==== 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 LIGASE 11-OCT-06 2IP1 . COMPND 2 MOLECULE: TRYPTOPHANYL-TRNA SYNTHETASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR M.G.MALKOWSKI,CENTER FOR HIGH-THROUGHPUT STRUCTURAL BIOLOGY . 371 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16888.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 261 70.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 21 5.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 11 3.0 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 . 13 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 154 41.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.4 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 1 2 2 2 1 1 3 0 1 2 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 0 0 3 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 . 1 1 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 99 A D > 0 0 145 0, 0.0 4,-1.0 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 -88.6 14.6 68.4 123.5 2 100 A Y H > + 0 0 67 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.756 360.0 53.8 -77.9 -27.1 14.1 64.7 124.2 3 101 A D H > S+ 0 0 130 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.843 108.2 54.1 -74.5 -25.7 17.5 63.1 123.4 4 102 A K H > S+ 0 0 59 -3,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.835 107.9 51.4 -65.0 -32.9 19.0 65.7 125.7 5 103 A L H X S+ 0 0 40 -4,-1.0 4,-3.1 2,-0.2 5,-0.4 0.901 105.3 53.3 -74.6 -40.1 16.5 64.3 128.3 6 104 A I H X>S+ 0 0 31 -4,-2.2 4,-2.2 1,-0.2 5,-1.5 0.952 114.2 43.9 -51.6 -51.0 17.6 60.7 127.7 7 105 A K H <5S+ 0 0 80 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.870 115.7 46.5 -63.1 -43.0 21.2 61.8 128.4 8 106 A Q H <5S+ 0 0 81 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.929 121.1 36.6 -69.3 -43.8 20.3 64.0 131.4 9 107 A F H <5S- 0 0 43 -4,-3.1 -2,-0.2 -5,-0.1 -1,-0.2 0.707 103.9-130.7 -82.8 -21.3 18.1 61.3 133.1 10 108 A G T <5 + 0 0 46 -4,-2.2 -3,-0.2 -5,-0.4 -4,-0.1 0.878 52.1 150.3 76.6 37.3 20.3 58.5 131.9 11 109 A T < - 0 0 16 -5,-1.5 32,-0.2 -6,-0.2 -1,-0.1 -0.321 49.9-104.0 -92.5-178.8 17.5 56.3 130.5 12 110 A K E -A 42 0A 100 30,-2.3 30,-2.0 -2,-0.1 -5,-0.0 -0.933 35.0-125.1-110.5 120.4 17.6 53.8 127.6 13 111 A P E -A 41 0A 58 0, 0.0 2,-0.6 0, 0.0 28,-0.3 -0.343 15.1-125.2 -63.2 145.1 16.0 54.9 124.3 14 112 A V + 0 0 22 26,-2.3 2,-0.2 4,-0.1 222,-0.0 -0.851 49.1 159.9 -81.7 121.9 13.3 52.9 122.7 15 113 A N > - 0 0 85 -2,-0.6 4,-1.8 22,-0.0 3,-0.4 -0.653 56.6 -71.0-132.8-170.9 14.6 52.2 119.2 16 114 A E H > S+ 0 0 82 1,-0.2 4,-2.5 -2,-0.2 5,-0.2 0.859 128.2 54.2 -56.2 -38.9 14.2 49.8 116.3 17 115 A E H > S+ 0 0 133 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.875 106.0 52.2 -64.2 -37.9 15.8 46.9 118.2 18 116 A T H > S+ 0 0 19 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.887 112.6 45.4 -62.7 -42.2 13.4 47.3 121.1 19 117 A L H X S+ 0 0 37 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.872 111.7 51.4 -72.4 -37.3 10.4 47.2 118.7 20 118 A K H X S+ 0 0 54 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.937 112.2 46.7 -63.5 -47.2 11.8 44.2 116.8 21 119 A R H X S+ 0 0 48 -4,-2.6 4,-2.5 1,-0.2 5,-0.3 0.877 109.0 55.8 -63.8 -39.4 12.3 42.3 120.1 22 120 A F H X S+ 0 0 3 -4,-2.1 4,-2.6 -5,-0.2 6,-0.4 0.937 110.4 43.6 -55.4 -51.6 8.8 43.2 121.3 23 121 A K H X S+ 0 0 83 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.916 113.9 51.9 -59.9 -45.0 7.2 41.7 118.2 24 122 A Q H < S+ 0 0 114 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.877 115.8 40.3 -58.0 -44.9 9.5 38.6 118.4 25 123 A V H < S+ 0 0 2 -4,-2.5 -2,-0.2 -5,-0.1 344,-0.2 0.903 129.3 26.2 -75.1 -45.0 8.6 38.0 122.0 26 124 A T H < S- 0 0 1 -4,-2.6 342,-0.5 -5,-0.3 343,-0.3 0.709 89.9-132.2 -93.7 -23.8 4.8 38.8 122.0 27 125 A G S < S+ 0 0 22 -4,-2.7 2,-0.3 -5,-0.4 -4,-0.2 0.373 73.7 111.9 79.0 -3.1 4.0 38.0 118.3 28 126 A R S S- 0 0 98 -6,-0.4 -1,-0.3 60,-0.1 -2,-0.2 -0.741 75.7-105.5-106.2 149.6 2.2 41.4 118.4 29 127 A E - 0 0 115 -2,-0.3 3,-0.1 -3,-0.1 -9,-0.1 -0.441 45.2-102.1 -65.2 141.0 2.9 44.7 116.6 30 128 A P - 0 0 8 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 -0.362 49.0 -92.4 -59.6 143.3 4.4 47.5 118.9 31 129 A H >> - 0 0 18 1,-0.1 4,-2.3 50,-0.1 3,-0.9 -0.151 30.7-115.5 -54.6 149.7 1.8 50.1 119.9 32 130 A H H 3> S+ 0 0 17 1,-0.3 4,-2.3 2,-0.2 6,-0.2 0.840 116.4 62.6 -63.1 -30.1 1.5 53.2 117.7 33 131 A F H 34>S+ 0 0 1 2,-0.2 5,-2.3 1,-0.2 6,-1.3 0.844 108.3 43.8 -56.6 -37.6 2.7 55.3 120.6 34 132 A L H X45S+ 0 0 10 -3,-0.9 3,-1.1 3,-0.2 -2,-0.2 0.905 111.7 51.3 -73.9 -42.1 