==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE SUBSTRATE 22-APR-13 4KA7 . COMPND 2 MOLECULE: OLIGOPEPTIDASE A; . SOURCE 2 ORGANISM_SCIENTIFIC: ARABIDOPSIS THALIANA; . AUTHOR R.P.-A.BERNTSSON,B.KMIEC,P.F.TEIXEIRA,L.M.SVENSSON,A.BAKALI, . 699 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29556.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 501 71.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 32 4.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 1 0.1 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 . 18 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 90 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 322 46.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 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 2 0 2 2 0 2 1 1 3 2 0 0 2 1 2 1 0 0 2 0 1 0 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 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 PARALLEL BRIDGES PER LADDER . 4 0 1 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 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 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 91 A S 0 0 141 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 143.4 -9.6 -14.9 -16.7 2 92 A D + 0 0 116 1,-0.1 2,-0.4 0, 0.0 0, 0.0 0.385 360.0 84.8 62.9 -1.3 -9.3 -18.6 -17.8 3 93 A E S S- 0 0 151 3,-0.0 2,-0.1 0, 0.0 -1,-0.1 -0.968 82.0-110.5-124.9 149.3 -12.9 -19.5 -16.7 4 94 A T > - 0 0 88 -2,-0.4 3,-0.9 1,-0.1 4,-0.2 -0.389 18.7-125.2 -72.4 151.3 -16.1 -19.0 -18.6 5 95 A L G > S+ 0 0 96 1,-0.2 3,-2.2 2,-0.2 6,-0.2 0.902 113.5 62.5 -55.3 -43.2 -18.7 -16.4 -17.6 6 96 A S G 3 S+ 0 0 89 1,-0.3 -1,-0.2 3,-0.0 -2,-0.0 0.696 99.1 55.8 -58.6 -20.1 -21.2 -19.3 -17.6 7 97 A S G < S+ 0 0 39 -3,-0.9 -1,-0.3 5,-0.0 -2,-0.2 0.424 74.1 133.1 -91.7 -1.8 -19.1 -20.9 -14.8 8 98 A N X - 0 0 9 -3,-2.2 3,-2.1 -4,-0.2 4,-0.3 -0.280 62.1-131.1 -50.6 127.9 -19.3 -17.8 -12.5 9 99 A P G > S+ 0 0 18 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.805 104.7 61.2 -57.4 -30.7 -20.3 -19.1 -9.0 10 100 A L G 3 S+ 0 0 1 1,-0.2 -2,-0.1 16,-0.1 60,-0.1 0.646 102.7 52.1 -68.2 -17.2 -23.1 -16.5 -8.7 11 101 A L G < S+ 0 0 38 -3,-2.1 -1,-0.2 -6,-0.2 2,-0.1 0.389 91.2 99.3-100.5 -0.2 -24.8 -18.0 -11.7 12 102 A Q S < S- 0 0 82 -3,-1.1 2,-0.5 -4,-0.3 -5,-0.0 -0.451 78.7-111.0 -87.5 157.8 -24.9 -21.6 -10.6 13 103 A D + 0 0 156 -2,-0.1 2,-0.3 2,-0.0 -2,-0.1 -0.788 50.2 172.8 -77.7 126.8 -27.7 -23.7 -9.0 14 104 A F - 0 0 57 -2,-0.5 0, 0.0 1,-0.1 0, 0.0 -0.985 41.7-151.6-138.6 149.5 -26.6 -24.3 -5.5 15 105 A D S S+ 0 0 119 -2,-0.3 -1,-0.1 1,-0.3 377,-0.1 0.859 97.8 20.4 -78.7 -45.3 -28.0 -25.8 -2.3 16 106 A F S S- 0 0 34 375,-0.1 -1,-0.3 419,-0.0 420,-0.0 -0.970 102.6 -95.3-124.9 140.6 -25.8 -23.6 -0.1 17 107 A P - 0 0 1 0, 0.0 2,-2.3 0, 0.0 3,-0.2 -0.187 33.3-114.7 -60.3 148.2 -24.2 -20.4 -1.3 18 108 A P >> + 0 0 16 0, 0.0 3,-1.8 0, 0.0 4,-0.7 -0.347 53.9 155.6 -79.8 60.6 -20.6 -20.6 -2.6 19 109 A F T 34 + 0 0 3 -2,-2.3 375,-0.1 374,-0.3 373,-0.0 0.646 69.0 54.4 -62.2 -18.7 -19.2 -18.4 0.2 20 110 A D T 34 S+ 0 0 105 -3,-0.2 -1,-0.3 1,-0.1 374,-0.0 0.493 114.1 37.7 -92.1 -10.0 -15.7 -20.0 -0.2 21 111 A S T <4 S+ 0 0 56 -3,-1.8 2,-0.5 372,-0.0 -2,-0.2 0.345 92.8 93.7-128.0 4.7 -15.3 -19.3 -3.9 22 112 A V < + 0 0 16 -4,-0.7 2,-0.3 -13,-0.1 -14,-0.0 -0.882 43.9 153.9-104.1 128.7 -16.9 -15.9 -4.5 23 113 A D > - 0 0 86 -2,-0.5 3,-2.2 62,-0.0 4,-0.5 -0.835 59.7 -75.1-138.2-175.3 -14.9 -12.7 -4.5 24 114 A A G >> S+ 0 0 12 1,-0.3 3,-1.6 -2,-0.3 4,-0.7 0.809 121.6 64.1 -48.7 -39.3 -14.9 -9.2 -5.9 25 115 A S G 34 S+ 0 0 80 1,-0.3 -1,-0.3 2,-0.2 5,-0.1 0.705 100.5 52.1 -64.8 -20.1 -13.9 -10.3 -9.4 26 116 A H G <> S+ 0 0 42 -3,-2.2 4,-2.1 1,-0.1 5,-0.3 0.623 93.5 76.8 -86.2 -15.0 -17.1 -12.4 -9.8 27 117 A V H <> S+ 0 0 0 -3,-1.6 4,-2.7 -4,-0.5 5,-0.5 0.933 91.9 43.6 -72.4 -51.8 -19.5 -9.5 -8.9 28 118 A R H X S+ 0 0 82 -4,-0.7 4,-2.1 2,-0.2 5,-0.3 0.973 122.8 36.8 -59.3 -54.6 -19.5 -7.3 -12.0 29 119 A P H > S+ 0 0 57 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.922 121.0 47.4 -64.9 -42.1 -19.9 -10.2 -14.5 30 120 A G H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -3,-0.2 0.932 115.6 41.3 -66.7 -51.1 -22.1 -12.3 -12.3 31 121 A I H X S+ 0 0 0 -4,-2.7 4,-2.8 -5,-0.3 5,-0.2 0.922 116.6 49.4 -64.6 -42.6 -24.6 -9.6 -11.3 32 122 A R H X S+ 0 0 74 -4,-2.1 4,-1.7 -5,-0.5 -2,-0.2 0.911 113.8 45.3 -67.4 -38.2 -24.8 -8.1 -14.8 33 123 A A H X S+ 0 0 19 -4,-2.4 4,-1.8 -5,-0.3 -1,-0.2 0.921 113.1 51.5 -68.0 -41.0 -25.3 -11.5 -16.4 34 124 A L H X S+ 0 0 2 -4,-2.4 4,-2.6 -5,-0.2 5,-0.2 0.931 107.5 52.1 -61.8 -46.0 -27.9 -12.4 -13.7 35 125 A L H X S+ 0 0 13 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.875 106.7 53.2 -59.4 -39.9 -29.8 -9.1 -14.3 36 126 A Q H X S+ 0 0 142 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.898 111.3 47.1 -58.4 -41.8 -30.1 -9.8 -18.0 37 127 A H H X S+ 0 0 81 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.910 112.2 48.5 -68.2 -42.6 -31.5 -13.2 -17.3 38 128 A L H X S+ 0 0 3 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.842 107.7 56.3 -66.7 -34.3 -34.0 -11.8 -14.8 39 129 A E H X S+ 0 0 61 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.932 108.7 46.6 -59.0 -47.8 -35.1 -9.1 -17.2 40 130 A A H X S+ 0 0 51 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.877 112.3 50.7 -62.9 -38.2 -35.9 -11.8 -19.8 41 131 A E H X S+ 0 0 87 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.893 109.6 50.1 -67.4 -39.5 -37.8 -13.7 -17.1 42 132 A L H X S+ 0 0 0 -4,-2.5 4,-3.0 2,-0.2 5,-0.2 0.906 109.2 52.1 -63.3 -42.7 -39.8 -10.6 -16.1 43 133 A E H X S+ 0 0 118 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.931 110.8 47.6 -58.2 -44.2 -40.7 -10.0 -19.8 44 134 A E H X S+ 0 0 104 -4,-2.1 4,-1.4 2,-0.2 -2,-0.2 0.885 112.5 49.3 -64.8 -42.2 -41.9 -13.6 -20.1 45 135 A L H X S+ 0 0 8 -4,-2.4 4,-1.2 2,-0.2 3,-0.5 0.951 111.5 48.3 -60.6 -50.8 -43.9 -13.3 -16.9 46 136 A E H < S+ 0 0 35 -4,-3.0 3,-0.3 1,-0.2 -2,-0.2 0.866 110.9 51.9 -60.7 -36.9 -45.5 -10.0 -18.0 47 137 A K H < S+ 0 0 177 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.820 121.0 31.2 -68.4 -32.2 -46.4 -11.4 -21.4 48 138 A S H < S+ 0 0 51 -4,-1.4 -1,-0.2 -3,-0.5 -2,-0.2 0.386 86.7 145.4-107.3 1.5 -48.2 -14.5 -19.9 49 139 A V < + 0 0 37 -4,-1.2 7,-0.2 -3,-0.3 -3,-0.1 -0.079 15.2 165.6 -55.5 132.6 -49.5 -13.0 -16.7 50 140 A E - 0 0 89 5,-0.4 2,-2.2 2,-0.2 5,-0.1 -0.943 50.7-101.2-136.5 156.3 -52.9 -14.2 -15.3 51 141 A P S S+ 0 0 70 0, 0.0 2,-0.3 0, 0.0 -2,-0.0 -0.358 89.5 97.5 -78.8 62.0 -54.4 -13.7 -11.8 52 142 