==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-MAY-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 26-APR-11 3ROS . COMPND 2 MOLECULE: NAD-DEPENDENT ALDEHYDE DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LACTOBACILLUS ACIDOPHILUS; . AUTHOR S.ESWARAMOORTHY,S.C.ALMO,S.SWAMINATHAN,NEW YORK STRUCTURAL G . 459 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19653.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 340 74.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 49 10.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 29 6.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 45 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 154 33.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 1 0 0 2 1 1 0 1 3 1 0 2 0 1 0 0 0 0 0 0 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 0 5 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 1 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 0 0 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 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A X 0 0 146 0, 0.0 2,-0.1 0, 0.0 18,-0.0 0.000 360.0 360.0 360.0 -97.1 22.9 35.1 3.6 2 2 A S - 0 0 30 1,-0.1 17,-0.1 2,-0.1 185,-0.0 -0.421 360.0-159.5 -66.6 137.0 23.3 31.3 3.6 3 3 A K + 0 0 127 -2,-0.1 2,-0.7 182,-0.1 -1,-0.1 0.423 57.3 115.3 -95.7 -0.2 22.3 29.7 6.9 4 4 A Y + 0 0 10 14,-0.5 14,-2.7 181,-0.1 2,-0.3 -0.599 40.0 139.9 -75.8 111.0 24.3 26.6 6.1 5 5 A Q E -A 17 0A 79 153,-2.1 2,-0.6 -2,-0.7 12,-0.2 -0.996 50.0-129.3-155.5 144.4 27.1 26.3 8.7 6 6 A S E +A 16 0A 0 10,-3.3 9,-2.9 -2,-0.3 10,-1.0 -0.860 32.8 172.5 -95.8 116.5 28.9 23.7 10.8 7 7 A V E -A 14 0A 46 -2,-0.6 7,-0.3 66,-0.4 5,-0.1 -0.981 30.8-131.9-130.1 120.2 29.1 24.8 14.5 8 8 A N E >> -A 13 0A 23 5,-2.6 4,-1.8 -2,-0.4 5,-1.0 -0.571 12.2-158.4 -71.4 115.7 30.4 22.5 17.2 9 9 A P T 45S+ 0 0 1 0, 0.0 331,-2.8 0, 0.0 -1,-0.2 0.687 89.2 58.2 -69.8 -17.5 27.8 22.5 20.0 10 10 A Y T 45S+ 0 0 66 329,-0.2 329,-0.2 62,-0.2 328,-0.2 0.850 124.5 19.6 -79.6 -35.3 30.4 21.3 22.5 11 11 A T T 45S- 0 0 39 -3,-0.3 -1,-0.1 2,-0.2 3,-0.1 0.448 97.6-133.6-109.1 -7.4 32.8 24.2 21.9 12 12 A N T <5 + 0 0 59 -4,-1.8 2,-0.4 1,-0.2 295,-0.0 0.865 61.8 133.6 53.2 40.5 30.2 26.5 20.4 13 13 A E E < -A 8 0A 112 -5,-1.0 -5,-2.6 2,-0.0 -1,-0.2 -0.977 55.2-129.5-125.1 132.7 32.6 27.3 17.6 14 14 A A E +A 7 0A 54 -2,-0.4 -7,-0.3 -7,-0.3 3,-0.1 -0.497 25.0 174.3 -75.9 144.9 31.9 27.4 13.9 15 15 A F E + 0 0 93 -9,-2.9 2,-0.3 1,-0.4 -8,-0.1 0.402 61.9 16.5-133.1 2.4 34.3 25.4 11.7 16 16 A A E -A 6 0A 27 -10,-1.0 -10,-3.3 2,-0.0 -1,-0.4 -0.900 54.5-161.6-173.0 142.4 32.8 25.6 8.1 17 17 A S E -A 5 0A 79 -2,-0.3 2,-0.4 -12,-0.2 -12,-0.2 -0.974 9.5-156.6-130.5 145.7 30.3 27.6 6.2 18 18 A Y - 0 0 74 -14,-2.7 -14,-0.5 -2,-0.3 2,-0.1 -0.974 10.8-133.4-128.8 139.0 28.5 26.8 2.9 19 19 A D - 0 0 136 -2,-0.4 166,-0.2 1,-0.1 -14,-0.0 -0.429 27.1-104.6 -85.6 159.4 26.9 29.0 0.2 20 20 A N - 0 0 48 -2,-0.1 -1,-0.1 1,-0.1 -18,-0.1 -0.524 48.4-105.9 -75.9 149.9 23.6 28.5 -1.5 21 21 A P - 0 0 15 0, 0.0 166,-0.2 0, 0.0 2,-0.1 -0.248 31.4-106.8 -73.9 168.1 24.0 27.2 -5.0 22 22 A T > - 0 0 75 1,-0.1 4,-2.2 164,-0.0 5,-0.2 -0.472 31.2-107.2 -87.3 165.4 23.6 29.4 -8.1 23 23 A S H > S+ 0 0 101 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.874 122.6 54.5 -59.9 -36.4 20.5 29.0 -10.4 24 24 A K H > S+ 0 0 147 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.915 106.4 49.2 -63.9 -45.0 22.8 27.3 -12.9 25 25 A Q H > S+ 0 0 102 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.895 111.3 50.3 -63.5 -39.3 24.1 24.8 -10.4 26 26 A I H X S+ 0 0 17 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.948 110.9 48.2 -63.6 -47.6 20.5 23.9 -9.4 27 27 A D H X S+ 0 0 85 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.894 110.1 52.4 -60.3 -40.5 19.4 23.4 -13.0 28 28 A E H X S+ 0 0 95 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.901 110.0 49.1 -62.5 -40.3 22.5 21.2 -13.7 29 29 A A H X S+ 0 0 6 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.935 112.2 46.5 -65.7 -46.9 21.6 19.1 -10.7 30 30 A I H X S+ 0 0 4 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.907 112.6 51.9 -62.4 -39.4 17.9 18.7 -11.8 31 31 A N H X S+ 0 0 86 -4,-2.6 4,-2.4 -5,-0.2 -2,-0.2 0.929 110.6 46.9 -62.6 -45.9 19.1 17.9 -15.3 32 32 A L H X S+ 0 0 76 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.930 114.8 46.6 -61.2 -46.6 21.5 15.2 -14.1 33 33 A A H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.916 112.9 48.3 -63.9 -44.8 18.9 13.6 -11.8 34 34 A H H X S+ 0 0 60 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.911 110.5 51.8 -63.9 -40.9 16.1 13.7 -14.5 35 35 A A H X S+ 0 0 52 -4,-2.4 4,-2.1 -5,-0.2 -1,-0.2 0.908 110.1 49.6 -61.0 -40.9 18.5 12.2 -17.1 36 36 A L H X S+ 0 0 11 -4,-2.1 4,-2.8 1,-0.2 -1,-0.2 0.892 106.1 56.4 -65.0 -39.9 19.3 9.4 -14.6 37 37 A Y H X S+ 0 0 33 -4,-2.3 4,-1.0 1,-0.2 -1,-0.2 0.920 108.6 47.3 -57.5 -44.2 15.6 8.8 -13.9 38 38 A K H < S+ 0 0 88 -4,-2.0 3,-0.4 1,-0.2 4,-0.4 0.912 112.6 48.7 -64.6 -43.3 15.1 8.2 -17.7 39 39 A K H >< S+ 0 0 120 -4,-2.1 3,-1.5 1,-0.2 -2,-0.2 0.908 107.9 54.9 -63.6 -42.7 18.0 5.8 -17.9 40 40 A W H >< S+ 0 0 6 -4,-2.8 3,-2.0 1,-0.3 -1,-0.2 0.732 89.9 75.2 -64.2 -23.8 16.9 3.8 -14.9 41 41 A R T 3< S+ 0 0 128 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.2 0.805 99.8 45.5 -59.5 -25.8 13.5 3.2 -16.5 42 42 A H T < S+ 0 0 155 -3,-1.5 2,-0.4 -4,-0.4 -1,-0.3 0.222 102.8 76.7-102.1 13.8 15.3 0.7 -18.7 43 43 A E S < S- 0 0 70 -3,-2.0 5,-0.1 106,-0.0 -1,-0.1 -0.980 82.8-118.5-130.2 121.1 17.3 -1.0 -16.0 44 44 A E > - 0 0 149 -2,-0.4 3,-1.5 1,-0.1 4,-0.3 -0.113 21.9-117.6 -56.3 149.1 15.8 -3.5 -13.5 45 45 A P T >> S+ 0 0 34 0, 0.0 3,-1.9 0, 0.0 4,-0.9 0.831 114.4 64.9 -55.8 -34.1 15.8 -2.7 -9.7 46 46 A A H >> S+ 0 0 40 1,-0.3 4,-0.9 2,-0.2 3,-0.6 0.836 90.9 65.4 -60.1 -30.2 18.0 -5.8 -9.2 47 47 A S H <4 S+ 0 0 52 -3,-1.5 