5.9 53.3 120.5 35 133 A R H 3<5S+ 0 0 87 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.843 114.9 44.3 -62.4 -33.9 6.2 53.4 116.7 36 134 A K T 3<5S- 0 0 55 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.423 113.5-116.0 -92.2 -0.0 5.7 57.2 116.8 37 135 A G T < 5S+ 0 0 34 -3,-1.1 -3,-0.2 2,-0.3 3,-0.2 0.698 76.1 129.9 73.6 19.8 8.1 57.8 119.8 38 136 A L S S+ 0 0 50 -2,-0.4 4,-1.4 190,-0.2 3,-0.4 0.611 80.2 137.5 65.2 17.6 14.3 47.6 132.5 45 143 A F H > S+ 0 0 4 190,-0.3 4,-2.5 1,-0.2 5,-0.2 0.857 70.8 62.5 -59.2 -31.7 11.8 46.9 129.7 46 144 A T H > S+ 0 0 50 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.912 99.1 52.5 -54.5 -44.5 14.2 44.2 128.7 47 145 A K H > S+ 0 0 50 -3,-0.4 4,-1.8 2,-0.2 -1,-0.2 0.886 108.5 50.9 -63.2 -39.1 13.7 42.4 131.9 48 146 A I H X S+ 0 0 0 -4,-1.4 4,-2.6 2,-0.2 -2,-0.2 0.924 109.9 48.8 -62.9 -46.9 9.9 42.5 131.4 49 147 A L H X S+ 0 0 3 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.903 109.2 54.7 -59.2 -41.0 10.3 41.1 127.8 50 148 A D H X S+ 0 0 54 -4,-2.7 4,-1.9 2,-0.2 -1,-0.2 0.891 109.2 47.7 -54.3 -45.7 12.5 38.3 129.4 51 149 A L H X>S+ 0 0 20 -4,-1.8 5,-2.8 2,-0.2 4,-1.1 0.936 111.7 47.9 -64.0 -50.1 9.7 37.5 131.8 52 150 A Y H ><5S+ 0 0 19 -4,-2.6 3,-0.9 1,-0.2 -2,-0.2 0.930 110.8 52.8 -56.6 -43.7 7.0 37.3 129.2 53 151 A E H 3<5S+ 0 0 50 -4,-2.6 319,-3.6 1,-0.3 -1,-0.2 0.868 113.1 43.2 -60.1 -37.8 9.3 35.2 127.0 54 152 A Q H 3<5S- 0 0 90 -4,-1.9 -1,-0.3 317,-0.3 -2,-0.2 0.529 115.0-117.4 -84.9 -7.9 9.8 32.7 130.0 55 153 A G T <<5 + 0 0 43 -4,-1.1 -3,-0.2 -3,-0.9 -2,-0.1 0.761 65.5 146.1 76.2 26.2 6.1 32.9 130.8 56 154 A K < - 0 0 105 -5,-2.8 -1,-0.3 -6,-0.2 -2,-0.1 -0.654 48.3-100.9 -96.6 153.4 6.7 34.4 134.2 57 155 A P + 0 0 48 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.314 43.0 154.3 -79.4 154.4 4.4 36.9 135.9 58 156 A F - 0 0 2 146,-0.1 2,-0.3 -7,-0.0 148,-0.2 -0.888 24.2-142.7-152.8 175.4 4.6 40.7 136.2 59 157 A F E -c 206 0A 0 146,-1.6 148,-2.1 -2,-0.3 2,-0.3 -0.917 9.5-119.8-139.6 171.4 1.9 43.4 136.6 60 158 A L E -cd 207 93A 0 32,-2.4 34,-2.6 -2,-0.3 2,-0.4 -0.848 20.2-164.7-112.6 151.3 1.1 46.9 135.5 61 159 A Y E + d 0 94A 13 146,-1.8 2,-0.3 -2,-0.3 34,-0.2 -0.996 13.8 161.5-132.9 135.7 0.6 50.0 137.6 62 160 A T E - d 0 95A 9 32,-1.8 34,-2.2 -2,-0.4 2,-0.3 -0.953 16.1-158.7-141.4 168.4 -0.9 53.4 136.9 63 161 A G E - d 0 96A 28 -2,-0.3 2,-0.3 32,-0.2 34,-0.2 -0.944 7.9-165.0-145.2 158.3 -2.3 56.2 139.2 64 162 A R E - d 0 97A 26 32,-2.4 34,-2.4 -2,-0.3 57,-0.0 -0.974 20.5-137.4-148.7 131.3 -4.6 59.2 139.2 65 163 A G - 0 0 27 -2,-0.3 2,-0.7 32,-0.2 34,-0.1 -0.829 39.3-121.8 -85.7 116.5 -5.0 62.1 141.6 66 164 A P - 0 0 0 0, 0.0 52,-0.2 0, 0.0 2,-0.2 -0.504 36.5-172.6 -72.0 108.0 -8.9 62.4 141.8 67 165 A S - 0 0 25 -2,-0.7 54,-0.1 2,-0.3 4,-0.1 -0.486 36.1-125.5 -96.6 164.6 -9.9 65.9 140.8 68 166 A S S S+ 0 0 98 -2,-0.2 2,-0.2 2,-0.1 -1,-0.1 0.691 93.1 77.0 -78.8 -19.9 -13.3 67.6 140.8 69 167 A D S S- 0 0 51 1,-0.1 -2,-0.3 3,-0.0 3,-0.1 -0.538 93.9 -95.7 -88.1 156.5 -12.8 68.3 137.1 70 168 A S - 0 0 21 -2,-0.2 -1,-0.1 1,-0.1 -2,-0.1 -0.306 53.2 -87.8 -55.9 148.8 -13.2 65.9 134.2 71 169 A M - 0 0 0 1,-0.1 184,-2.7 183,-0.1 185,-0.3 -0.357 45.3-121.6 -55.0 140.7 -10.1 64.2 132.9 72 170 A H B >> -G 254 0B 65 182,-0.2 3,-1.0 183,-0.1 4,-0.7 -0.555 22.8-109.3 -78.2 154.0 -8.2 66.2 130.2 73 171 A L G >4 S+ 0 0 2 180,-3.1 3,-1.5 1,-0.2 4,-0.4 0.900 120.9 56.4 -42.8 -48.6 -7.7 64.7 126.8 74 172 A G G >4 S+ 0 0 15 179,-0.3 3,-1.1 1,-0.3 -1,-0.2 0.788 94.8 65.3 -62.7 -28.7 -3.9 64.4 127.7 75 173 A H G <> S+ 0 0 64 -3,-1.0 4,-0.6 1,-0.2 -1,-0.3 0.728 89.9 68.7 -64.8 -24.2 -4.7 62.3 130.8 76 174 A M H S+ 0 0 17 -3,-1.1 4,-2.2 -4,-0.4 5,-0.2 0.890 93.4 41.9 -53.2 -55.9 -2.6 58.8 127.1 78 176 A P H > S+ 0 0 40 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.851 117.4 50.1 -59.6 -33.4 -1.1 56.6 129.9 79 177 A F H X S+ 0 0 5 -4,-0.6 4,-2.4 -3,-0.2 -2,-0.2 0.904 109.7 48.9 -72.5 -44.6 -4.5 54.8 130.3 80 178 A V H X S+ 0 0 32 -4,-3.0 4,-1.7 2,-0.2 -1,-0.2 0.924 115.9 44.7 -52.6 -49.0 -4.8 54.0 126.6 81 179 A F H X S+ 0 0 0 -4,-2.2 4,-2.6 -5,-0.3 -2,-0.2 0.894 112.4 50.2 -68.6 -41.0 -1.2 52.7 126.5 82 180 A T H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.880 106.9 56.2 -66.6 -36.6 -1.6 50.7 129.8 83 181 A K H X S+ 0 0 90 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.898 109.8 45.1 -59.5 -42.6 -4.8 49.1 128.4 84 182 A W H X S+ 0 0 34 -4,-1.7 4,-3.2 2,-0.2 5,-0.3 0.921 110.7 53.6 -67.5 -44.9 -2.8 47.9 125.4 85 183 A L H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 5,-0.3 0.910 109.2 