==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 02-JUN-04 1TJ0 . COMPND 2 MOLECULE: BIFUNCTIONAL PUTA PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR J.J.TANNER,M.ZHANG,T.A.WHITE,J.P.SCHUERMANN,B.A.BABAN,D.F.BE . 468 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21845.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 337 72.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 43 9.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 18 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 203 43.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 4 1 1 0 0 2 1 1 5 1 1 1 1 0 0 1 0 0 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 4 1 2 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 PARALLEL BRIDGES PER LADDER . 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 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 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 89 A S > 0 0 100 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 172.5 12.5 21.3 61.0 2 90 A V H > + 0 0 136 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.944 360.0 44.2 -57.5 -47.8 8.8 20.7 60.4 3 91 A S H > S+ 0 0 18 1,-0.2 4,-1.5 2,-0.2 272,-0.2 0.906 113.3 50.5 -69.8 -39.3 8.1 24.4 59.6 4 92 A R H > S+ 0 0 35 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.846 109.5 49.7 -64.4 -39.1 11.2 24.8 57.4 5 93 A A H X S+ 0 0 60 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.819 107.0 55.3 -66.9 -37.1 10.4 21.7 55.2 6 94 A A H X S+ 0 0 37 -4,-1.5 4,-1.2 -5,-0.2 -2,-0.2 0.880 107.7 50.7 -67.7 -34.2 6.8 22.9 54.8 7 95 A I H >X S+ 0 0 0 -4,-1.5 3,-0.9 264,-0.2 4,-0.8 0.971 110.5 48.0 -61.5 -57.2 8.2 26.2 53.4 8 96 A T H >< S+ 0 0 77 -4,-2.1 3,-1.1 1,-0.2 4,-0.2 0.896 109.9 53.4 -48.8 -42.9 10.5 24.4 51.0 9 97 A A H 3< S+ 0 0 72 -4,-2.4 -1,-0.2 1,-0.3 3,-0.2 0.745 108.6 49.1 -73.1 -23.4 7.6 22.2 49.8 10 98 A A H X< S+ 0 0 0 -4,-1.2 3,-1.8 -3,-0.9 -1,-0.3 0.547 77.5 113.8 -89.0 -7.6 5.4 25.2 49.0 11 99 A Y T << S+ 0 0 46 -3,-1.1 256,-0.4 -4,-0.8 257,-0.3 0.771 97.7 0.1 -32.2 -60.2 8.1 27.0 47.0 12 100 A R T 3 S+ 0 0 60 -4,-0.2 -1,-0.3 -3,-0.2 300,-0.1 -0.161 85.9 166.1-129.2 41.6 6.4 26.8 43.6 13 101 A R < - 0 0 51 -3,-1.8 299,-0.1 1,-0.1 5,-0.1 -0.251 50.5 -84.9 -62.2 145.8 3.1 25.0 44.3 14 102 A P > - 0 0 79 0, 0.0 4,-2.2 0, 0.0 5,-0.1 -0.184 35.5-127.6 -49.3 142.2 0.5 25.2 41.5 15 103 A E H > S+ 0 0 9 1,-0.2 4,-2.6 2,-0.2 5,-0.4 0.821 106.2 58.0 -67.3 -37.7 -1.7 28.3 41.7 16 104 A T H > S+ 0 0 32 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.945 112.8 43.3 -57.5 -45.1 -5.0 26.5 41.7 17 105 A E H > S+ 0 0 93 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.919 115.7 45.2 -63.8 -47.3 -3.9 24.7 44.8 18 106 A A H X S+ 0 0 3 -4,-2.2 4,-1.5 1,-0.2 -2,-0.2 0.925 116.1 45.0 -70.4 -43.5 -2.3 27.6 46.7 19 107 A V H X S+ 0 0 0 -4,-2.6 4,-1.2 439,-0.2 3,-0.2 0.904 110.4 54.9 -66.1 -40.7 -5.2 30.0 46.0 20 108 A S H < S+ 0 0 63 -4,-2.0 4,-0.5 -5,-0.4 -1,-0.2 0.842 109.4 48.8 -61.3 -38.1 -7.8 27.3 46.9 21 109 A M H < S+ 0 0 85 -4,-1.7 4,-0.4 1,-0.2 -1,-0.2 0.801 111.9 47.7 -69.5 -32.7 -6.1 26.9 50.3 22 110 A L H X S+ 0 0 6 -4,-1.5 4,-2.0 -3,-0.2 3,-0.3 0.681 91.3 83.8 -78.3 -21.3 -5.9 30.6 51.0 23 111 A L H X S+ 0 0 12 -4,-1.2 4,-1.0 1,-0.3 3,-0.3 0.904 92.7 39.5 -61.4 -50.3 -9.5 31.4 50.2 24 112 A E H 4 S+ 0 0 130 -4,-0.5 -1,-0.3 1,-0.2 -2,-0.1 0.742 115.5 54.5 -74.8 -22.0 -11.3 30.5 53.4 25 113 A Q H 4 S+ 0 0 78 -4,-0.4 -1,-0.2 -3,-0.3 -2,-0.2 0.792 113.2 42.7 -72.0 -31.6 -8.4 31.9 55.5 26 114 A A H < S+ 0 0 0 -4,-2.0 2,-0.3 -3,-0.3 -2,-0.2 0.559 86.9 112.8 -88.4 -12.9 -8.8 35.3 53.6 27 115 A R < - 0 0 71 -4,-1.0 3,-0.0 -5,-0.2 6,-0.0 -0.508 62.3-139.1 -72.7 124.4 -12.6 35.5 53.6 28 116 A L - 0 0 8 -2,-0.3 5,-0.1 1,-0.1 -1,-0.1 -0.694 27.0-110.8 -75.5 127.2 -13.9 38.3 55.8 29 117 A P >> - 0 0 71 0, 0.0 4,-2.6 0, 0.0 3,-0.7 -0.300 40.3 -94.2 -55.8 144.1 -17.0 37.3 57.8 30 118 A Q H 3> S+ 0 0 55 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.743 