A T S >>S- 0 0 54 -2,-2.2 4,-1.2 1,-0.1 5,-0.9 -0.911 84.6-108.6-138.8 164.6 -53.4 -17.2 -10.7 53 143 A W T >4>S+ 0 0 23 -2,-0.3 5,-2.9 3,-0.2 3,-0.6 0.958 116.0 46.6 -62.4 -50.5 -50.6 -18.8 -8.7 54 144 A P T 345S+ 0 0 79 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 0.798 120.3 39.4 -64.2 -27.4 -48.9 -20.6 -11.6 55 145 A K T 345S+ 0 0 84 3,-0.1 -5,-0.4 -5,-0.1 -2,-0.2 0.507 134.9 8.4-100.5 -7.5 -49.1 -17.5 -13.9 56 146 A L T S+ 0 0 34 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.854 114.6 54.0 -61.4 -29.7 -42.9 -17.0 -11.6 60 150 A L H X S+ 0 0 4 -4,-1.9 4,-2.9 2,-0.2 5,-0.3 0.943 106.9 49.3 -66.0 -48.3 -42.7 -13.8 -9.5 61 151 A E H X S+ 0 0 0 -4,-2.6 4,-3.5 1,-0.2 5,-0.3 0.894 106.4 57.2 -57.1 -39.3 -41.2 -15.7 -6.5 62 152 A K H X S+ 0 0 117 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.907 112.2 41.4 -60.9 -40.1 -38.6 -17.3 -8.8 63 153 A I H X S+ 0 0 5 -4,-1.5 4,-1.9 2,-0.2 5,-0.2 0.958 118.4 44.9 -67.9 -53.5 -37.4 -13.9 -10.0 64 154 A V H X S+ 0 0 37 -4,-2.9 4,-2.6 1,-0.2 5,-0.2 0.906 112.9 52.5 -58.2 -43.5 -37.5 -12.3 -6.5 65 155 A D H X S+ 0 0 6 -4,-3.5 4,-2.7 -5,-0.3 5,-0.3 0.911 107.0 50.1 -63.1 -46.7 -35.8 -15.4 -4.9 66 156 A R H X S+ 0 0 63 -4,-1.7 4,-2.2 -5,-0.3 5,-0.3 0.927 115.0 43.2 -60.3 -46.0 -32.9 -15.5 -7.3 67 157 A L H X S+ 0 0 11 -4,-1.9 4,-2.6 1,-0.2 5,-0.5 0.913 115.0 49.7 -64.9 -44.0 -32.0 -11.8 -6.8 68 158 A T H X S+ 0 0 55 -4,-2.6 4,-1.7 -5,-0.2 -2,-0.2 0.904 114.0 45.0 -62.5 -43.0 -32.6 -11.9 -3.1 69 159 A V H X S+ 0 0 10 -4,-2.7 4,-2.0 -5,-0.2 -2,-0.2 0.936 119.1 39.8 -68.9 -46.2 -30.3 -15.0 -2.6 70 160 A V H X S+ 0 0 3 -4,-2.2 4,-1.8 -5,-0.3 -2,-0.2 0.941 120.9 41.8 -72.5 -48.9 -27.5 -13.8 -4.9 71 161 A W H X S+ 0 0 19 -4,-2.6 4,-2.8 -5,-0.3 5,-0.2 0.888 113.3 57.3 -63.5 -37.3 -27.5 -10.2 -3.8 72 162 A G H X S+ 0 0 24 -4,-1.7 4,-2.3 -5,-0.5 -2,-0.2 0.911 105.5 48.3 -58.5 -43.5 -27.9 -11.3 -0.2 73 163 A M H X S+ 0 0 5 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.899 112.8 48.4 -69.0 -36.9 -24.8 -13.5 -0.3 74 164 A I H X S+ 0 0 1 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.909 113.0 47.0 -64.8 -45.6 -22.8 -10.6 -1.8 75 165 A N H X S+ 0 0 57 -4,-2.8 4,-1.7 2,-0.2 -2,-0.2 0.852 110.6 53.3 -68.3 -32.1 -24.1 -8.1 0.8 76 166 A H H X S+ 0 0 3 -4,-2.3 4,-1.7 -5,-0.2 5,-0.3 0.929 108.2 49.4 -63.9 -47.2 -23.3 -10.7 3.5 77 167 A L H X S+ 0 0 8 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.878 108.5 54.3 -60.4 -35.2 -19.8 -11.0 2.3 78 168 A K H < S+ 0 0 19 -4,-2.1 4,-0.3 1,-0.2 -1,-0.2 0.890 110.8 46.9 -62.1 -38.2 -19.5 -7.2 2.3 79 169 A A H < S+ 0 0 15 -4,-1.7 348,-3.0 1,-0.2 -2,-0.2 0.744 127.1 24.1 -76.7 -27.7 -20.7 -7.2 6.0 80 170 A V H < S+ 0 0 0 -4,-1.7 -2,-0.2 346,-0.2 -3,-0.2 0.509 134.4 28.6-116.0 -9.9 -18.3 -10.0 7.2 81 171 A K S < S+ 0 0 82 -4,-2.4 345,-0.2 -5,-0.3 -2,-0.2 -0.287 76.9 178.7-150.9 50.8 -15.4 -9.9 4.7 82 172 A D + 0 0 15 343,-2.6 -4,-0.1 -4,-0.3 3,-0.1 -0.284 3.7 170.8 -59.5 137.2 -15.2 -6.3 3.4 83 173 A T > - 0 0 47 1,-0.1 4,-2.3 342,-0.0 5,-0.2 -0.968 45.1-116.7-138.9 159.4 -12.4 -5.5 0.9 84 174 A P H > S+ 0 0 99 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.907 118.2 52.4 -57.4 -40.7 -11.7 -2.4 -1.2 85 175 A E H > S+ 0 0 121 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.875 109.0 