50.0 -52.5 -45.8 0.1 46.7 127.6 86 184 A Q H X>S+ 0 0 10 -4,-2.7 4,-1.4 1,-0.2 5,-1.0 0.921 113.6 45.3 -60.3 -43.7 -2.5 44.7 129.6 87 185 A E H <5S+ 0 0 60 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.941 115.9 43.8 -67.5 -49.0 -3.9 43.1 126.5 88 186 A V H <5S+ 0 0 6 -4,-3.2 -2,-0.2 1,-0.2 -1,-0.2 0.865 124.6 33.1 -70.8 -35.5 -0.6 42.3 124.7 89 187 A F H <5S- 0 0 4 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.588 97.3-136.4 -92.5 -14.3 1.1 40.9 127.8 90 188 A D T <5 + 0 0 30 -4,-1.4 273,-0.6 -5,-0.3 -3,-0.2 0.955 53.9 142.9 54.3 56.8 -2.1 39.4 129.4 91 189 A V < - 0 0 5 -5,-1.0 -1,-0.2 -6,-0.2 -32,-0.2 -0.814 53.9 -96.4-125.1 159.8 -1.1 40.7 132.8 92 190 A P - 0 0 0 0, 0.0 -32,-2.4 0, 0.0 2,-0.4 -0.433 34.5-150.9 -77.9 154.5 -3.0 42.1 135.8 93 191 A L E -de 60 135A 0 41,-2.3 43,-2.6 -34,-0.2 2,-0.4 -0.988 8.4-163.3-129.1 133.7 -3.3 45.8 136.4 94 192 A V E -de 61 136A 0 -34,-2.6 -32,-1.8 -2,-0.4 2,-0.5 -0.956 6.6-163.7-114.9 138.0 -3.7 47.9 139.6 95 193 A I E -de 62 137A 0 41,-3.0 43,-2.8 -2,-0.4 2,-0.5 -0.970 7.8-152.5-125.8 114.3 -4.8 51.5 139.4 96 194 A E E -de 63 138A 0 -34,-2.2 -32,-2.4 -2,-0.5 2,-0.7 -0.744 3.9-159.3 -92.1 126.0 -4.3 53.7 142.4 97 195 A L E -de 64 139A 0 41,-3.6 43,-2.4 -2,-0.5 2,-2.0 -0.903 11.5-152.0-100.4 112.3 -6.6 56.7 143.1 98 196 A T > + 0 0 7 -34,-2.4 4,-2.2 -2,-0.7 5,-0.2 -0.356 38.2 149.0 -87.3 63.7 -4.7 59.0 145.4 99 197 A D H > S+ 0 0 0 -2,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.877 72.6 53.7 -63.0 -37.6 -7.7 60.6 147.2 100 198 A D H > S+ 0 0 25 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.950 108.7 49.0 -62.6 -48.1 -5.6 61.1 150.4 101 199 A E H > S+ 0 0 59 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.898 109.6 52.3 -54.2 -45.6 -2.9 63.0 148.5 102 200 A K H X S+ 0 0 50 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.905 107.9 51.5 -58.0 -44.6 -5.5 65.2 146.8 103 201 A F H < S+ 0 0 68 -4,-2.2 -1,-0.2 1,-0.2 6,-0.2 0.905 108.4 52.2 -58.4 -43.9 -6.9 66.1 150.2 104 202 A L H < S+ 0 0 36 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.877 115.3 41.1 -60.8 -38.6 -3.4 67.0 151.4 105 203 A F H < S+ 0 0 89 -4,-1.9 2,-0.8 1,-0.2 -2,-0.2 0.793 111.6 55.6 -80.6 -30.2 -2.9 69.3 148.5 106 204 A K >< - 0 0 114 -4,-2.3 3,-2.2 -5,-0.2 -1,-0.2 -0.799 63.2-173.5-114.1 94.8 -6.3 71.0 148.3 107 205 A H T 3 S+ 0 0 156 -2,-0.8 -1,-0.1 1,-0.3 -4,-0.1 0.644 80.2 63.0 -70.9 -13.9 -7.1 72.5 151.7 108 206 A K T 3 S+ 0 0 99 2,-0.1 -1,-0.3 0, 0.0 2,-0.2 0.622 89.4 92.8 -78.9 -14.4 -10.7 73.4 150.8 109 207 A L < - 0 0 37 -3,-2.2 2,-0.2 -6,-0.2 3,-0.0 -0.526 63.0-148.9 -85.8 147.6 -11.5 69.7 150.3 110 208 A T > - 0 0 70 -2,-0.2 4,-1.7 1,-0.1 5,-0.2 -0.579 33.2-105.3-100.3 168.0 -13.0 67.4 152.9 111 209 A I H > S+ 0 0 67 -2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.921 123.6 54.0 -58.4 -43.4 -12.4 63.6 153.2 112 210 A N H > S+ 0 0 103 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.905 104.0 55.5 -57.8 -45.1 -15.9 63.1 151.8 113 211 A D H > S+ 0 0 53 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.930 110.2 44.0 -51.6 -51.8 -15.2 65.3 148.8 114 212 A V H X S+ 0 0 0 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.798 109.9 54.5 -73.4 -27.0 -12.1 63.2 147.8 115 213 A K H X S+ 0 0 95 -4,-1.9 4,-1.3 2,-0.2 -1,-0.2 0.886 112.4 46.1 -68.7 -39.5 -13.9 59.8 148.3 116 214 A N H X S+ 0 0 102 -4,-2.3 4,-2.0 -5,-0.2 -2,-0.2 0.920 112.6 49.1 -62.9 -47.6 -16.6 61.1 146.0 117 215 A F H X S+ 0 0 37 -4,-2.7 4,-2.9 1,-0.2 5,-0.2 0.865 105.2 59.2 -61.7 -39.7 -14.0 62.4 143.5 118 216 A A H X S+ 0 0 1 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.912 107.9 45.2 -54.4 -43.9 -12.2 59.0 143.6 119 217 A R H X S+ 0 0 50 -4,-1.3 4,-1.4 2,-0.2 -2,-0.2 0.894 114.3 48.3 -69.7 -38.7 -15.4 57.2 142.4 120 218 A E H X S+ 0 0 80 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.907 112.2 48.3 -68.4 -40.0 -16.1 59.8 139.7 121 219 A N H X S+ 0 0 3 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.869 105.8 59.4 -67.2 -35.5 -12.5 59.6 138.5 122 220 A A H X S+ 0 0 0 -4,-2.0 4,-2.9 -5,-0.2 -1,-0.2 0.853 101.5 54.3 -59.5 -37.1 -12.8 55.8 138.5 123 221 A K H X S+ 0 0 29 -4,-1.4 4,-2.2 2,-0.2 -1,-0.2 0.930 107.4 50.2 -62.3 -44.0 -15.7 56.0 136.0 124 222 A D H < S+ 0 0 7 -4,-1.5 4,-0.4 2,-0.2 -2,-0.2 0.916 112.9 46.8 -55.6 -45.5 -13.5 58.1 133.7 125 223 A I H >< S+ 0 0 0 -4,-2.2 3,-1.5 1,-0.2 4,-0.5 0.932 111.5 49.2 -66.3 -46.1 -10.8 55.4 134.0 126 224 A I H >X S+ 0 0 12 -4,-2.9 3,-2.1 1,-0.3 4,-1.3 0.881 101.9 65.5 -58.6 -38.2 -13.2 52.5 133.4 127 225 A A T 3< S+ 0 0 1 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.604 