122.5 38.5 -24.4 -66.6 -20.3 38.9 56.6 31 119 A P H 3> S+ 0 0 93 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.885 117.5 49.8 -61.4 -44.5 -20.4 41.9 59.1 32 120 A V H <> S+ 0 0 37 -3,-0.7 4,-2.1 1,-0.2 -2,-0.2 0.889 108.6 54.9 -61.9 -40.2 -16.6 42.5 58.9 33 121 A A H X S+ 0 0 33 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.913 110.7 44.1 -57.1 -48.2 -16.8 42.5 55.0 34 122 A E H X S+ 0 0 57 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.869 112.8 49.4 -71.8 -38.0 -19.4 45.2 54.9 35 123 A Q H X S+ 0 0 92 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.887 113.2 49.7 -67.7 -30.9 -17.7 47.4 57.5 36 124 A A H X S+ 0 0 0 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.933 110.7 48.9 -71.8 -45.4 -14.5 47.0 55.5 37 125 A H H X S+ 0 0 72 -4,-2.6 4,-2.9 2,-0.2 5,-0.2 0.944 111.9 49.3 -57.5 -48.3 -16.2 47.9 52.2 38 126 A K H X S+ 0 0 102 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.938 115.1 42.6 -58.1 -51.6 -17.8 51.0 53.8 39 127 A L H X S+ 0 0 14 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.878 114.3 51.3 -62.8 -42.1 -14.6 52.2 55.3 40 128 A A H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 5,-0.3 0.917 110.1 49.6 -60.6 -46.4 -12.6 51.4 52.1 41 129 A Y H X S+ 0 0 85 -4,-2.9 4,-2.7 -5,-0.2 -2,-0.2 0.956 112.2 48.4 -56.6 -49.5 -15.2 53.3 50.0 42 130 A Q H X S+ 0 0 104 -4,-2.4 4,-2.4 1,-0.2 5,-0.2 0.892 113.2 46.7 -61.2 -41.7 -14.9 56.4 52.3 43 131 A L H X S+ 0 0 5 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.910 114.8 45.5 -66.4 -46.3 -11.1 56.4 52.3 44 132 A A H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 5,-0.3 0.864 112.7 52.6 -66.8 -36.4 -10.9 56.0 48.5 45 133 A D H X S+ 0 0 58 -4,-2.7 4,-2.6 -5,-0.3 -2,-0.2 0.986 112.2 42.8 -62.7 -58.6 -13.6 58.7 48.0 46 134 A K H < S+ 0 0 111 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.893 117.5 49.6 -53.1 -40.6 -11.9 61.3 50.2 47 135 A L H >< S+ 0 0 30 -4,-2.1 3,-1.0 -5,-0.2 4,-0.2 0.953 115.8 38.6 -66.9 -52.8 -8.5 60.4 48.6 48 136 A R H 3< S+ 0 0 25 -4,-2.8 5,-0.3 1,-0.2 3,-0.3 0.856 124.4 39.6 -64.7 -38.8 -9.6 60.5 44.9 49 137 A N T >< S+ 0 0 36 -4,-2.6 3,-1.6 -5,-0.3 -1,-0.2 -0.071 74.5 124.8-110.9 27.1 -11.9 63.6 45.4 50 138 A Q T < S+ 0 0 117 -3,-1.0 -1,-0.2 1,-0.3 -2,-0.1 0.933 91.4 24.0 -48.2 -56.0 -9.6 65.5 47.8 51 139 A K T 3 S- 0 0 157 -3,-0.3 -1,-0.3 -4,-0.2 5,-0.1 -0.403 126.8 -91.3-110.9 48.1 -9.6 68.5 45.4 52 140 A N S <> S+ 0 0 85 -3,-1.6 4,-2.8 1,-0.1 5,-0.3 0.697 70.5 156.6 54.0 28.6 -12.9 67.6 43.7 53 141 A A H > S+ 0 0 46 -5,-0.3 4,-1.7 1,-0.2 -4,-0.2 0.882 74.4 40.7 -52.3 -40.9 -11.3 65.6 40.9 54 142 A S H > S+ 0 0 36 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.928 113.5 51.3 -78.4 -47.2 -14.5 63.6 40.2 55 143 A G H 4 S+ 0 0 35 1,-0.2 4,-0.4 2,-0.2 -2,-0.2 0.933 114.6 46.5 -44.9 -47.5 -16.9 66.5 40.6 56 144 A R H >X S+ 0 0 163 -4,-2.8 4,-1.7 1,-0.2 3,-0.5 0.804 107.8 55.0 -72.5 -33.8 -14.7 68.3 38.1 57 145 A A H 3X S+ 0 0 24 -4,-1.7 4,-2.0 -5,-0.3 -1,-0.2 0.909 106.8 52.6 -60.3 -43.1 -14.5 65.4 35.7 58 146 A G H 3X S+ 0 0 47 -4,-2.4 4,-1.0 1,-0.2 -1,-0.2 0.512 105.1 54.5 -76.8 -8.9 -18.3 65.3 35.7 59 147 A M H <> S+ 0 0 123 -3,-0.5 4,-0.9 -4,-0.4 -1,-0.2 0.862 110.2 45.1 -83.1 -47.6 -18.5 69.0 34.7 60 148 A V H X S+ 0 0 88 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.839 116.4 48.0 -61.3 -35.7 -16.2 68.5 31.7 61 149 A Q H X S+ 0 0 132 -4,-2.0 4,-1.3 1,-0.2 -1,-0.2 0.937 111.3 48.6 -70.6 -47.7 -18.2 65.4 30.8 62 150 A G H X S+ 0 0 41 -4,-1.0 4,-1.0 2,-0.2 -1,-0.2 0.569 113.3 48.0 -72.0 -12.1 -21.6 67.1 31.1 63 151 A L H < S+ 0 0 69 -4,-0.9 5,-0.4 2,-0.2 -1,-0.2 0.817 113.6 45.9 -89.7 -43.5 -20.5 70.0 29.0 64 152 A L H <>S+ 0 0 35 -4,-1.8 5,-0.7 -5,-0.2 3,-0.3 0.682 118.9 45.8 -66.1 -20.3 -19.0 67.8 26.3 65 153 A Q H <5S+ 0 0 78 -4,-1.3 2,-0.5 3,-0.2 -3,-0.2 0.861 109.6 47.8 -94.4 -42.6 -22.3 65.7 26.5 66 154 A E T <5S+ 0 0 87 -4,-1.0 -1,-0.2 1,-0.1 -2,-0.1 -0.300 131.7 17.9 -98.4 49.1 -25.1 68.4 26.5 