48.6 -65.9 -37.5 -12.2 -4.5 -4.3 86 176 A L H > S+ 0 0 10 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.901 110.0 52.3 -70.6 -39.5 -15.6 -5.8 -3.1 87 177 A R H X S+ 0 0 38 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.923 111.0 46.8 -55.8 -50.5 -16.7 -2.2 -2.2 88 178 A A H X S+ 0 0 38 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.879 112.3 50.2 -61.3 -41.1 -15.8 -1.0 -5.7 89 179 A A H X S+ 0 0 0 -4,-1.9 4,-1.5 2,-0.2 -2,-0.2 0.920 112.3 45.9 -67.6 -44.0 -17.6 -3.9 -7.4 90 180 A I H X S+ 0 0 1 -4,-2.4 4,-2.2 1,-0.2 3,-0.3 0.922 112.6 51.2 -64.2 -44.7 -20.8 -3.5 -5.4 91 181 A E H < S+ 0 0 124 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.899 108.5 53.5 -57.2 -42.2 -20.8 0.3 -6.0 92 182 A D H < S+ 0 0 75 -4,-2.2 -1,-0.2 1,-0.2 4,-0.2 0.811 120.4 29.4 -63.1 -35.9 -20.3 -0.4 -9.7 93 183 A V H X S+ 0 0 0 -4,-1.5 4,-2.2 -3,-0.3 3,-0.4 0.581 95.2 89.8-102.1 -13.5 -23.4 -2.7 -10.0 94 184 A Q H X S+ 0 0 11 -4,-2.2 4,-3.0 1,-0.2 5,-0.2 0.890 86.5 51.8 -57.8 -43.8 -25.7 -1.4 -7.3 95 185 A P H > S+ 0 0 62 0, 0.0 4,-2.8 0, 0.0 -1,-0.2 0.875 110.5 49.0 -59.6 -38.3 -27.4 1.2 -9.6 96 186 A E H > S+ 0 0 80 -3,-0.4 4,-1.8 -4,-0.2 -2,-0.2 0.883 112.8 47.8 -65.3 -40.7 -28.2 -1.6 -12.2 97 187 A K H X S+ 0 0 11 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.927 113.8 46.6 -65.3 -44.8 -29.5 -3.8 -9.4 98 188 A V H X S+ 0 0 3 -4,-3.0 4,-2.6 1,-0.2 5,-0.2 0.925 108.9 55.3 -66.1 -42.6 -31.7 -1.0 -8.0 99 189 A K H X S+ 0 0 146 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.897 110.1 47.0 -54.9 -41.3 -32.9 -0.1 -11.5 100 190 A F H X S+ 0 0 2 -4,-1.8 4,-3.0 2,-0.2 5,-0.2 0.912 108.8 53.3 -68.8 -43.0 -34.1 -3.7 -11.9 101 191 A Q H X S+ 0 0 70 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.892 111.8 46.8 -56.9 -41.3 -35.8 -3.7 -8.4 102 192 A L H X S+ 0 0 7 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.915 111.7 50.4 -65.7 -43.8 -37.7 -0.6 -9.4 103 193 A R H < S+ 0 0 82 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.938 115.4 43.1 -57.9 -49.6 -38.6 -2.1 -12.8 104 194 A L H >< S+ 0 0 23 -4,-3.0 3,-1.4 1,-0.2 -2,-0.2 0.930 116.0 46.7 -62.2 -48.9 -39.9 -5.2 -11.1 105 195 A G H 3< S+ 0 0 26 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.804 113.0 50.0 -66.8 -30.3 -41.7 -3.4 -8.3 106 196 A Q T 3< S+ 0 0 14 -4,-2.3 2,-0.5 -5,-0.2 -1,-0.3 0.224 77.4 138.0 -94.1 13.8 -43.3 -1.0 -10.7 107 197 A S <> - 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0 0 70 -5,-2.8 -1,-0.3 -6,-0.2 3,-0.1 -0.671 63.8-128.4-104.4 164.2 -47.7 11.7 2.9 282 372 A N S S- 0 0 128 -2,-0.2 2,-0.3 1,-0.2 -5,-0.1 0.799 85.1 -6.1 -79.5 -32.8 -46.7 14.6 5.3 283 373 A N S > S- 0 0 22 -7,-0.2 4,-1.0 1,-0.1 3,-0.5 -0.951 75.0 -96.1-156.2 170.7 -43.3 13.1 6.4 284 374 A Y H > S+ 0 0 41 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.829 114.8 65.3 -66.9 -32.1 -41.2 9.9 6.1 285 375 A A H > S+ 0 0 0 289,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.898 100.1 52.8 -56.5 -39.1 -42.5 8.5 9.5 286 376 A E H > S+ 0 0 60 -3,-0.5 4,-0.9 288,-0.3 -1,-0.2 0.884 108.9 49.5 -62.8 -38.7 -45.9 8.2 7.9 287 377 A V H >< S+ 0 0 12 -4,-1.0 3,-1.0 2,-0.2 4,-0.5 0.954 111.6 48.9 -62.0 -50.1 -44.4 6.3 5.0 288 378 A S H >< S+ 0 0 9 -4,-2.8 3,-1.1 1,-0.2 -2,-0.2 0.887 108.2 54.4 -54.9 -44.4 -42.5 4.0 