84.9 71.9 -62.5 -17.7 -14.5 54.4 130.3 128 226 A V T <4 S- 0 0 7 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.819 126.1 -97.1 -63.7 -30.6 -11.1 54.0 128.7 129 227 A G T <4 + 0 0 29 -3,-2.1 2,-0.3 -4,-0.5 -2,-0.2 0.780 65.6 157.2 115.4 54.7 -12.2 50.3 128.4 130 228 A F < - 0 0 15 -4,-1.3 -1,-0.1 -5,-0.1 -47,-0.0 -0.725 31.3-138.4-100.5 157.8 -10.9 48.1 131.2 131 229 A D > - 0 0 92 -2,-0.3 3,-0.9 1,-0.1 4,-0.4 -0.928 11.6-135.7-114.3 139.3 -12.4 44.9 132.4 132 230 A P G > S+ 0 0 31 0, 0.0 3,-0.6 0, 0.0 -1,-0.1 0.742 94.4 77.1 -69.1 -20.4 -12.7 44.0 136.1 133 231 A K G 3 S+ 0 0 46 1,-0.2 228,-2.9 227,-0.1 3,-0.0 0.819 116.6 15.1 -57.4 -31.7 -11.4 40.4 135.7 134 232 A N G < S+ 0 0 32 -3,-0.9 -41,-2.3 226,-0.2 2,-0.4 0.203 117.0 79.2-129.1 14.9 -7.8 41.6 135.4 135 233 A T E < -e 93 0A 0 -3,-0.6 2,-0.5 -4,-0.4 -41,-0.2 -0.994 50.0-169.8-131.6 129.3 -8.1 45.2 136.7 136 234 A F E -e 94 0A 0 -43,-2.6 -41,-3.0 -2,-0.4 2,-0.5 -0.980 5.9-171.5-118.3 119.2 -8.2 46.5 140.3 137 235 A I E -e 95 0A 0 217,-2.0 2,-0.4 -2,-0.5 -41,-0.2 -0.968 16.9-178.5-111.4 118.0 -9.0 50.2 140.7 138 236 A F E -e 96 0A 2 -43,-2.8 -41,-3.6 -2,-0.5 2,-0.4 -0.952 30.9-136.9-130.0 144.8 -8.6 51.4 144.3 139 237 A S E > -e 97 0A 6 -2,-0.4 4,-2.3 216,-0.2 5,-0.3 -0.765 23.0-137.4 -81.7 129.6 -9.0 54.5 146.5 140 238 A D H > S+ 0 0 0 -43,-2.4 4,-2.1 -2,-0.4 -1,-0.1 0.939 105.9 51.1 -51.6 -49.2 -6.1 54.8 148.9 141 239 A L H 4 S+ 0 0 59 -44,-0.3 -1,-0.2 1,-0.2 -43,-0.1 0.907 114.2 43.2 -55.2 -43.9 -8.5 55.8 151.7 142 240 A Q H 4 S+ 0 0 126 1,-0.2 -1,-0.2 -27,-0.0 -2,-0.2 0.803 120.8 38.1 -76.9 -32.2 -10.7 52.7 151.0 143 241 A Y H < S+ 0 0 39 -4,-2.3 5,-0.2 213,-0.0 -1,-0.2 0.619 83.8 122.2 -95.5 -15.3 -7.9 50.1 150.6 144 242 A M < + 0 0 66 -4,-2.1 2,-0.2 -5,-0.3 3,-0.1 -0.224 53.1 49.7 -57.9 135.6 -5.4 51.4 153.3 145 243 A G S >> S+ 0 0 29 1,-0.2 4,-2.2 0, 0.0 3,-0.9 -0.772 77.0 50.0 132.0-175.3 -4.6 48.8 155.9 146 244 A G H 3> S- 0 0 58 -2,-0.2 4,-2.2 1,-0.2 -1,-0.2 -0.067 120.7 -14.5 52.5-143.4 -3.4 45.2 156.0 147 245 A A H 3> S+ 0 0 27 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.767 135.8 61.3 -63.6 -28.7 -0.4 44.1 153.9 148 246 A F H <> S+ 0 0 2 -3,-0.9 4,-2.5 45,-0.3 -2,-0.2 0.968 108.4 42.5 -61.6 -51.3 -0.7 47.4 151.9 149 247 A Y H X S+ 0 0 124 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.903 109.4 58.0 -64.9 -36.9 -0.1 49.4 155.1 150 248 A E H X S+ 0 0 113 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.947 109.8 44.9 -54.7 -43.1 2.7 47.0 156.1 151 249 A T H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.905 109.0 55.7 -69.5 -40.6 4.4 47.8 152.8 152 250 A V H X S+ 0 0 1 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.936 109.3 48.4 -51.1 -48.1 3.8 51.6 153.3 153 251 A V H X S+ 0 0 66 -4,-2.7 4,-1.0 1,-0.2 -2,-0.2 0.944 111.0 49.0 -62.9 -49.1 5.6 51.3 156.7 154 252 A R H >< S+ 0 0 89 -4,-2.4 3,-0.7 1,-0.2 4,-0.4 0.915 114.1 46.7 -52.6 -47.2 8.5 49.4 155.2 155 253 A V H >< S+ 0 0 0 -4,-2.9 3,-2.2 1,-0.2 4,-0.3 0.925 105.3 59.1 -61.8 -44.5 8.9 52.0 152.4 156 254 A S H 3< S+ 0 0 43 -4,-2.8 3,-0.5 1,-0.3 -1,-0.2 0.684 99.3 58.2 -64.8 -21.3 8.6 55.0 154.8 157 255 A R T << S+ 0 0 204 -4,-1.0 -1,-0.3 -3,-0.7 -2,-0.2 0.609 103.0 55.6 -77.1 -16.5 11.7 53.8 156.7 158 256 A Q S < S+ 0 0 58 -3,-2.2 2,-0.5 -4,-0.4 -1,-0.2 0.303 94.5 71.1-103.4 1.5 13.8 53.9 153.5 159 257 A I - 0 0 27 -3,-0.5 2,-0.1 -4,-0.3 -1,-0.1 -0.987 69.5-150.2-126.1 124.3 13.3 57.5 152.5 160 258 A T > - 0 0 81 -2,-0.5 4,-2.0 1,-0.1 5,-0.1 -0.428 28.6-111.1 -88.1 161.5 14.8 60.4 154.4 161 259 A G H > S+ 0 0 45 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.872 118.6 59.3 -52.9 -42.1 13.5 64.0 154.8 162 260 A S H > S+ 0 0 93 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.928 106.8 45.7 -53.6 -48.4 16.5 65.2 152.7 163 261 A T H >>S+ 0 0 44 1,-0.2 4,-3.3 2,-0.2 5,-1.0 0.895 109.6 54.9 -63.7 -41.9 15.3 63.0 149.7 164 262 A A H <5S+ 0 0 4 -4,-2.0 6,-1.4 3,-0.2 4,-0.4 0.871 115.1 39.9 -59.7 -38.2 11.7 64.1 150.2 165 263 A K H X5S+ 0 0 85 -4,-2.2 4,-1.0 4,-0.2 -2,-0.2 0.958 121.6 41.1 -73.9 -50.8 12.9 67.8 149.9 166 264 A A H <5S+ 0 0 87 -4,-3.1 -2,-0.2 -5,-0.2 -3,-0.2 0.853 130.7 23.1 -67.5 -40.7 15.4 67.2 147.1 167 265 A V T <5S+ 0 0 59 -4,-3.3 -3,-0.2 -5,-0.2 -1,-0.1 0.848 129.3 39.8 -97.3 -42.7 13.4 64.8 144.9 168 266 A F T 4 - 0 0 79 -2,-0.1 3,-2.3 4,-0.1 8,-0.1 -0.872 41.7 -86.8-137.9 175.5 9.9 72.1 152.3 172 270 A D T 3 S+ 0 0 125 1,-0.3 4,-0.1 -2,-0.3 -2,-0.0 0.684 120.9 62.3 -64.1 -18.8 9.4 72.6 156.0 173 271 A S T 3 S+ 0 0 106 2,-0.1 -1,-0.3 0, 0.0 2,-0.2 