67 155 A F T 5S- 0 0 73 -2,-0.5 -3,-0.1 -3,-0.3 -1,-0.1 0.100 106.2-119.8 173.8 -34.3 -23.7 70.4 23.6 68 156 A S T 5 + 0 0 78 -5,-0.4 2,-0.3 -4,-0.2 -3,-0.2 1.000 46.4 155.6 80.8 78.0 -21.3 67.9 21.9 69 157 A L < - 0 0 68 -5,-0.7 -1,-0.2 1,-0.1 2,-0.1 -0.806 36.5-119.4-120.7 164.9 -17.6 68.9 21.7 70 158 A S > - 0 0 69 -2,-0.3 4,-1.5 1,-0.0 2,-1.2 -0.288 43.6 -90.9 -85.1-179.5 -14.3 67.0 21.5 71 159 A S T 4 S+ 0 0 105 1,-0.2 -1,-0.0 2,-0.2 -7,-0.0 -0.553 127.8 42.3 -90.9 67.5 -11.5 67.2 24.1 72 160 A Q T > S+ 0 0 60 -2,-1.2 4,-1.7 0, 0.0 -1,-0.2 0.062 111.1 50.2-177.0 -47.7 -9.9 70.0 22.1 73 161 A E H > S+ 0 0 39 2,-0.2 4,-1.3 3,-0.1 -2,-0.2 0.800 114.3 48.5 -72.7 -33.6 -13.0 72.1 21.3 74 162 A G H X S+ 0 0 7 -4,-1.5 4,-1.4 2,-0.2 -3,-0.1 0.894 112.6 46.7 -72.3 -45.0 -14.0 71.9 25.0 75 163 A V H > S+ 0 0 92 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.889 110.2 55.3 -55.6 -45.4 -10.5 72.9 26.1 76 164 A A H X S+ 0 0 55 -4,-1.7 4,-1.2 1,-0.2 -2,-0.2 0.838 105.4 51.3 -62.4 -35.1 -10.6 75.7 23.5 77 165 A L H X S+ 0 0 81 -4,-1.3 4,-2.8 2,-0.2 -1,-0.2 0.858 106.6 54.0 -71.7 -35.9 -13.8 77.1 24.9 78 166 A M H X S+ 0 0 93 -4,-1.4 4,-2.0 2,-0.2 -2,-0.2 0.901 103.8 56.2 -63.9 -41.7 -12.3 77.2 28.5 79 167 A C H X S+ 0 0 76 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.879 111.6 43.7 -53.6 -41.0 -9.3 79.2 27.1 80 168 A L H X S+ 0 0 94 -4,-1.2 4,-1.7 2,-0.2 -2,-0.2 0.926 112.7 50.6 -71.9 -49.4 -11.9 81.8 25.9 81 169 A A H X S+ 0 0 37 -4,-2.8 4,-0.9 1,-0.2 -2,-0.2 0.741 108.9 55.2 -55.0 -27.8 -13.9 81.7 29.1 82 170 A E H < S+ 0 0 109 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.919 109.1 44.1 -72.9 -48.2 -10.6 82.2 31.0 83 171 A A H >< S+ 0 0 51 -4,-1.7 3,-0.9 1,-0.2 -2,-0.2 0.753 110.3 56.9 -62.9 -28.8 -9.8 85.4 29.1 84 172 A L H >< S+ 0 0 31 -4,-1.7 3,-0.9 1,-0.2 -1,-0.2 0.812 103.8 54.6 -77.4 -26.7 -13.4 86.5 29.5 85 173 A L T 3< S+ 0 0 130 -4,-0.9 -1,-0.2 1,-0.2 -2,-0.2 0.329 98.8 61.2 -91.6 8.2 -12.9 86.2 33.2 86 174 A R T < S+ 0 0 173 -3,-0.9 -1,-0.2 3,-0.0 -2,-0.2 0.240 76.3 104.3 -99.8 0.7 -9.8 88.5 33.1 87 175 A I < - 0 0 37 -3,-0.9 6,-0.2 1,-0.2 -3,-0.0 -0.776 67.3-150.8 -85.6 103.9 -12.0 91.4 31.9 88 176 A P S S+ 0 0 116 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 0.778 73.1 58.6 -48.6 -45.7 -12.3 93.4 35.1 89 177 A D > - 0 0 110 1,-0.1 4,-2.1 -3,-0.1 5,-0.1 -0.748 68.1-149.9 -99.6 126.7 -15.8 95.0 34.5 90 178 A K H > S+ 0 0 127 -2,-0.4 4,-2.4 1,-0.2 5,-0.2 0.835 95.9 57.8 -64.0 -35.1 -18.9 92.8 34.0 91 179 A A H > S+ 0 0 77 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.953 108.8 45.3 -60.8 -47.3 -20.7 95.3 31.7 92 180 A T H > S+ 0 0 81 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.941 112.6 52.3 -60.8 -46.7 -17.8 95.4 29.3 93 181 A R H X S+ 0 0 45 -4,-2.1 4,-1.8 -6,-0.2 -1,-0.2 0.908 113.2 42.3 -52.8 -52.3 -17.6 91.6 29.4 94 182 A D H X S+ 0 0 72 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.892 112.2 53.4 -67.6 -43.9 -21.3 91.0 28.6 95 183 A A H X S+ 0 0 52 -4,-2.5 4,-1.6 -5,-0.2 -1,-0.2 0.847 110.7 49.6 -55.9 -36.1 -21.4 93.8 25.9 96 184 A L H < S+ 0 0 106 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.900 110.6 46.6 -72.7 -45.7 -18.4 92.0 24.2 97 185 A I H < S+ 0 0 100 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.855 112.3 51.3 -62.6 -42.8 -19.9 88.5 24.2 98 186 A R H < 0 0 80 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.938 360.0 360.0 -62.2 -45.7 -23.3 89.7 22.9 99 187 A D < 0 0 167 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.0 -0.608 360.0 360.0-100.6 360.0 -21.6 91.6 20.0 100 ! 