4,-0.3 1,-0.2 -1,-0.3 0.654 106.2 42.2 -67.0 -15.5 20.7 -4.0 -11.2 48 48 A R H <> S+ 0 0 7 -3,-1.9 4,-2.2 -4,-0.3 -1,-0.2 0.549 95.6 79.6-105.3 -11.9 20.9 -1.4 -8.4 49 49 A A H S+ 0 0 40 -4,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.879 108.7 53.1 -63.0 -38.2 25.4 -1.1 -5.8 52 52 A L H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.877 107.7 51.1 -66.3 -35.9 23.2 -0.6 -2.7 53 53 A H H X S+ 0 0 78 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.908 109.6 50.3 -65.9 -39.3 25.0 -3.5 -1.0 54 54 A D H X S+ 0 0 76 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.838 108.8 52.4 -65.7 -33.1 28.4 -1.8 -1.9 55 55 A I H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.913 106.3 53.6 -67.9 -41.2 27.0 1.4 -0.5 56 56 A A H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.929 110.7 46.7 -58.3 -44.4 26.2 -0.5 2.7 57 57 A N H X S+ 0 0 75 -4,-2.1 4,-2.8 1,-0.2 -1,-0.2 0.879 109.8 53.1 -65.7 -39.0 29.8 -1.7 2.9 58 58 A A H X S+ 0 0 17 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.878 106.9 52.5 -64.8 -37.6 31.2 1.8 2.2 59 59 A L H < S+ 0 0 0 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.936 111.4 46.5 -63.4 -44.3 29.1 3.2 5.1 60 60 A K H >< S+ 0 0 102 -4,-1.9 3,-1.8 1,-0.2 4,-0.3 0.941 110.6 53.7 -61.3 -46.0 30.5 0.6 7.4 61 61 A E H 3< S+ 0 0 157 -4,-2.8 3,-0.2 1,-0.3 -1,-0.2 0.835 115.8 38.7 -57.6 -35.5 34.0 1.3 6.0 62 62 A H T 3X S+ 0 0 52 -4,-2.0 4,-2.8 1,-0.2 5,-0.3 0.165 81.9 121.4-102.0 18.5 33.6 5.0 6.8 63 63 A E H <> S+ 0 0 20 -3,-1.8 4,-2.7 1,-0.2 5,-0.2 0.882 74.5 43.9 -49.6 -52.3 31.8 4.5 10.1 64 64 A D H > S+ 0 0 104 -4,-0.3 4,-2.2 -3,-0.2 -1,-0.2 0.876 115.5 48.6 -65.6 -35.3 34.2 6.3 12.4 65 65 A E H > S+ 0 0 104 -3,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.923 114.9 45.0 -68.8 -44.1 34.6 9.2 10.0 66 66 A L H X S+ 0 0 4 -4,-2.8 4,-2.0 -7,-0.2 -2,-0.2 0.910 113.6 49.8 -64.4 -44.5 30.9 9.6 9.5 67 67 A A H X S+ 0 0 0 -4,-2.7 4,-2.6 -5,-0.3 5,-0.2 0.925 110.5 50.1 -62.3 -45.3 30.2 9.3 13.3 68 68 A K H X S+ 0 0 113 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.919 109.1 51.1 -60.6 -44.5 32.8 11.9 14.2 69 69 A X H X S+ 0 0 52 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.898 111.5 48.8 -60.8 -40.2 31.4 14.4 11.6 70 70 A X H X S+ 0 0 4 -4,-2.0 4,-2.8 2,-0.2 6,-0.4 0.952 112.6 46.6 -62.2 -51.8 27.9 13.9 13.1 71 71 A T H X S+ 0 0 1 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.871 112.2 51.4 -60.0 -38.6 29.1 14.4 16.6 72 72 A L H < S+ 0 0 41 -4,-2.7 -62,-0.2 -5,-0.2 -1,-0.2 0.862 115.9 40.5 -68.2 -36.0 31.1 17.4 15.7 73 73 A E H < S+ 0 0 1 -4,-1.9 -66,-0.4 -5,-0.2 -2,-0.2 0.858 134.9 11.2 -83.7 -37.1 28.1 19.1 13.9 74 74 A X H < S- 0 0 0 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.272 95.8-114.7-129.9 15.3 25.2 18.4 16.2 75 75 A G < + 0 0 0 -4,-1.6 -4,-0.2 -5,-0.3 3,-0.1 0.349 52.2 158.5 74.6 -2.2 26.7 16.9 19.5 76 76 A K - 0 0 1 -6,-0.4 -1,-0.2 1,-0.1 -2,-0.1 -0.196 54.6 -94.3 -55.8 