0.618 87.7 94.5 -78.1 -11.3 6.2 74.7 155.6 174 272 A D S < S- 0 0 34 -3,-2.3 -4,-0.0 1,-0.1 5,-0.0 -0.501 86.4-101.9 -80.9 151.0 4.6 71.6 153.9 175 273 A C >> - 0 0 52 -2,-0.2 4,-1.7 -71,-0.2 3,-0.5 -0.289 23.8-117.2 -74.9 157.0 2.5 69.3 156.1 176 274 A I H 3> S+ 0 0 146 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.727 113.3 65.7 -68.8 -22.6 3.9 65.9 157.3 177 275 A G H 3> S+ 0 0 23 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.928 104.0 45.5 -58.9 -44.4 1.2 64.1 155.2 178 276 A K H <4 S+ 0 0 25 -3,-0.5 4,-0.5 1,-0.2 -2,-0.2 0.914 110.2 53.3 -66.5 -42.0 2.8 65.5 152.1 179 277 A F H < S+ 0 0 46 -4,-1.7 3,-0.3 1,-0.2 -1,-0.2 0.898 116.4 40.0 -55.3 -39.7 6.3 64.5 153.3 180 278 A H H >< S+ 0 0 74 -4,-1.7 3,-2.7 1,-0.2 4,-0.4 0.734 88.5 92.8 -83.2 -24.0 5.1 61.0 153.9 181 279 A F T >X S+ 0 0 9 -4,-1.5 4,-1.9 1,-0.3 3,-1.3 0.733 72.9 65.8 -58.0 -34.3 2.9 60.4 150.9 182 280 A A H 3> S+ 0 0 8 -4,-0.5 4,-3.1 -3,-0.3 -1,-0.3 0.800 92.7 67.4 -52.6 -29.8 5.6 58.8 148.5 183 281 A S H <> S+ 0 0 8 -3,-2.7 4,-1.4 1,-0.2 -1,-0.3 0.899 105.5 40.7 -53.7 -45.2 5.6 56.0 151.1 184 282 A I H <> S+ 0 0 15 -3,-1.3 4,-1.0 -4,-0.4 -2,-0.2 0.930 116.6 46.5 -72.5 -50.6 2.0 55.1 150.0 185 283 A Q H >< S+ 0 0 19 -4,-1.9 3,-0.9 1,-0.2 4,-0.3 0.937 114.6 48.3 -59.2 -47.1 2.5 55.7 146.3 186 284 A I H >< S+ 0 0 0 -4,-3.1 3,-1.9 1,-0.2 -1,-0.2 0.863 101.4 63.7 -65.5 -33.4 5.7 53.6 146.2 187 285 A A H >< S+ 0 0 0 -4,-1.4 3,-1.5 -5,-0.3 6,-0.3 0.814 92.9 65.7 -59.0 -28.6 4.1 50.8 148.2 188 286 A T T << S+ 0 0 0 -4,-1.0 -1,-0.3 -3,-0.9 -2,-0.2 0.602 87.7 67.7 -70.8 -11.6 1.7 50.3 145.2 189 287 A A T < S+ 0 0 1 -3,-1.9 17,-0.3 -4,-0.3 -1,-0.3 0.517 91.4 79.0 -83.6 -6.3 4.7 49.2 143.0 190 288 A F S X S- 0 0 1 -3,-1.5 3,-1.8 -4,-0.2 4,-0.1 -0.890 73.2-142.6-113.8 135.0 5.1 46.0 145.2 191 289 A P G > S+ 0 0 2 0, 0.0 3,-2.3 0, 0.0 8,-0.3 0.720 96.0 76.4 -66.6 -21.6 3.0 42.8 145.0 192 290 A S G 3 S+ 0 0 13 10,-0.3 -41,-0.1 1,-0.3 -42,-0.1 0.743 88.2 62.3 -57.4 -22.7 3.2 42.5 148.8 193 291 A S G < S+ 0 0 0 -3,-1.8 -45,-0.3 -6,-0.3 -1,-0.3 0.555 105.2 46.6 -79.4 -7.7 0.5 45.3 148.9 194 292 A F X>> + 0 0 0 -3,-2.3 4,-2.6 -47,-0.1 5,-1.8 -0.373 59.4 149.2-132.8 51.6 -2.0 43.0 147.0 195 293 A P T 345S+ 0 0 57 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.849 84.6 33.3 -60.0 -33.0 -2.0 39.6 148.6 196 294 A N T 345S+ 0 0 121 -3,-0.1 -2,-0.0 2,-0.1 -3,-0.0 0.360 124.9 44.0-104.3 5.7 -5.7 38.9 147.7 197 295 A V T <45S+ 0 0 1 -3,-1.0 163,-2.9 162,-0.2 -1,-0.1 0.756 134.1 10.1-110.3 -52.7 -5.7 40.8 144.4 198 296 A L T <5S- 0 0 2 -4,-2.6 -2,-0.1 -7,-0.2 -6,-0.1 0.861 71.9-165.2 -91.1 -51.5 -2.4 39.7 142.8 199 297 A G < + 0 0 47 -5,-1.8 -7,-0.1 -8,-0.3 -3,-0.1 0.864 40.0 144.4 62.7 37.7 -1.3 36.8 145.0 200 298 A L - 0 0 24 -9,-0.3 -1,-0.2 -6,-0.2 -6,-0.1 -0.689 57.5 -85.1-106.7 154.4 2.1 37.0 143.4 201 299 A P > - 0 0 87 0, 0.0 3,-2.1 0, 0.0 -1,-0.1 -0.267 41.4-110.7 -56.5 149.2 5.6 36.4 145.0 202 300 A D T 3 S+ 0 0 88 1,-0.3 29,-0.6 -11,-0.1 -10,-0.3 0.779 116.1 55.9 -47.9 -37.9 7.2 39.4 146.7 203 301 A K T 3 S+ 0 0 126 27,-0.2 -1,-0.3 -12,-0.1 27,-0.1 0.128 75.3 120.8 -89.3 20.7 9.8 39.7 144.0 204 302 A T < - 0 0 7 -3,-2.1 27,-0.3 -4,-0.1 2,-0.2 -0.727 56.6-141.4 -80.8 126.2 7.4 40.0 141.1 205 303 A P - 0 0 9 0, 0.0 -146,-1.6 0, 0.0 2,-0.3 -0.497 6.4-141.6 -87.7 159.4 8.0 43.4 139.4 206 304 A C E -c 59 0A 0 -17,-0.3 28,-2.4 25,-0.3 2,-0.5 -0.767 10.0-132.6-108.8 165.5 5.6 45.9 137.9 207 305 A L E -cf 60 234A 0 -148,-2.1 -146,-1.8 -2,-0.3 28,-0.2 -0.975 21.9-164.2-116.3 129.7 5.9 47.9 134.8 208 306 A I E - f 0 235A 2 26,-2.8 28,-1.8 -2,-0.5 2,-0.3 -0.932 12.3-151.0-125.0 107.9 5.0 51.6 135.1 209 307 A P E + f 0 236A 8 0, 0.0 2,-0.3 0, 0.0 28,-0.2 -0.625 38.1 155.0 -67.7 134.3 4.3 54.0 132.2 210 308 A C E - f 0 237A 9 26,-2.9 28,-2.7 -2,-0.3 2,-0.2 -0.921 46.0 -84.9-152.2 174.0 5.3 57.5 133.3 211 309 A A E > - f 0 238A 23 -2,-0.3 3,-1.8 26,-0.2 4,-0.2 -0.593 42.3-116.1 -83.0 149.6 6.4 60.9 132.1 212 310 A I G > S+ 0 0 0 26,-2.0 3,-1.8 1,-0.3 -1,-0.1 0.863 113.5 56.8 -54.2 -39.0 10.1 61.4 131.5 213 311 A D G 3 S+ 0 0 89 1,-0.3 4,-0.3 2,-0.1 -1,-0.3 0.524 95.1 66.6 -78.3 -2.2 10.5 64.0 134.3 214 312 A Q G <> S+ 0 0 88 -3,-1.8 4,-2.4 1,-0.2 -1,-0.3 0.442 74.1 97.1 -87.5 -3.1 9.2 61.5 136.8 215 313 A D H <> S+ 0 0 0 -3,-1.8 4,-1.8 1,-0.2 5,-0.2 0.905 78.7 51.3 -57.1 -44.5 12.3 59.3 136.2 216 314 A P H > S+ 0 0 37 0, 0.0 4,-0.9 0, 0.0 -1,-0.2 0.927 110.5 50.6 -59.5 -40.6 14.2 60.7 139.3 217 315 A Y H >> S+ 0 0 47 -4,-0.3 4,-1.5 1,-0.2 3,-1.0 0.936 110.3 48.9 -56.1 -51.0 11.2 59.9 141.5 218 316 A F H 3X