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 0.0 101 242 A P > 0 0 141 0, 0.0 4,-0.9 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 -53.5 25.7 59.5 25.6 102 243 A L H > + 0 0 140 2,-0.2 4,-1.7 3,-0.1 5,-0.1 0.873 360.0 43.9 -72.2 -44.8 22.5 61.4 24.8 103 244 A I H > S+ 0 0 131 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.909 113.4 51.3 -69.5 -43.3 20.3 58.4 25.7 104 245 A R H > S+ 0 0 63 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.832 111.7 48.2 -59.2 -34.4 22.3 57.7 28.8 105 246 A K H X S+ 0 0 84 -4,-0.9 4,-1.9 2,-0.2 -1,-0.2 0.820 110.5 49.6 -81.2 -31.2 21.9 61.3 29.9 106 247 A G H X S+ 0 0 40 -4,-1.7 4,-2.8 2,-0.2 5,-0.2 0.896 112.0 49.2 -69.2 -42.8 18.2 61.4 29.3 107 248 A V H X S+ 0 0 93 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.930 112.7 46.7 -60.6 -47.9 17.7 58.2 31.3 108 249 A D H X S+ 0 0 64 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.886 116.1 46.1 -64.6 -36.3 19.8 59.6 34.2 109 250 A M H X S+ 0 0 118 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.870 111.1 49.3 -73.6 -41.6 17.9 62.9 34.1 110 251 A A H X S+ 0 0 41 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.832 110.1 54.5 -69.8 -29.7 14.4 61.4 33.9 111 252 A M H X S+ 0 0 13 -4,-1.9 4,-1.9 -5,-0.2 -2,-0.2 0.904 110.5 44.6 -65.9 -46.1 15.3 59.1 36.8 112 253 A R H X S+ 0 0 107 -4,-1.6 4,-1.5 2,-0.2 -2,-0.2 0.941 114.8 48.7 -65.1 -47.1 16.3 62.1 39.0 113 254 A L H < S+ 0 0 130 -4,-2.5 4,-0.3 1,-0.2 -2,-0.2 0.892 119.6 36.8 -58.3 -45.5 13.2 64.1 38.0 114 255 A M H < S+ 0 0 76 -4,-2.2 3,-0.4 -5,-0.2 -1,-0.2 0.797 116.1 55.8 -79.1 -23.6 10.8 61.2 38.6 115 256 A G H >< S+ 0 0 0 -4,-1.9 3,-2.1 1,-0.2 4,-0.4 0.734 83.5 78.7 -85.8 -27.3 12.7 59.9 41.7 116 257 A E G >< S+ 0 0 65 -4,-1.5 3,-1.4 1,-0.3 -1,-0.2 0.810 85.8 61.9 -57.5 -38.5 12.9 62.9 43.9 117 258 A Q G 3 S+ 0 0 115 -3,-0.4 -1,-0.3 -4,-0.3 -2,-0.1 0.743 105.2 49.7 -58.2 -22.8 9.3 62.5 45.1 118 259 A F G < S+ 0 0 7 -3,-2.1 2,-0.4 -4,-0.2 -1,-0.2 0.493 96.0 83.0 -96.9 -2.9 10.3 59.1 46.6 119 260 A V < - 0 0 22 -3,-1.4 283,-0.2 -4,-0.4 3,-0.1 -0.872 54.1-167.7-110.9 131.6 13.4 60.4 48.4 120 261 A T S S- 0 0 19 281,-2.5 2,-0.3 -2,-0.4 282,-0.2 0.770 71.6 -18.3 -87.8 -31.2 13.1 62.0 51.9 121 262 A G B -a 402 0A 2 280,-1.0 282,-1.9 282,-0.1 -1,-0.3 -0.932 49.3-122.1-171.2 157.1 16.7 63.4 52.0 122 263 A E S S+ 0 0 100 -2,-0.3 2,-0.3 280,-0.2 282,-0.2 0.795 101.8 23.2 -71.1 -31.3 20.2 63.1 50.4 123 264 A T S > S- 0 0 70 280,-0.2 4,-2.3 1,-0.1 5,-0.2 -0.900 85.1-110.8-131.1 164.7 21.8 62.3 53.8 124 265 A I H > S+ 0 0 5 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.867 115.5 55.5 -69.6 -38.0 20.5 60.9 57.1 125 266 A A H > S+ 0 0 68 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.940 110.2 46.6 -57.3 -46.1 20.8 64.2 59.0 126 267 A E H > S+ 0 0 82 2,-0.2 4,-1.4 1,-0.2 -2,-0.2 0.952 113.0 48.3 -64.4 -47.3 18.6 65.9 56.3 127 268 A A H < S+ 0 0 3 -4,-2.3 3,-0.5 1,-0.2 -2,-0.2 0.924 111.4 50.7 -56.9 -48.3 16.0 63.2 56.4 128 269 A L H >< S+ 0 0 32 -4,-2.9 3,-1.5 1,-0.2 4,-0.3 0.886 107.5 53.2 -57.7 -40.6 15.8 63.2 60.2 129 270 A A H >< S+ 0 0 77 -4,-2.0 3,-0.6 1,-0.3 4,-0.3 0.824 105.9 54.3 -68.2 -26.8 15.4 67.0 60.2 130 271 A N T 3< S+ 0 0 98 -4,-1.4 4,-0.4 -3,-0.5 -1,-0.3 0.292 94.9 76.7 -85.6 15.8 12.4 66.6 57.8 131 272 A A T <> S+ 0 0 2 -3,-1.5 4,-1.9 2,-0.1 -1,-0.2 0.573 70.7 73.7-109.8 -15.2 10.7 64.1 60.2 132 273 A R H <> S+ 0 0 69 -3,-0.6 4,-2.5 -4,-0.3 5,-0.3 0.904 87.1 65.5 -69.7 -41.9 9.2 66.3 63.0 133 274 A K H > S+ 0 0 95 -4,-0.3 4,-0.8 1,-0.2 3,-0.2 0.918 115.7 27.0 -44.6 -58.5 6.4 67.6 60.8 134 275 A L H 4>S+ 0 0 29 -4,-0.4 5,-2.2 1,-0.2 4,-0.4 0.831 115.5 63.2 -80.5 -29.6 4.8 64.2 60.4 135 276 A E H ><5S+ 0 0 45 -4,-1.9 3,-0.7 1,-0.2 -2,-0.2 0.795 99.0 56.1 -63.9 -27.4 6.1 62.8 63.7 136 277 A E H 3<5S+ 0 0 72 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.925 104.3 54.6 -63.3 -40.8 4.1 65.5 65.6 137 278 A K T 3<5S- 0 0 98 -4,-0.8 -1,-0.2 -5,-0.3 -2,-0.2 0.504 131.6 -94.0 -76.3 -4.6 1.0 64.1 63.8 138 279 A G T < 5S+ 0 0 33 -3,-0.7 258,-0.5 -4,-0.4 -3,-0.2 0.485 80.1 137.9 103.5 8.6 1.7 60.6 65.1 139 280 A F E < -b 396 0A 4 -5,-2.2 -1,-0.4 256,-0.1 2,-0.2 -0.543 36.2-155.2 -79.0 151.3 3.7 59.2 62.1 140 281 A R E -b 397 0A 7 256,-2.5 258,-2.8 -2,-0.2 2,-0.3 -0.722 8.5-136.8-112.8 173.0 6.7 57.1 62.6 141 282 A Y E -b 398 0A 11 256,-0.3 43,-1.9 -2,-0.2 2,-0.4 -0.974 15.5-167.6-132.2 145.2 9.7 56.5 60.3 142 283 A S E -bc 399 184A 5 256,-2.5 258,-3.0 -2,-0.3 2,-0.4 -0.984 27.6-143.0-124.1 118.6 11.9 53.7 59.0 143 284 A Y E -bc 400 185A 1 41,-2.3 43,-2.6 -2,-0.4 2,-0.6 -0.680 10.5-161.7 -89.8 132.4 15.0 55.0 57.2 144 285 A D E -bc 401 186A 1 256,-2.7 258,-2.8 -2,-0.4 2,-1.0 -0.961 11.9-147.2-114.1 108.1 16.3 53.2 54.2 145 286 A M E -b 402 0A 16 41,-0.6 43,-0.2 -2,-0.6 258,-0.2 -0.716 34.0-125.4 -71.1 102.9 19.9 54.0 53.2 146 287 A L + 0 0 9 256,-2.1 262,-0.1 -2,-1.0 258,-0.1 -0.171 67.0 86.5 -57.6 146.5 19.4 53.6 49.4 147 288 A G + 0 0 7 260,-0.3 2,-0.3 256,-0.1 41,-0.2 -0.034 41.7 168.3 125.1 130.2 21.8 51.2 47.7 148 289 A E + 0 0 40 1,-0.2 3,-0.1 42,-0.1 43,-0.1 -0.900 46.2 53.0-154.4 174.6 21.7 47.5 47.1 149 290 A A - 0 0 55 -2,-0.3 42,-0.2 1,-0.2 -1,-0.2 0.915 67.9-151.3 53.4 53.7 23.3 44.5 45.3 150 291 A A - 0 0 1 40,-1.7 45,-2.6 43,-0.2 46,-0.5 -0.332 12.4-168.2 -54.2 127.2 26.9 45.2 46.3 151 292 A L + 0 0 112 43,-0.2 2,-0.3 -3,-0.1 -1,-0.1 0.698 64.6 33.9 -94.8 -24.1 29.2 43.9 43.5 152 293 A T S > S- 0 0 65 42,-0.1 4,-1.9 1,-0.1 5,-0.2 -0.868 81.7-110.4-129.6 164.0 32.5 44.2 45.4 153 294 A A H > S+ 0 0 69 -2,-0.3 4,-1.5 1,-0.2 5,-0.1 0.816 121.2 52.4 -59.3 -32.3 34.0 43.8 48.9 154 295 A A H > S+ 0 0 72 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.879 105.5 52.7 -70.9 -40.7 34.5 47.6 48.8 155 296 A D H > S+ 0 0 64 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.931 111.8 46.7 -58.1 -45.3 30.9 48.3 47.9 156 297 A A H X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.807 110.0 52.4 -68.9 -37.8 29.7 46.2 50.8 157 298 A Q H X S+ 0 0 92 -4,-1.5 4,-1.7 2,-0.2 -1,-0.2 0.914 108.9 50.7 -64.6 -45.0 32.1 47.8 53.2 158 299 A A H X S+ 0 0 60 -4,-2.4 4,-2.4 2,-0.2 3,-0.2 0.922 111.0 47.8 -61.6 -43.2 30.9 51.3 52.2 159 300 A Y H X S+ 0 0 56 -4,-2.1 4,-2.5 32,-0.3 -1,-0.2 0.916 108.7 55.7 -63.1 -41.9 27.2 50.3 52.7 160 301 A M H X S+ 0 0 10 -4,-2.2 4,-2.0 31,-0.2 -1,-0.2 0.820 110.2 44.3 -57.5 -37.2 28.1 48.8 56.1 161 302 A V H X S+ 0 0 68 -4,-1.7 4,-2.8 -3,-0.2 5,-0.2 0.851 111.5 52.8 -79.3 -39.4 29.6 52.1 57.2 162 303 A S H X S+ 0 0 35 -4,-2.4 4,-2.0 -5,-0.2 -2,-0.2 0.900 111.6 47.4 -58.2 -37.9 26.7 54.1 55.8 163 304 A Y H X S+ 0 0 1 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.943 112.6 48.3 -70.4 -46.2 24.3 51.7 57.8 164 305 A Q H X S+ 0 0 61 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.925 113.1 47.7 -55.3 -50.9 26.4 52.1 61.1 165 306 A Q H X S+ 0 0 109 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.904 110.4 53.3 -56.6 -45.1 26.5 55.9 60.7 166 307 A A H X S+ 0 0 0 -4,-2.0 4,-3.1 -5,-0.2 5,-0.3 0.898 105.9 52.1 -61.1 -40.1 22.8 55.9 60.0 167 308 A I H X S+ 0 0 0 -4,-2.2 4,-3.0 2,-0.2 5,-0.2 0.916 108.8 50.7 -66.9 -41.1 22.0 53.9 63.2 168 309 A H H X S+ 0 0 76 -4,-2.0 4,-2.3 2,-0.2 5,-0.2 0.971 115.3 42.8 -55.5 -55.3 24.0 56.4 65.3 169 310 A A H X S+ 0 0 27 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.904 118.3 43.4 -60.4 -44.4 22.1 59.4 63.8 170 311 A I H X S+ 0 0 0 -4,-3.1 4,-2.4 1,-0.2 -1,-0.2 0.927 114.6 50.7 -66.8 -46.2 18.7 57.7 64.0 171 312 A G H X S+ 0 0 2 -4,-3.0 4,-2.2 -5,-0.3 5,-0.4 0.832 110.3 48.4 -59.2 -38.8 19.4 56.4 67.5 172 313 A K H < S+ 0 0 146 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.866 114.3 46.6 -72.2 -38.4 20.5 59.9 68.8 173 314 A A H < S+ 0 0 43 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.855 109.6 54.8 -69.9 -31.4 17.4 61.4 67.2 174 315 A S H >< S- 0 0 0 -4,-2.4 3,-1.3 -5,-0.1 -2,-0.2 0.939 83.1-173.8 -65.9 -50.1 15.2 58.6 68.7 175 316 A N T 3< - 0 0 143 -4,-2.2 -3,-0.1 1,-0.3 -4,-0.1 0.812 69.6 -43.7 62.8 39.6 16.6 59.4 72.2 176 317 A G T 3 S+ 0 0 58 46,-0.5 -1,-0.3 -5,-0.4 3,-0.1 0.426 96.6 130.3 92.9 -1.6 14.9 56.5 74.0 177 318 A R <> - 0 0 104 -3,-1.3 4,-0.7 1,-0.1 5,-0.3 0.653 64.1-139.4 -55.4 -18.8 11.5 56.7 72.4 178 319 A G H > - 0 0 10 44,-0.3 4,-1.8 45,-0.2 47,-0.2 -0.010 26.4 -54.3 85.5-179.9 11.9 52.9 71.8 179 320 A I H 