7.4 289 379 A M H >< S+ 0 0 14 -4,-2.6 3,-1.9 1,-0.2 -1,-0.2 0.682 86.8 80.8 -67.5 -20.1 -45.8 3.4 9.4 290 380 A A T << S+ 0 0 20 -3,-1.0 -1,-0.2 -4,-0.9 -2,-0.2 0.840 102.0 36.9 -55.8 -34.0 -47.7 2.2 6.3 291 381 A M T < S+ 0 0 57 -3,-1.1 216,-0.6 -4,-0.5 2,-0.3 0.187 109.0 83.8-103.5 14.8 -46.0 -1.2 6.7 292 382 A K S < S- 0 0 31 -3,-1.9 214,-0.0 2,-0.3 330,-0.0 -0.811 79.0-124.5-117.7 158.8 -46.1 -1.3 10.6 293 383 A M S S+ 0 0 55 -2,-0.3 -1,-0.1 2,-0.0 -4,-0.1 0.863 94.4 66.7 -58.7 -40.2 -48.6 -2.2 13.3 294 384 A A - 0 0 5 4,-0.1 2,-0.3 3,-0.0 -2,-0.3 -0.126 69.1-147.0 -78.1 172.1 -48.1 1.2 14.8 295 385 A T > - 0 0 66 1,-0.1 4,-2.8 -5,-0.0 5,-0.3 -0.837 39.0-100.9-122.8 170.3 -49.0 4.7 13.7 296 386 A V H > S+ 0 0 43 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.939 125.4 48.9 -55.7 -46.3 -46.9 7.8 14.5 297 387 A E H > S+ 0 0 149 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.911 113.6 44.8 -58.7 -47.5 -49.4 8.7 17.2 298 388 A K H > S+ 0 0 101 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.862 113.2 50.2 -69.8 -37.0 -49.4 5.2 18.7 299 389 A A H X S+ 0 0 0 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.937 112.0 48.0 -64.9 -45.7 -45.6 4.8 18.6 300 390 A A H X S+ 0 0 46 -4,-2.6 4,-2.4 -5,-0.3 -2,-0.2 0.872 110.0 53.7 -61.6 -37.9 -45.2 8.2 20.3 301 391 A E H X S+ 0 0 119 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.921 109.1 47.0 -62.6 -46.3 -47.8 7.2 23.0 302 392 A L H X S+ 0 0 23 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.928 112.6 49.9 -62.6 -46.8 -46.0 4.0 23.9 303 393 A L H X S+ 0 0 6 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.909 111.9 47.8 -58.0 -45.0 -42.6 5.8 24.1 304 394 A E H X S+ 0 0 75 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.906 111.3 51.0 -66.0 -40.5 -44.1 8.5 26.3 305 395 A K H X S+ 0 0 107 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.929 115.1 42.2 -57.5 -48.3 -45.7 5.8 28.6 306 396 A L H X S+ 0 0 4 -4,-2.7 4,-1.0 2,-0.2 -2,-0.2 0.880 113.8 52.8 -68.4 -37.4 -42.4 3.9 28.9 307 397 A R H >X S+ 0 0 34 -4,-2.7 4,-1.9 -5,-0.2 3,-0.7 0.930 109.0 49.2 -62.1 -46.7 -40.5 7.2 29.4 308 398 A S H 3< S+ 0 0 67 -4,-2.7 4,-0.5 1,-0.2 -1,-0.2 0.870 112.1 48.9 -60.9 -37.5 -42.9 8.3 32.2 309 399 A A H 3< S+ 0 0 35 -4,-1.7 -1,-0.2 -5,-0.2 4,-0.2 0.675 117.3 42.0 -73.7 -19.0 -42.4 4.9 33.9 310 400 A S H S+ 0 0 126 -4,-0.5 4,-2.4 1,-0.2 -1,-0.2 0.882 114.6 50.7 -61.4 -39.5 -37.8 8.7 38.3 313 403 A A H > S+ 0 0 30 -4,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.899 109.8 50.8 -62.9 -42.6 -35.8 5.4 38.3 314 404 A A H X S+ 0 0 1 -4,-2.3 4,-1.8 243,-0.3 -2,-0.2 0.866 109.9 49.5 -64.1 -39.4 -33.2 7.0 35.9 315 405 A V H X S+ 0 0 44 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.932 111.8 48.7 -63.9 -44.9 -32.9 10.1 38.2 316 406 A Q H X S+ 0 0 105 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.888 107.5 55.5 -63.5 -39.2 -32.4 7.8 41.2 317 407 A D H X S+ 0 0 19 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.905 108.1 49.3 -54.4 -45.8 -29.8 5.8 39.3 318 408 A M H X S+ 0 0 58 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.926 112.0 47.2 -62.9 -44.8 -27.9 9.0 38.7 319 409 A E H X S+ 0 0 80 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.882 109.0 55.6 -65.1 -37.0 -28.1 9.9 42.4 320 410 