S+ 0 0 10 -4,-2.4 4,-2.2 1,-0.3 -1,-0.2 0.740 102.4 62.1 -66.6 -18.3 11.0 56.4 140.1 219 317 A R H 3X S+ 0 0 118 -4,-1.8 4,-1.9 -5,-0.2 -1,-0.3 0.777 101.8 52.6 -74.0 -24.8 14.7 55.9 140.8 220 318 A V H S+ 0 0 0 -4,-2.7 5,-2.9 1,-0.2 4,-0.6 0.923 107.6 48.3 -52.6 -48.6 12.8 48.1 146.0 226 324 A D H ><5S+ 0 0 79 -4,-1.9 3,-1.1 1,-0.2 -1,-0.2 0.927 111.5 49.2 -55.8 -48.6 16.4 47.1 146.3 227 325 A K H 3<5S+ 0 0 105 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.834 113.5 46.0 -65.6 -31.3 16.5 48.0 150.0 228 326 A L H 3<5S- 0 0 26 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.489 113.0-118.1 -85.9 -3.1 13.3 46.0 150.7 229 327 A K T <<5S+ 0 0 149 -3,-1.1 -3,-0.2 -4,-0.6 2,-0.2 0.831 75.4 125.0 61.2 34.5 14.6 43.0 148.7 230 328 A Y S - 0 0 60 1,-0.1 3,-1.5 -2,-0.1 28,-0.3 -0.495 21.9-119.1 -69.2 145.1 -0.6 72.1 125.6 244 342 A L T 3 S+ 0 0 1 7,-0.9 27,-2.3 1,-0.3 48,-0.2 0.901 112.6 43.5 -51.7 -47.1 -3.5 73.3 123.4 245 343 A Q T 3 0 0 88 6,-0.3 -1,-0.3 1,-0.2 27,-0.1 0.403 360.0 360.0 -87.3 3.5 -2.2 76.9 123.2 246 344 A G < 0 0 79 -3,-1.5 -1,-0.2 25,-0.1 -2,-0.1 -0.267 360.0 360.0 70.4 360.0 1.4 75.9 122.6 247 ! 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 0.0 248 353 A D > 0 0 133 0, 0.0 3,-1.3 0, 0.0 4,-0.4 0.000 360.0 360.0 360.0-153.9 -9.3 77.3 132.5 249 354 A D G > + 0 0 64 1,-0.2 3,-0.5 2,-0.1 5,-0.1 0.820 360.0 55.3 -58.1 -32.9 -11.8 76.0 129.9 250 355 A T G 3 S+ 0 0 35 1,-0.2 -1,-0.2 3,-0.1 3,-0.1 0.395 95.9 62.8 -86.6 0.3 -9.6 77.4 127.1 251 356 A T G < S+ 0 0 73 -3,-1.3 -7,-0.9 1,-0.2 -6,-0.3 0.568 106.9 26.1-106.5 -4.2 -6.3 75.7 127.9 252 357 A A < - 0 0 11 -3,-0.5 2,-0.5 -4,-0.4 -1,-0.2 -0.997 69.8-118.4-152.5 151.3 -7.3 72.0 127.4 253 358 A I - 0 0 3 -2,-0.3 -180,-3.1 -3,-0.1 -179,-0.3 -0.815 38.7-153.1 -82.0 129.7 -9.8 69.7 125.7 254 359 A F B > -G 72 0B 33 -2,-0.5 3,-2.2 -182,-0.3 -182,-0.2 -0.794 24.2-122.1-107.4 153.0 -11.8 67.9 128.4 255 360 A M T 3 S+ 0 0 2 -184,-2.7 -183,-0.1 -2,-0.3 85,-0.1 0.562 113.9 57.0 -69.7 -8.5 -13.4 64.5 128.2 256 361 A T T 3 S+ 0 0 90 -185,-0.3 -1,-0.3 2,-0.0 -184,-0.1 0.351 79.9 123.9 -95.8 1.3 -16.8 66.2 128.9 257 362 A D < - 0 0 11 -3,-2.2 -4,-0.0 1,-0.1 0, 0.0 -0.339 60.2-126.6 -69.4 141.6 -16.5 68.6 125.9 258 363 A T > - 0 0 59 1,-0.1 4,-2.3 -2,-0.0 5,-0.2 -0.384 30.0-100.8 -76.9 165.6 -19.4 68.6 123.4 259 364 A P H > S+ 0 0 77 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.913 125.8 47.8 -54.3 -43.0 -18.7 68.1 119.7 260 365 A K H > S+ 0 0 62 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.872 108.8 52.9 -69.3 -33.8 -19.0 71.9 119.1 261 366 A Q H > S+ 0 0 90 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.877 108.3 50.9 -66.6 -39.1 -16.7 72.7 122.1 262 367 A I H X S+ 0 0 2 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.934 112.0 47.8 -59.4 -47.5 -14.0 70.4 120.6 263 368 A Q H X S+ 0 0 98 -4,-1.9 4,-2.6 -5,-0.2 5,-0.2 0.934 113.4 46.8 -58.1 -50.3 -14.3 72.2 117.2 264 369 A K H X S+ 0 0 56 -4,-2.6 4,-3.3 1,-0.2 5,-0.4 0.905 112.4 50.1 -63.5 -41.4 -14.2 75.7 118.8 265 370 A K H X>S+ 0 0 17 -4,-2.4 4,-2.2 2,-0.2 5,-0.9 0.915 113.4 43.8 -67.3 -45.0 -11.2 74.9 121.0 266 371 A I H X5S+ 0 0 0 -4,-2.4 4,-1.3 3,-0.2 -2,-0.2 0.966 120.3 42.8 -61.3 -51.2 -9.1 73.4 118.2 267 372 A N H <5S+ 0 0 81 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.928 125.8 31.0 -60.1 -49.4 -10.0 76.2 115.8 268 373 A K H <5S+ 0 0 69 -4,-3.3 -3,-0.2 -5,-0.2 -1,-0.2 0.864 134.1 21.1 -79.2 -39.3 -9.7 79.1 118.3 269 374 A Y H <5S+ 0 0 92 -4,-2.2 2,-0.2 -5,-0.4 -3,-0.2 0.675 83.6 109.9-112.6 -22.7 -6.9 77.9 120.6 270 375 A A S < S- 0 0 48 1,-0.1 4,-2.3 0, 0.0 -2,-0.2 -0.988 78.2-123.1-144.2 154.5 -1.4 82.9 104.8 278 383 A A H > S+ 0 0 45 -2,-0.3 4,-2.7 2,-0.2 5,-0.2 0.887 114.4 54.2 -59.1 -42.1 -2.0 80.1 102.3 279 384 A D H > S+ 0 0 139 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.892 111.8 43.8 -57.3 -44.7 0.5 81.8 99.8 280 385 A L H > S+ 0 0 70 2,-0.2 4,-3.3 1,-0.2 5,-0.5 0.863 112.9 53.4 -67.8 -36.4 3.2 81.8 102.5 281 386 A H H X S+ 0 0 2 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.920 107.6 48.7 -66.6 -42.9 2.3 78.2 103.5 282 387 A R H < S+ 0 0 121 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.901 119.5 41.5 -60.3 -38.7 2.6 76.9 99.9 283 388 A E H < S+ 0 0 155 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.912 131.0 19.7 -76.7 -45.2 6.0 78.6 99.7 284 389 A L H < S- 0 0 104 -4,-3.3 -3,-0.2 -5,-0.1 -2,-0.2 0.680 95.8-141.7-102.4 -22.6 7.5 77.9 103.2 285 390 A G < - 0 0 4 -4,-2.2 2,-0.2 -5,-0.5 30,-0.2 0.016 19.5 -85.5 76.7 171.0 5.5 74.9 104.4 286 391 A G - 0 0 9 