4 S+ 0 0 12 45,-0.2 46,-0.2 1,-0.2 -1,-0.2 0.681 127.7 41.0 -72.5 -24.4 11.1 50.5 69.0 180 321 A Y H 4 S+ 0 0 63 -3,-0.2 -1,-0.2 44,-0.1 -2,-0.1 0.911 126.8 24.9 -90.3 -54.3 7.4 51.3 68.6 181 322 A E H < S+ 0 0 102 -4,-0.7 -3,-0.2 2,-0.1 -2,-0.2 0.766 114.4 71.6 -86.8 -28.1 7.1 55.1 68.8 182 323 A G S < S- 0 0 0 -4,-1.8 43,-0.2 -5,-0.3 -8,-0.1 -0.462 91.6 -86.3 -88.9 165.0 10.6 55.9 67.8 183 324 A P - 0 0 1 0, 0.0 42,-0.4 0, 0.0 2,-0.2 -0.195 41.9-170.1 -66.1 154.7 12.3 55.7 64.4 184 325 A G E -c 142 0A 3 -43,-1.9 -41,-2.3 40,-0.2 2,-0.3 -0.741 16.6-116.3-131.8-178.5 13.9 52.6 63.1 185 326 A I E -cd 143 226A 1 40,-2.7 42,-2.8 -43,-0.3 2,-0.4 -0.910 12.8-149.3-122.5 151.8 16.2 51.5 60.2 186 327 A S E -cd 144 227A 0 -43,-2.6 -41,-0.6 -2,-0.3 2,-0.3 -0.987 17.4-170.2-118.4 136.4 15.7 49.2 57.3 187 328 A I E - d 0 228A 0 40,-2.8 42,-2.8 -2,-0.4 2,-0.6 -0.914 18.6-140.0-127.2 152.2 18.5 47.2 55.7 188 329 A K > - 0 0 9 -2,-0.3 3,-1.7 -41,-0.2 4,-0.5 -0.940 8.9-150.2-108.9 117.3 19.0 45.1 52.6 189 330 A L G > S+ 0 0 2 -2,-0.6 3,-1.6 40,-0.5 4,-0.4 0.842 96.5 66.8 -52.9 -33.2 21.1 42.1 53.1 190 331 A S G > S+ 0 0 4 1,-0.3 -40,-1.7 2,-0.2 3,-0.5 0.768 95.4 57.9 -61.5 -25.6 22.2 42.4 49.4 191 332 A A G < S+ 0 0 0 -3,-1.7 -32,-0.3 -42,-0.2 -1,-0.3 0.680 103.6 53.5 -74.4 -16.1 24.1 45.7 50.4 192 333 A L G < S+ 0 0 0 -3,-1.6 -1,-0.2 -4,-0.5 -2,-0.2 0.426 106.7 43.6-104.7 -4.5 26.2 43.8 53.0 193 334 A H S X S- 0 0 4 -3,-0.5 3,-1.2 -4,-0.4 -43,-0.2 -0.993 86.3-107.6-145.2 134.4 27.8 41.0 51.0 194 335 A P T 3 S- 0 0 22 0, 0.0 -43,-0.2 0, 0.0 -41,-0.1 -0.424 99.9 -2.1 -66.1 130.2 29.4 41.0 47.5 195 336 A R T >> S+ 0 0 147 -45,-2.6 3,-2.0 -2,-0.2 4,-0.5 0.884 76.3 172.6 57.2 42.9 27.4 39.3 44.9 196 337 A Y G X4 + 0 0 6 -3,-1.2 3,-1.5 -46,-0.5 -1,-0.1 0.835 66.1 75.1 -44.5 -39.6 24.7 38.3 47.4 197 338 A S G 34 S+ 0 0 55 1,-0.3 -1,-0.3 -7,-0.1 -2,-0.1 0.753 112.9 20.7 -55.4 -29.6 22.6 37.1 44.5 198 339 A R G <4 S+ 0 0 197 -3,-2.0 -1,-0.3 2,-0.1 -2,-0.2 0.252 90.7 139.0-122.3 13.8 24.7 34.0 44.1 199 340 A A << - 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0 0 13 25,-2.0 25,-0.1 -2,-0.6 -2,-0.0 -0.956 48.6-163.6-169.3 152.5 0.0 49.1 52.0 346 487 A H + 0 0 22 -2,-0.3 2,-0.6 25,-0.1 25,-0.1 0.153 66.9 111.1-116.3 8.6 -1.3 52.0 50.0 347 488 A N > - 0 0 12 1,-0.1 4,-3.2 2,-0.0 5,-0.2 -0.788 59.2-153.1 -94.5 120.1 -4.5 50.1 49.1 348 489 A A H > S+ 0 0 0 -2,-0.6 4,-2.2 1,-0.2 -1,-0.1 0.796 96.9 48.3 -62.6 -38.5 -7.6 51.4 50.8 349 490 A H H > S+ 0 0 6 90,-0.2 4,-3.0 2,-0.2 5,-0.2 0.927 112.6 50.7 -63.8 -45.2 -9.4 48.1 50.8 350 491 A T H > S+ 0 0 3 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.946 112.8 45.1 -57.3 -48.3 -6.3 46.5 52.2 351 492 A L H X S+ 0 0 0 -4,-3.2 4,-2.4 1,-0.2 -1,-0.2 0.949 114.1 48.4 -61.3 -48.2 -6.1 49.0 54.9 352 493 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.894 110.5 52.0 -60.6 -40.5 -9.8 48.9 55.7 353 494 A A H X S+ 0 0 0 -4,-3.0 4,-2.9 2,-0.2 -1,-0.2 0.904 111.2 46.1 -62.9 -44.0 -9.8 45.1 55.9 354 495 A I H X S+ 0 0 1 -4,-2.0 4,-2.4 -5,-0.2 -2,-0.2 0.917 109.7 55.3 -64.0 -45.9 -6.8 45.0 58.3 355 496 A Y H < S+ 0 0 58 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.895 115.4 38.6 -51.8 -44.6 -8.5 47.7 60.5 356 497 A Q H >< S+ 0 0 45 -4,-2.1 3,-1.6 1,-0.2 -2,-0.2 0.878 113.5 53.6 -78.2 -41.1 -11.6 45.5 60.8 357 498 A L H 3< S+ 0 0 34 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.797 96.4 68.4 -65.0 -25.3 -9.8 42.2 61.1 358 499 A A T 3< S- 0 0 10 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.584 102.0-145.6 -70.2 -8.6 -7.7 43.6 64.0 359 500 A G < - 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i 0 398A 4 26,-1.9 28,-3.1 -2,-0.3 2,-0.4 -0.968 30.5-108.5-147.8 160.9 3.7 53.3 53.7 372 513 A L E >> - i 0 399A 28 -2,-0.3 4,-1.7 26,-0.2 3,-1.6 -0.760 45.8 -98.8 -90.1 138.3 6.4 54.4 51.3 373 514 A H T 34 S+ 0 0 40 26,-2.3 -1,-0.1 -2,-0.4 -253,-0.0 -0.342 108.4 20.3 -50.9 133.1 7.4 58.1 51.2 374 515 A G T 34 S+ 0 0 30 -2,-0.1 -1,-0.2 1,-0.0 -256,-0.1 0.490 124.3 58.4 81.3 7.0 5.7 60.0 48.3 375 516 A M T <4 S+ 0 0 22 -3,-1.6 4,-0.2 -257,-0.1 -2,-0.2 0.639 103.6 34.9-128.3 -36.1 3.0 57.4 47.9 376 517 A G S X S+ 0 0 0 -4,-1.7 4,-2.6 1,-0.1 3,-0.4 0.631 82.3 94.2-106.6 -12.7 1.0 56.9 51.1 377 518 A E H > S+ 0 0 34 -5,-0.3 4,-1.5 1,-0.2 -1,-0.1 0.839 86.3 50.7 -58.5 -39.9 0.7 60.2 52.9 378 519 A P H 4 S+ 0 0 50 0, 0.0 4,-0.5 0, 0.0 -1,-0.2 0.911 114.0 44.8 -62.5 -43.0 -2.7 61.2 51.4 379 520 A L H >4 S+ 0 0 4 -3,-0.4 3,-1.3 -4,-0.2 -2,-0.2 0.956 118.0 44.0 -62.8 -45.5 -4.2 57.9 52.3 380 521 A Y H >X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.3 3,-0.9 0.588 93.2 77.0 -87.6 -7.2 -2.7 58.0 55.8 381 522 A E T 3< S+ 0 0 51 -4,-1.5 -1,-0.3 -5,-0.3 -2,-0.2 0.783 100.2 47.6 -63.3 -26.5 -3.6 61.6 56.4 382 523 A Q T <4 S+ 0 0 27 -3,-1.3 10,-1.1 -4,-0.5 -1,-0.2 0.508 119.0 40.2 -85.2 -7.3 -7.0 60.1 57.0 383 524 A V T <4 S+ 0 0 0 -3,-0.9 11,-2.0 8,-0.2 10,-0.9 0.828 101.3 61.9-114.1 -47.4 -5.7 57.3 59.3 384 525 A T S < S+ 0 0 4 -4,-2.8 2,-0.2 9,-0.2 -1,-0.2 -0.745 88.8 48.7 -90.3 133.0 -3.0 58.6 61.6 385 526 A G S S- 0 0 15 -2,-0.4 8,-0.4 -247,-0.1 -247,-0.1 -0.654 92.5 -31.3 128.7 174.2 -4.2 61.4 63.9 386 527 A K > > - 0 0 151 -2,-0.2 5,-1.8 1,-0.1 3,-0.7 -0.315 43.2-132.8 -65.9 142.9 -6.9 62.2 66.4 387 528 A V G > 5S+ 0 0 100 1,-0.2 3,-1.7 3,-0.2 -1,-0.1 0.783 106.9 63.3 -62.0 -30.9 -10.5 60.9 66.0 388 529 A A G 3 5S+ 0 0 100 1,-0.3 -1,-0.2 2,-0.2 -2,-0.0 0.768 98.1 57.1 -72.4 -21.1 -11.9 64.4 66.7 389 530 A D G < 5S- 0 0 108 -3,-0.7 -1,-0.3 2,-0.1 -2,-0.2 0.135 129.7 -99.6 -88.7 20.6 -10.0 65.4 63.5 390 531 A G T < 5S+ 0 0 66 -3,-1.7 -3,-0.2 1,-0.2 -2,-0.2 0.555 82.5 134.7 72.4 12.2 -12.0 62.8 61.6 391 532 A K < - 0 0 45 -5,-1.8 -8,-0.2 1,-0.1 -1,-0.2 -0.477 64.4-127.1 -94.0 164.8 -9.0 60.3 61.7 392 533 A L - 0 0 28 -10,-1.1 -8,-0.2 -2,-0.1 -9,-0.1 0.675 38.0-133.0 -79.1 -18.3 -8.9 56.6 62.5 393 534 A N + 0 0 85 -10,-0.9 -9,-0.2 -8,-0.4 -7,-0.1 0.952 57.4 137.1 58.5 52.3 -6.1 57.1 65.1 394 535 A R - 0 0 32 -11,-2.0 -1,-0.2 -14,-0.1 -2,-0.1 -1.000 54.0-117.7-123.8 132.4 -3.9 54.2 63.9 395 536 A P - 0 0 13 0, 0.0 -26,-2.5 0, 0.0 2,-0.4 -0.287 25.2-162.0 -72.2 148.9 -0.2 54.8 63.6 396 537 A C E -ib 369 139A 0 -258,-0.5 -256,-2.5 -28,-0.2 2,-0.6 -1.000 8.7-148.6-133.9 133.8 1.7 54.6 60.3 397 538 A R E -ib 370 140A 8 -28,-2.1 -26,-1.9 -2,-0.4 2,-0.4 -0.929 15.4-145.1-106.9 120.3 5.4 54.2 59.7 398 539 A I E -ib 371 141A 0 -258,-2.8 -256,-2.5 -2,-0.6 2,-0.6 -0.667 9.6-136.4 -87.9 127.4 6.8 55.9 56.6 399 540 A Y E -ib 372 142A 13 -28,-3.1 -26,-2.3 -2,-0.4 -256,-0.2 -0.823 26.6-161.5 -87.1 118.6 9.6 54.1 54.8 400 541 A A E - 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0 0 31 -4,-0.9 3,-1.7 -3,-0.7 6,-0.3 -0.624 67.3-138.8 -77.0 134.1 0.8 49.0 36.5 422 563 A N T 3 S+ 0 0 119 -2,-0.3 -1,-0.1 1,-0.3 -3,-0.0 0.648 102.8 59.1 -67.2 -17.0 -2.9 49.0 35.6 423 564 A T T 3 S+ 0 0 59 4,-0.1 -1,-0.3 -5,-0.0 2,-0.2 0.567 83.3 104.9 -83.2 -13.5 -3.5 46.5 38.4 424 565 A S S X> S- 0 0 24 -3,-1.7 4,-2.5 -6,-0.2 3,-0.7 -0.542 70.3-138.3 -78.3 134.6 -2.1 48.9 41.1 425 566 A F H 3> S+ 0 0 12 -2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.836 105.1 55.9 -52.7 -41.0 -4.5 50.6 43.5 426 567 A V H 34 S+ 0 0 30 2,-0.2 4,-0.4 1,-0.2 -1,-0.2 0.780 111.1 45.1 -67.9 -26.6 -2.5 53.9 43.2 427 568 A N H <4 S+ 0 0 56 -3,-0.7 3,-0.5 -6,-0.3 4,-0.4 0.877 115.0 46.4 -79.2 -43.6 -2.9 53.7 39.4 428 569 A R H >< S+ 0 0 75 -4,-2.5 3,-0.7 1,-0.2 6,-0.3 0.820 105.1 60.1 -69.6 -30.6 -6.7 52.8 39.5 429 570 A I T 3< S+ 0 0 20 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.1 0.767 102.9 52.7 -65.7 -28.7 -7.6 55.5 42.2 430 571 A A T 3 S+ 0 0 84 -3,-0.5 2,-0.9 -4,-0.4 -1,-0.2 0.522 88.4 90.9 -90.3 -10.9 -6.3 58.2 39.8 431 572 A D X - 0 0 75 -3,-0.7 3,-1.3 -4,-0.4 -1,-0.1 -0.808 59.5-171.0 -81.4 104.2 -8.6 56.9 37.1 432 573 A T T 3 S+ 0 0 70 -2,-0.9 -1,-0.1 1,-0.3 4,-0.1 0.702 81.0 65.2 -77.2 -17.9 -11.8 58.8 37.6 433 574 A S