A D H X S+ 0 0 56 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.879 107.7 48.8 -60.3 -41.6 -27.0 6.4 43.3 321 411 A L H X S+ 0 0 9 -4,-2.0 4,-2.7 2,-0.2 5,-0.2 0.907 111.9 48.7 -65.7 -43.1 -23.8 6.8 41.2 322 412 A K H X S+ 0 0 90 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.933 112.2 48.4 -62.1 -48.4 -23.0 10.1 42.7 323 413 A S H X S+ 0 0 65 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.905 113.9 46.7 -55.9 -48.4 -23.5 8.8 46.2 324 414 A F H X S+ 0 0 31 -4,-2.3 4,-0.8 2,-0.2 -2,-0.2 0.937 113.4 46.6 -63.2 -49.9 -21.3 5.7 45.6 325 415 A A H ><>S+ 0 0 0 -4,-2.7 5,-2.2 1,-0.2 3,-1.0 0.925 113.1 50.9 -58.5 -44.6 -18.5 7.7 43.9 326 416 A K H ><5S+ 0 0 88 -4,-2.7 3,-1.8 1,-0.3 -1,-0.2 0.892 105.9 54.6 -59.9 -41.2 -18.6 10.3 46.7 327 417 A N H 3<5S+ 0 0 134 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.628 104.9 55.4 -69.7 -14.7 -18.4 7.5 49.4 328 418 A Q T <<5S- 0 0 117 -3,-1.0 -1,-0.3 -4,-0.8 -2,-0.2 0.366 118.8-113.7 -92.1 1.8 -15.2 6.3 47.6 329 419 A G T < 5 + 0 0 66 -3,-1.8 2,-0.3 1,-0.2 -3,-0.2 0.678 55.9 169.1 72.6 20.9 -13.7 9.8 47.9 330 420 A A > < - 0 0 13 -5,-2.2 3,-1.8 -6,-0.2 4,-0.2 -0.500 33.2-148.6 -74.0 123.8 -13.8 10.3 44.1 331 421 A A G > S+ 0 0 87 -2,-0.3 3,-1.1 1,-0.3 -1,-0.1 0.847 96.1 59.8 -60.2 -34.9 -13.0 13.9 43.2 332 422 A E G > S+ 0 0 27 1,-0.2 3,-1.7 2,-0.2 -1,-0.3 0.517 77.6 91.1 -73.9 -4.3 -15.3 13.6 40.1 333 423 A S G < S+ 0 0 7 -3,-1.8 3,-0.4 1,-0.3 -1,-0.2 0.769 84.3 55.1 -62.0 -23.8 -18.3 12.8 42.3 334 424 A D G < S+ 0 0 129 -3,-1.1 -1,-0.3 -4,-0.2 -2,-0.2 0.603 123.8 24.0 -80.4 -12.8 -19.0 16.6 42.4 335 425 A S S < S- 0 0 69 -3,-1.7 -1,-0.2 -4,-0.1 -2,-0.2 -0.303 79.1-174.2-152.6 55.7 -19.0 16.7 38.6 336 426 A M - 0 0 49 -3,-0.4 2,-0.2 4,-0.1 -3,-0.1 -0.326 11.1-170.8 -63.2 133.6 -19.9 13.3 37.1 337 427 A T >> - 0 0 32 -2,-0.0 3,-2.1 262,-0.0 4,-0.9 -0.677 40.6 -91.6-120.5 174.5 -19.6 13.3 33.3 338 428 A H T 34 S+ 0 0 40 1,-0.3 4,-0.5 -2,-0.2 3,-0.2 0.747 123.9 57.6 -61.1 -25.2 -20.6 10.8 30.5 339 429 A W T 34 S+ 0 0 21 1,-0.2 -1,-0.3 2,-0.1 4,-0.1 0.360 105.8 51.3 -87.8 7.1 -17.1 9.2 30.7 340 430 A D T <> S+ 0 0 0 -3,-2.1 4,-2.6 3,-0.1 5,-0.3 0.587 90.2 80.1-105.9 -20.8 -17.6 8.4 34.4 341 431 A T H X S+ 0 0 35 -4,-0.9 4,-2.2 1,-0.2 5,-0.2 0.903 94.3 40.9 -59.6 -53.4 -21.0 6.7 34.1 342 432 A T H > S+ 0 0 52 -4,-0.5 4,-2.0 2,-0.2 -1,-0.2 0.889 116.3 51.1 -66.4 -41.1 -20.0 3.2 32.9 343 433 A F H > S+ 0 0 13 -109,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.958 115.1 39.5 -59.3 -56.4 -17.0 3.1 35.3 344 434 A W H X S+ 0 0 21 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.820 111.5 58.6 -71.2 -27.6 -18.9 4.0 38.4 345 435 A S H X S+ 0 0 13 -4,-2.2 4,-2.7 -5,-0.3 -1,-0.2 0.915 108.8 46.1 -62.1 -43.1 -21.9 1.9 37.4 346 436 A E H X S+ 0 0 15 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.905 111.9 49.7 -67.7 -42.6 -19.6 -1.1 37.3 347 437 A R H X S+ 0 0 42 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.920 113.8 47.1 -59.1 -44.2 -18.0 -0.2 40.7 348 438 A L H X S+ 0 0 22 -4,-2.6 4,-3.2 2,-0.2 5,-0.3 0.925 111.3 50.5 -62.9 -46.4 -21.5 0.1 42.1 349 439 A R H X S+ 0 0 39 -4,-2.7 4,-2.3 1,-0.2 6,-0.5 0.910 111.5 48.7 -57.8 -46.1 -22.7 -3.2 40.6 350 440 A E H X S+ 0 0 43 -4,-2.6 4,-1.3 2,-0.2 -1,-0.2 0.913 117.3 41.1 -59.5 -46.1 -19.6 -5.0 42.0 351 441 A S H < S+ 0 0 79 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.928 118.7 43.6 -70.2 -46.4 -20.1 -3.5 45.5 352 442 A K H < S+ 0 0 125 -4,-3.2 -2,-0.2 1,-0.2 -3,-0.2 0.876 129.7 22.9 -71.3 -40.9 -23.9 -3.8 45.7 353 443 A Y H < S- 0 0 29 -4,-2.3 -1,-0.2 -5,-0.3 -3,-0.2 0.522 94.8-129.6-106.9 -8.0 -24.3 -7.3 44.3 354 444 A D < + 0 0 111 -4,-1.3 2,-0.4 -5,-0.4 -4,-0.2 0.859 62.5 132.7 59.6 38.6 -20.8 -8.8 45.0 355 445 A I - 0 0 8 -6,-0.5 2,-0.5 -5,-0.2 -1,-0.2 -0.988 40.4-162.4-122.4 131.5 -20.4 -10.0 41.4 356 446 A N >> - 0 0 55 -2,-0.4 4,-1.1 1,-0.1 3,-0.6 -0.960 13.5-147.8-114.6 118.5 -17.3 -9.4 39.3 357 447 A E H >> S+ 0 0 28 -2,-0.5 4,-1.7 1,-0.2 3,-0.5 0.846 97.7 56.7 -52.5 -42.8 -17.6 -9.8 35.5 358 448 A E H 34 S+ 0 0 44 1,-0.2 -1,-0.2 2,-0.2 3,-0.0 0.874 106.7 49.8 -58.7 -40.6 -14.0 -11.0 35.1 359 449 A E H <4 S+ 0 0 142 -3,-0.6 -1,-0.2 1,-0.2 -2,-0.2 0.698 109.7 52.1 -72.3 -22.3 -14.7 -13.9 37.6 360 450 A L H X< S+ 0 0 16 -4,-1.1 3,-2.3 -3,-0.5 4,-0.5 0.795 89.1 80.7 -81.2 -31.2 -17.9 -14.9 35.8 361 451 A R G >< S+ 0 0 18 -4,-1.7 3,-1.8 1,-0.3 110,-0.6 0.806 82.8 60.3 -47.5 -43.6 -16.2 -15.1 32.4 362 452 A P G 3 S+ 0 0 26 0, 0.0 172,-2.0 0, 0.0 -1,-0.3 0.731 103.1 55.0 -60.6 -20.0 -14.7 -18.6 32.9 363 453 A Y G < S+ 0 0 48 -3,-2.3 169,-0.7 170,-0.2 2,-0.4 0.561 100.8 61.6 -86.5 -11.1 -18.3 -19.9 33.4 364 454 A F < + 0 0 0 -3,-1.8 107,-2.8 -4,-0.5 2,-0.3 -0.596 63.8 160.1-119.1 71.4 -19.5 -18.6 30.1 365 455 A S B >> -B 470 0B 4 -2,-0.4 4,-2.3 167,-0.4 3,-0.5 -0.723 46.2-121.4 -91.1 143.9 -17.6 -20.3 27.3 366 456 A L H 3> S+ 0 0 1 103,-2.2 4,-2.9 -2,-0.3 5,-0.2 0.860 108.5 53.7 -53.4 -44.4 -19.1 -20.2 23.8 367 457 A P H 3> S+ 0 0 63 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.910 113.5 43.1 -60.3 -39.8 -19.3 -24.0 23.3 368 458 A K H <> S+ 0 0 63 -3,-0.5 4,-2.5 2,-0.2 -2,-0.2 0.836 112.3 54.2 -71.1 -34.6 -21.2 -24.5 26.6 369 459 A V H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.943 110.5 46.1 -63.1 -47.4 -23.4 -21.5 25.9 370 460 A M H X S+ 0 0 6 -4,-2.9 4,-2.7 2,-0.2 5,-0.2 0.929 111.3 52.2 -63.0 -44.3 -24.4 -23.1 22.5 371 461 A D H X S+ 0 0 102 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.2 0.929 112.8 45.0 -55.0 -48.0 -24.9 -26.5 24.1 372 462 A G H X S+ 0 0 4 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.887 111.9 51.8 -64.1 -41.4 -27.3 -24.9 26.7 373 463 A L H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.913 111.2 47.3 -61.9 -42.3 -29.1 -22.9 24.1 374 464 A F H X S+ 0 0 21 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.883 109.9 53.3 -68.9 -37.2 -29.7 -26.0 22.0 375 465 A S H X S+ 0 0 65 -4,-2.2 4,-2.3 -5,-0.2 -2,-0.2 0.927 109.7 48.3 -60.8 -45.6 -30.9 -27.9 25.0 376 466 A L H X S+ 0 0 9 -4,-2.5 4,-3.1 2,-0.2 5,-0.3 0.922 109.4 52.9 -57.9 -44.7 -33.4 -25.1 25.8 377 467 A A H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 6,-0.9 0.856 109.2 49.9 -62.4 -36.1 -34.5 -25.1 22.1 378 468 A K H X S+ 0 0 95 -4,-2.1 4,-1.7 4,-0.2 -1,-0.2 0.933 113.0 46.4 -65.0 -46.5 -35.1 -28.9 22.4 379 469 A T H < S+ 0 0 41 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.951 123.2 33.1 -61.9 -50.2 -37.2 -28.4 25.6 380 470 A L H < S+ 0 0 3 -4,-3.1 279,-0.3 -5,-0.1 -2,-0.2 0.913 135.6 18.5 -73.2 -43.3 -39.3 -25.5 24.3 381 471 A F H < S- 0 0 12 -4,-2.4 -3,-0.2 -5,-0.3 -2,-0.2 0.397 92.6-119.4-122.2 -1.6 -39.6 -26.4 20.6 382 472 A G < + 0 0 35 -4,-1.7 2,-0.3 -5,-0.3 -4,-0.2 0.669 65.3 135.0 71.9 20.3 -38.8 -30.1 20.1 383 473 A I - 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0 0 16 -3,-1.7 -1,-0.3 165,-0.1 5,-0.2 -0.826 67.3-106.3 -82.9 119.1 -43.9 -9.6 9.4 506 596 A E >> - 0 0 41 -2,-0.7 3,-2.8 1,-0.1 4,-0.5 -0.192 32.1-119.6 -41.8 130.2 -44.7 -5.9 10.2 507 597 A W G >4 S+ 0 0 64 -216,-0.6 3,-1.0 1,-0.3 4,-0.4 0.779 110.1 62.3 -57.5 -31.8 -41.3 -4.5 11.3 508 598 A D G 34 S+ 0 0 0 1,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.453 106.3 47.7 -77.1 3.5 -42.5 -3.6 14.8 509 599 A A G X4 S+ 0 0 4 -3,-2.8 3,-1.6 -4,-0.1 -1,-0.2 0.467 87.2 84.6-110.2 -8.8 -43.2 -7.3 15.5 510 600 A V T << S+ 0 0 1 -3,-1.0 4,-0.5 -4,-0.5 -2,-0.1 0.748 83.6 60.1 -72.0 -19.8 -39.9 -8.7 14.2 511 601 A E T 3> S+ 0 0 0 -4,-0.4 4,-1.4 114,-0.3 -1,-0.3 0.275 83.2 91.0 -88.9 12.8 -38.1 -8.1 17.5 512 602 A L H <> S+ 0 0 10 -3,-1.6 4,-2.6 2,-0.2 5,-0.2 0.988 88.5 36.4 -68.4 -62.2 -40.6 -10.4 19.4 513 603 A P H > S+ 0 0 1 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.844 118.1 52.8 -68.0 -28.6 -38.9 -13.8 19.2 514 604 A S H > S+ 0 0 0 -4,-0.5 4,-1.1 -30,-0.2 -30,-0.2 0.961 114.6 38.7 -66.3 -53.6 -35.4 -12.4 19.6 515 605 A Q H X S+ 0 0 21 -4,-1.4 4,-0.7 1,-0.2 3,-0.2 0.857 111.6 61.7 -67.3 -33.2 -36.1 -10.4 22.7 516 606 A F H >< S+ 0 0 0 -4,-2.6 3,-1.2 1,-0.2 4,-0.4 0.929 100.4 53.1 -53.5 -48.1 -38.3 -13.3 23.9 517 607 A M H >< S+ 0 0 2 -4,-1.8 3,-1.5 1,-0.3 4,-0.3 0.829 96.0 68.2 -61.2 -32.7 -35.3 -15.6 23.9 518 608 A E H >< S+ 0 0 33 -4,-1.1 3,-1.4 1,-0.3 4,-0.3 0.791 87.1 68.2 -59.3 -29.0 -33.3 -13.3 26.1 519 609 A N G X< S+ 0 0 14 -3,-1.2 3,-1.5 -4,-0.7 -1,-0.3 0.813 88.4 65.4 -58.8 -30.0 -35.6 -13.9 29.1 520 610 A W G X S+ 0 0 0 -3,-1.5 3,-1.2 -4,-0.4 7,-0.3 0.665 79.8 79.1 -74.8 -13.8 -34.3 -17.5 29.3 521 611 A C G < S+ 0 0 2 -3,-1.4 -1,-0.3 -4,-0.3 -2,-0.2 0.741 99.3 44.0 -61.1 -22.2 -30.8 -16.4 30.3 522 612 A Y G < S+ 0 0 27 -3,-1.5 2,-0.5 -4,-0.3 -1,-0.3 0.425 84.8 111.3-101.7 -3.8 -32.3 -15.8 33.8 523 613 A H S X> S- 0 0 31 -3,-1.2 4,-2.8 -4,-0.2 3,-0.6 -0.639 70.5-135.2 -74.9 121.2 -34.2 -19.1 33.9 524 614 A R H 3> S+ 0 0 104 -2,-0.5 4,-2.9 1,-0.3 5,-0.3 0.866 99.8 47.1 -50.5 -52.4 -32.4 -21.2 36.5 525 615 A D H 3> S+ 0 0 113 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.871 116.4 46.2 -58.2 -36.7 -32.2 -24.5 34.6 526 616 A T H <> S+ 0 0 8 -3,-0.6 4,-1.4 2,-0.2 -2,-0.2 0.961 114.2 45.3 -71.8 -50.8 -31.0 -22.7 31.5 527 617 A L H X S+ 0 0 4 -4,-2.8 4,-2.8 -7,-0.3 3,-0.4 0.919 114.7 49.0 -59.2 -44.9 -28.4 -20.6 33.2 528 618 A M H < S+ 0 0 19 -4,-2.9 -1,-0.2 -5,-0.3 12,-0.2 0.810 106.5 56.1 -66.8 -30.1 -27.1 -23.6 35.2 529 619 A S H < S+ 0 0 41 -4,-1.4 -1,-0.2 -5,-0.3 -2,-0.2 0.814 117.0 36.7 -69.4 -31.0 -26.9 -25.8 32.1 530 620 A I H < S+ 0 0 3 -4,-1.4 2,-2.1 -3,-0.4 -165,-0.3 0.859 97.9 81.5 -85.1 -41.4 -24.7 -23.1 30.5 531 621 A A < + 0 0 0 -4,-2.8 9,-2.7 -5,-0.2 2,-0.4 -0.430 55.3 135.9 -82.4 75.5 -22.6 -21.9 33.5 532 622 A K B -I 539 0E 52 -2,-2.1 -167,-0.4 -169,-0.7 7,-0.2 -0.984 63.0-104.0-119.2 130.5 -19.9 -24.6 33.8 533 623 A H > - 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