28,-2.8 -12,-0.3 33,-0.1 31,-0.1 -0.706 27.2-123.3-108.7 165.5 4.3 74.2 107.9 287 392 A N >> - 0 0 68 -14,-2.5 3,-1.2 -2,-0.2 4,-0.6 -0.894 19.5-174.6-111.1 102.4 6.0 72.5 110.9 288 393 A P T 34 S+ 0 0 0 0, 0.0 3,-0.3 0, 0.0 7,-0.2 0.743 77.1 75.6 -68.5 -21.4 4.0 69.5 112.1 289 394 A D T 34 S+ 0 0 93 1,-0.2 22,-0.0 -16,-0.1 -2,-0.0 0.769 111.0 25.6 -58.1 -30.3 6.5 69.0 115.0 290 395 A V T <4 S+ 0 0 68 -3,-1.2 2,-0.7 -17,-0.0 -1,-0.2 0.372 94.0 112.6-112.5 -3.7 4.9 72.0 116.8 291 396 A D X - 0 0 0 -4,-0.6 4,-2.5 -3,-0.3 -19,-0.2 -0.650 52.8-159.3 -77.8 113.1 1.4 71.9 115.2 292 397 A V H > S+ 0 0 4 -21,-2.1 4,-3.0 -2,-0.7 5,-0.3 0.903 90.1 54.8 -60.6 -43.2 -1.0 70.9 118.0 293 398 A A H > S+ 0 0 1 -22,-0.5 4,-2.4 1,-0.2 -1,-0.2 0.935 112.2 44.2 -59.6 -44.7 -3.7 69.7 115.5 294 399 A Y H > S+ 0 0 24 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.920 113.9 50.4 -62.8 -45.0 -1.2 67.3 113.9 295 400 A Q H X S+ 0 0 32 -4,-2.5 4,-1.4 2,-0.2 -2,-0.2 0.937 113.6 44.4 -61.1 -45.6 0.2 66.2 117.3 296 401 A Y H X S+ 0 0 5 -4,-3.0 4,-1.7 1,-0.2 -1,-0.2 0.895 111.5 53.4 -66.9 -40.6 -3.3 65.4 118.6 297 402 A L H X S+ 0 0 0 -4,-2.4 4,-1.5 -5,-0.3 -1,-0.2 0.922 109.5 49.9 -56.2 -44.7 -4.3 63.7 115.4 298 403 A S H < S+ 0 0 3 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.748 109.9 49.5 -71.2 -27.1 -1.3 61.5 115.7 299 404 A F H < S+ 0 0 15 -4,-1.4 -1,-0.2 -3,-0.2 -2,-0.2 0.794 121.1 34.5 -74.8 -32.4 -2.0 60.5 119.3 300 405 A F H < S+ 0 0 26 -4,-1.7 2,-0.4 -5,-0.2 -2,-0.2 0.434 107.1 67.5-111.2 0.3 -5.6 59.6 118.6 301 406 A K < - 0 0 68 -4,-1.5 2,-0.9 -5,-0.1 -1,-0.1 -0.987 63.0-154.2-118.0 128.8 -5.6 58.1 115.1 302 407 A D + 0 0 97 -2,-0.4 2,-0.1 1,-0.0 -4,-0.1 -0.790 54.6 110.5-100.6 92.5 -3.8 54.8 114.4 303 408 A D > - 0 0 68 -2,-0.9 4,-2.6 -5,-0.1 5,-0.2 -0.596 39.9-173.2-161.7 90.8 -2.9 55.0 110.7 304 409 A D H > S+ 0 0 70 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.864 87.1 49.4 -57.6 -42.3 0.9 55.2 110.0 305 410 A V H > S+ 0 0 98 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.949 113.8 44.5 -63.7 -50.7 0.4 55.8 106.2 306 411 A F H > S+ 0 0 60 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.909 115.5 47.4 -58.6 -46.6 -2.2 58.5 106.6 307 412 A L H X S+ 0 0 5 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.894 109.5 52.3 -69.6 -38.7 -0.3 60.3 109.3 308 413 A K H X S+ 0 0 127 -4,-2.5 4,-2.8 -5,-0.2 -1,-0.2 0.899 110.5 49.9 -58.2 -42.0 3.0 60.2 107.4 309 414 A E H X S+ 0 0 96 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.902 111.7 47.7 -64.8 -44.6 1.1 61.7 104.4 310 415 A C H X S+ 0 0 6 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.932 113.2 48.6 -57.6 -48.7 -0.3 64.4 106.7 311 416 A Y H X S+ 0 0 52 -4,-2.8 4,-2.0 2,-0.2 -2,-0.2 0.952 115.8 42.7 -57.5 -51.6 3.2 65.1 108.2 312 417 A D H X S+ 0 0 63 -4,-2.8 4,-1.8 1,-0.2 -2,-0.2 0.884 113.8 50.0 -67.8 -41.6 4.9 65.3 104.7 313 418 A K H X>S+ 0 0 96 -4,-2.6 6,-1.8 2,-0.2 5,-1.0 0.779 108.1 54.6 -69.0 -29.5 2.2 67.4 103.0 314 419 A Y H ><5S+ 0 0 0 -4,-2.0 -28,-2.8 -5,-0.2 3,-0.7 0.955 110.4 46.0 -63.4 -48.6 2.2 69.8 105.9 315 420 A K H 3<5S+ 0 0 113 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.812 114.5 47.1 -62.7 -34.4 6.0 70.3 105.4 316 421 A S H 3<5S- 0 0 53 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.583 112.5-119.5 -83.8 -13.2 5.6 70.6 101.6 317 422 A G T <<5S+ 0 0 2 -4,-0.8 -3,-0.2 -3,-0.7 -4,-0.1 0.401 83.0 116.8 91.7 -2.2 2.7 73.1 102.0 318 423 A E S - 0 0 33 -2,-0.5 4,-2.2 1,-0.1 3,-0.5 -0.417 23.0-111.3 -84.2 161.1 -3.1 73.9 105.1 321 426 A S H > S+ 0 0 23 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.889 116.3 53.2 -58.2 -43.7 -3.4 74.4 108.8 322 427 A G H > S+ 0 0 49 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.802 109.3 50.3 -62.4 -29.8 -7.3 74.7 108.7 323 428 A E H > S+ 0 0 88 -3,-0.5 4,-1.9 2,-0.2 -2,-0.2 0.901 109.5 49.6 -79.0 -43.4 -7.4 71.4 106.9 324 429 A M H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.903 111.1 51.3 -52.7 -46.4 -5.1 69.8 109.6 325 430 A K H X S+ 0 0 20 -4,-2.7 4,-3.1 1,-0.2 -2,-0.2 0.932 107.3 52.1 -60.8 -45.4 -7.4 71.2 112.2 326 431 A K H X S+ 0 0 58 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.884 110.9 47.6 -60.0 -37.2 -10.5 69.8 110.5 327 432 A L H X S+ 0 0 44 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.935 113.2 48.1 -68.8 -44.8 -8.9 66.3 110.5 328 433 A C H X S+ 0 0 0 -4,-2.6 4,-3.2 1,-0.2 5,-0.3 0.948 111.0 51.5 -57.5 -50.5 -7.9 66.6 114.2 329 434 A I H X S+ 0 0 11 -4,-3.1 4,-2.8 1,-0.2 5,-0.2 0.924 109.5 48.6 -54.4 -49.7 -11.4 67.8 115.1 330 435 A E H X S+ 0 0 127 