T 3 S+ 0 0 86 2,-0.1 -1,-0.3 -3,-0.1 -2,-0.0 0.577 83.4 88.0 -73.5 -14.1 -13.6 56.6 35.1 434 575 A L S < S- 0 0 23 -3,-1.3 5,-0.1 -6,-0.3 -3,-0.0 -0.804 86.5-120.9 -91.3 116.7 -13.2 53.5 37.4 435 576 A P >> - 0 0 63 0, 0.0 4,-1.7 0, 0.0 3,-0.8 -0.182 13.8-124.2 -62.2 145.9 -16.1 53.3 39.9 436 577 A L H 3> S+ 0 0 19 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.887 109.0 59.9 -56.1 -43.4 -15.2 53.4 43.6 437 578 A D H 34 S+ 0 0 89 1,-0.2 -1,-0.2 2,-0.2 -396,-0.0 0.811 107.7 43.9 -56.0 -36.3 -17.0 50.1 44.2 438 579 A E H X4 S+ 0 0 109 -3,-0.8 3,-0.9 2,-0.2 -1,-0.2 0.819 110.1 56.5 -76.8 -35.1 -14.7 48.2 41.7 439 580 A L H 3< S+ 0 0 10 -4,-1.7 -90,-0.2 1,-0.2 -2,-0.2 0.908 116.7 34.9 -59.4 -43.1 -11.6 49.9 43.0 440 581 A V T 3< S+ 0 0 0 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.125 88.0 147.7-102.6 22.8 -12.3 48.6 46.6 441 582 A A < - 0 0 47 -3,-0.9 -3,-0.1 1,-0.1 -92,-0.1 -0.268 58.4-100.9 -63.2 142.5 -13.8 45.3 45.5 442 583 A D > - 0 0 32 1,-0.1 4,-2.2 2,-0.0 -1,-0.1 -0.495 25.9-145.4 -66.7 123.8 -13.3 42.5 47.9 443 584 A P H > S+ 0 0 6 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.831 96.5 53.7 -58.6 -42.6 -10.4 40.2 46.6 444 585 A V H > S+ 0 0 0 2,-0.2 4,-1.7 -418,-0.2 5,-0.2 0.927 113.0 44.8 -59.2 -43.3 -11.9 36.9 47.9 445 586 A T H > S+ 0 0 79 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.866 109.4 56.6 -69.0 -39.1 -15.2 37.7 46.0 446 587 A A H X S+ 0 0 33 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.919 108.4 47.7 -53.5 -44.7 -13.2 38.7 43.0 447 588 A V H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 11,-0.3 0.798 110.2 49.8 -70.9 -34.2 -11.5 35.3 42.9 448 589 A E H X S+ 0 0 72 -4,-1.7 4,-1.5 2,-0.2 -1,-0.2 0.829 107.3 56.5 -73.1 -29.7 -14.7 33.4 43.3 449 590 A K H X S+ 0 0 133 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.933 110.5 44.4 -64.8 -47.3 -16.1 35.5 40.4 450 591 A L H X S+ 0 0 33 -4,-2.0 4,-2.7 1,-0.2 5,-0.2 0.909 110.3 54.6 -57.7 -46.3 -13.2 34.4 38.2 451 592 A A H X S+ 0 0 15 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.807 109.0 47.6 -64.2 -31.1 -13.5 30.7 39.3 452 593 A Q H < S+ 0 0 167 -4,-1.5 -1,-0.2 -3,-0.2 -2,-0.2 0.828 116.4 44.6 -77.5 -36.5 -17.2 30.6 38.3 453 594 A Q H < S+ 0 0 145 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.889 122.1 37.0 -67.5 -38.4 -16.4 32.2 34.9 454 595 A E H < S- 0 0 66 -4,-2.7 -2,-0.2 2,-0.2 -3,-0.2 0.634 104.9-116.1-102.7 -18.4 -13.4 30.0 34.2 455 596 A G S < S+ 0 0 71 -4,-1.6 2,-0.3 -5,-0.2 -3,-0.1 0.269 86.7 50.8 104.0 -8.3 -14.3 26.7 35.6 456 597 A Q S > S- 0 0 105 -6,-0.2 3,-0.5 -5,-0.1 2,-0.4 -0.980 81.0-107.3-156.3 154.5 -11.7 26.4 38.4 457 598 A T T 3 S+ 0 0 40 -2,-0.3 -437,-0.2 1,-0.2 -438,-0.1 -0.695 94.3 9.6 -86.6 133.7 -10.4 28.4 41.4 458 599 A G T 3 S+ 0 0 1 -2,-0.4 -439,-0.2 -11,-0.3 -1,-0.2 0.803 74.3 170.2 75.2 31.8 -7.0 30.0 41.2 459 600 A L < - 0 0 48 -3,-0.5 -1,-0.2 -444,-0.1 -143,-0.1 -0.499 39.7-101.7 -71.1 144.8 -6.1 29.5 37.5 460 601 A P - 0 0 43 0, 0.0 -1,-0.1 0, 0.0 -145,-0.0 -0.115 50.5 -71.6 -59.8 163.2 -2.9 31.4 36.5 461 602 A H > - 0 0 59 3,-0.2 3,-1.7 1,-0.1 -144,-0.1 -0.324 45.0-130.7 -51.1 131.4 -2.9 34.6 34.5 462 603 A P T 3 S+ 0 0 97 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.800 108.2 49.0 -62.5 -27.2 -4.0 33.6 31.0 463 604 A K T 3 S+ 0 0 172 1,-0.2 -2,-0.1 2,-0.0 0, 0.0 0.298 103.1 66.1 -91.4 4.0 -1.1 35.6 29.5 464 605 A I < - 0 0 14 -3,-1.7 -1,-0.2 0, 0.0 -3,-0.2 -0.687 69.7-179.4-127.6 80.9 1.5 34.0 31.9 465 606 A P - 0 0 68 0, 0.0 -4,-0.1 0, 0.0 -2,-0.0 -0.261 44.8 -74.2 -71.8 164.4 1.7 30.3 31.1 466 607 A L > - 0 0 74 1,-0.1 3,-1.7 2,-0.1 -155,-0.1 -0.271 47.9-110.7 -56.2 147.2 4.1 28.0 33.1 467 608 A P T 3 S+ 0 0 20 0, 0.0 -1,-0.1 0, 0.0 -157,-0.1 0.822 119.2 52.4 -50.3 -38.7 7.8 28.5 32.2 468 609 A R T 3 0 0 164 -159,-0.5 -158,-0.1 -158,-0.1 -2,-0.1 0.637 360.0 360.0 -73.7 -16.8 7.9 25.1 30.5 469 610 A D < 0 0 143 -3,-1.7 -161,-0.0 0, 0.0 0, 0.0 -0.001 360.0 360.0 -94.4 360.0 4.8 25.9 28.3