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.912 114.1 47.0 -58.2 -43.9 -13.1 64.8 113.4 331 436 A T H X S+ 0 0 17 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.940 115.1 44.5 -64.6 -47.1 -10.7 62.3 115.1 332 437 A L H X S+ 0 0 0 -4,-3.2 4,-3.1 1,-0.2 5,-0.3 0.876 110.2 55.9 -69.9 -35.6 -11.0 63.9 118.6 333 438 A Q H X S+ 0 0 55 -4,-2.8 4,-2.4 -5,-0.3 -1,-0.2 0.926 109.1 46.1 -59.9 -45.0 -14.8 64.1 118.2 334 439 A E H X S+ 0 0 147 -4,-1.9 4,-2.1 -5,-0.2 -2,-0.2 0.929 115.5 47.0 -62.8 -44.9 -15.1 60.4 117.5 335 440 A F H X S+ 0 0 44 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.943 115.2 44.1 -61.6 -50.7 -12.8 59.6 120.4 336 441 A V H X S+ 0 0 1 -4,-3.1 4,-2.6 1,-0.2 -2,-0.2 0.888 112.8 52.0 -66.0 -39.8 -14.5 61.8 123.0 337 442 A K H X S+ 0 0 117 -4,-2.4 4,-2.0 -5,-0.3 -1,-0.2 0.919 110.7 46.6 -64.1 -45.8 -18.0 60.8 121.9 338 443 A A H X S+ 0 0 33 -4,-2.1 4,-2.2 -5,-0.2 -2,-0.2 0.920 113.1 51.2 -61.8 -46.3 -17.3 57.0 122.3 339 444 A F H X S+ 0 0 2 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.925 109.4 49.1 -50.7 -55.3 -15.6 57.7 125.7 340 445 A Q H X S+ 0 0 65 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.878 110.6 51.8 -55.5 -41.2 -18.7 59.7 126.9 341 446 A E H X S+ 0 0 101 -4,-2.0 4,-0.5 1,-0.2 -1,-0.2 0.902 111.3 46.1 -62.5 -43.6 -20.9 56.8 125.8 342 447 A R H >< S+ 0 0 93 -4,-2.2 3,-0.6 1,-0.2 -2,-0.2 0.837 110.1 54.5 -68.9 -32.5 -18.8 54.3 127.7 343 448 A R H >< S+ 0 0 59 -4,-2.5 3,-2.0 1,-0.2 -2,-0.2 0.885 100.3 58.8 -69.0 -38.4 -18.7 56.5 130.8 344 449 A A H 3< S+ 0 0 81 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.721 100.2 60.9 -60.1 -20.1 -22.5 56.7 130.8 345 450 A Q T << S+ 0 0 156 -3,-0.6 2,-0.7 -4,-0.5 -1,-0.3 0.307 84.2 90.5 -91.4 8.4 -22.4 52.8 131.1 346 451 A V < + 0 0 8 -3,-2.0 2,-0.2 4,-0.1 -223,-0.1 -0.914 54.4 165.0-105.6 108.1 -20.5 52.9 134.4 347 452 A D > - 0 0 82 -2,-0.7 4,-2.7 1,-0.0 3,-0.2 -0.561 55.6 -84.6-112.6-177.8 -22.8 53.0 137.4 348 453 A E H > S+ 0 0 90 1,-0.2 4,-2.2 2,-0.2 -1,-0.0 0.901 128.8 52.7 -56.0 -42.2 -22.3 52.3 141.1 349 454 A E H > S+ 0 0 119 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.891 109.5 48.0 -59.7 -41.8 -22.6 48.6 140.6 350 455 A T H >> S+ 0 0 31 -3,-0.2 4,-1.0 1,-0.2 3,-1.0 0.940 108.7 54.9 -65.2 -45.9 -20.0 48.6 137.8 351 456 A L H >X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.3 3,-1.1 0.916 102.6 57.1 -50.3 -46.3 -17.7 50.6 140.1 352 457 A D H 3X S+ 0 0 73 -4,-2.2 4,-1.9 1,-0.3 -1,-0.3 0.794 98.4 60.5 -60.3 -28.6 -18.0 48.0 142.8 353 458 A K H << S+ 0 0 102 -4,-1.0 -1,-0.3 -3,-1.0 -2,-0.2 0.834 116.1 32.7 -67.2 -31.8 -16.7 45.3 140.4 354 459 A F H << S+ 0 0 4 -3,-1.1 -217,-2.0 -4,-1.0 -2,-0.2 0.793 123.7 43.6 -89.4 -36.1 -13.4 47.2 140.0 355 460 A M H < S+ 0 0 6 -4,-2.5 -216,-0.2 -5,-0.2 -3,-0.2 0.673 90.8 82.8 -96.1 -19.5 -13.0 48.8 143.4 356 461 A V S < S- 0 0 83 -4,-1.9 -219,-0.1 -5,-0.3 -213,-0.0 -0.750 98.1 -99.9 -80.7 130.6 -14.0 45.9 145.8 357 462 A P + 0 0 72 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 -0.295 57.2 163.3 -55.6 130.5 -10.8 43.8 146.3 358 463 A H - 0 0 47 -4,-0.2 2,-0.5 -226,-0.1 -162,-0.0 -0.979 45.8 -95.4-146.1 151.7 -11.0 40.7 144.1 359 464 A K - 0 0 109 -2,-0.3 -162,-0.2 1,-0.1 -161,-0.2 -0.583 42.5-134.0 -73.9 118.0 -8.5 38.2 142.8 360 465 A L - 0 0 3 -163,-2.9 2,-0.4 -2,-0.5 -226,-0.2 -0.455 15.3-153.0 -72.7 142.7 -7.4 39.2 139.4 361 466 A V + 0 0 90 -228,-2.9 2,-0.3 -2,-0.1 -270,-0.0 -0.975 29.4 140.0-121.2 135.6 -7.2 36.5 136.7 362 467 A W + 0 0 64 -2,-0.4 -271,-0.1 -270,-0.1 -272,-0.1 -0.927 38.9 63.5-157.3 175.8 -4.8 36.7 133.8 363 468 A G S S+ 0 0 51 -273,-0.6 4,-0.1 -2,-0.3 -272,-0.1 0.601 73.9 107.5 75.4 12.1 -2.5 34.6 131.6 364 469 A E + 0 0 93 2,-0.1 2,-0.1 -274,-0.0 -1,-0.1 0.607 49.0 101.8 -97.4 -17.6 -5.5 32.6 130.4 365 470 A K S S- 0 0 63 1,-0.1 2,-0.2 -275,-0.1 -3,-0.0 -0.395 87.1 -99.8 -67.0 142.6 -5.4 34.1 126.9 366 471 A E - 0 0 190 -2,-0.1 2,-0.1 1,-0.1 -1,-0.1 -0.496 40.9-130.5 -63.6 127.5 -3.9 32.0 124.2 367 472 A R - 0 0 70 -2,-0.2 3,-0.1 1,-0.1 -340,-0.1 -0.467 7.6-146.9 -79.6 152.2 -0.3 33.1 123.4 368 473 A L S S+ 0 0 114 -342,-0.5 2,-0.4 1,-0.3 -341,-0.1 0.785 91.7 35.9 -84.1 -32.7 1.1 33.8 120.0 369 474 A V S S- 0 0 44 -343,-0.3 -1,-0.3 -344,-0.2 3,-0.1 -0.991 91.5-116.3-126.9 132.6 4.5 32.5 121.0 370 475 A A - 0 0 79 -2,-0.4 2,-0.1 1,-0.1 -315,-0.1 -0.239 39.0 -94.5 -65.6 143.7 5.2 29.6 123.4 371 476 A P 0 0 81 0, 0.0 -317,-0.3 0, 0.0 -1,-0.1 -0.353 360.0 360.0 -58.7 131.2 7.0 30.2 126.7 372 477 A K 0 0 97 -319,-3.6 -317,-0.1 -320,-0.1 -318,-0.1 -0.601 360.0 360.0-108.4 360.0 10.8 29.6 126.5