143.1 25.4 13.4 19.5 77 77 A L >> - 0 0 16 1,-0.2 4,-2.2 224,-0.1 3,-0.7 -0.379 32.9-126.2 -57.8 134.2 27.3 10.9 21.7 78 78 A L H 3> S+ 0 0 37 217,-2.8 4,-2.5 1,-0.3 5,-0.2 0.861 110.7 57.8 -52.6 -38.6 29.8 9.2 19.4 79 79 A S H 3> S+ 0 0 73 216,-0.3 4,-1.8 1,-0.2 -1,-0.3 0.901 108.6 45.5 -60.5 -39.6 28.5 5.8 20.5 80 80 A E H <> S+ 0 0 16 -3,-0.7 4,-2.1 2,-0.2 -1,-0.2 0.857 109.6 55.0 -71.4 -35.7 25.0 6.8 19.3 81 81 A S H X S+ 0 0 0 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.909 109.6 47.3 -63.5 -40.8 26.5 8.2 16.0 82 82 A K H X S+ 0 0 67 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.896 109.0 53.4 -67.3 -39.0 28.1 4.8 15.4 83 83 A E H X S+ 0 0 100 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.889 106.9 53.9 -61.5 -37.8 24.9 3.0 16.2 84 84 A E H X S+ 0 0 4 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.905 107.1 49.9 -63.6 -41.3 23.2 5.2 13.7 85 85 A V H X S+ 0 0 0 -4,-1.7 4,-2.3 1,-0.2 -2,-0.2 0.933 110.0 50.6 -62.8 -44.5 25.7 4.1 11.0 86 86 A E H X S+ 0 0 81 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.890 108.9 52.1 -59.1 -41.3 25.1 0.5 11.9 87 87 A L H X S+ 0 0 38 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.902 110.5 48.7 -61.4 -41.8 21.4 1.0 11.5 88 88 A C H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.841 107.1 53.6 -68.6 -35.6 21.9 2.6 8.1 89 89 A V H X S+ 0 0 18 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.941 111.2 48.6 -63.1 -43.4 24.2 -0.3 6.9 90 90 A S H X S+ 0 0 56 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.891 110.4 49.7 -61.8 -44.6 21.3 -2.6 7.9 91 91 A I H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 5,-0.2 0.914 111.0 49.5 -63.2 -44.1 18.7 -0.5 6.1 92 92 A C H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.939 112.9 46.5 -60.4 -47.0 20.8 -0.4 2.9 93 93 A N H X S+ 0 0 38 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.867 108.7 58.2 -63.6 -35.2 21.3 -4.2 3.0 94 94 A Y H X S+ 0 0 45 -4,-2.2 4,-2.2 1,-0.2 5,-0.3 0.953 111.3 38.5 -59.8 -51.8 17.6 -4.7 3.7 95 95 A Y H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.809 113.4 56.2 -71.4 -27.8 16.5 -2.9 0.6 96 96 A A H < S+ 0 0 7 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.879 117.4 36.7 -68.5 -35.5 19.3 -4.4 -1.5 97 97 A D H < S+ 0 0 98 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.728 134.7 19.9 -88.7 -25.2 18.1 -7.9 -0.4 98 98 A H H X S+ 0 0 93 -4,-2.2 4,-1.4 -5,-0.2 -3,-0.2 0.576 101.8 81.9-122.3 -14.2 14.3 -7.3 -0.4 99 99 A G H >X S+ 0 0 0 -4,-1.9 3,-0.8 -5,-0.3 4,-0.5 0.966 92.4 45.6 -59.6 -60.8 13.6 -4.3 -2.6 100 100 A P H >4 S+ 0 0 18 0, 0.0 3,-1.2 0, 0.0 -1,-0.2 0.873 111.9 55.3 -51.6 -39.1 13.7 -5.8 -6.1 101 101 A E H >4 S+ 0 0 94 1,-0.3 3,-1.0 2,-0.2 -2,-0.2 0.856 105.5 51.0 -63.6 -36.2 11.5 -8.7 -4.9 102 102 A X H << S+ 0 0 51 -4,-1.4 -1,-0.3 -3,-0.8 -3,-0.1 0.465 102.5 63.1 -81.9 -0.6 8.9 -6.3 -3.6 103 103 A L T << S+ 0 0 17 -3,-1.2 16,-0.6 -4,-0.5 -1,-0.2 0.266 71.8 122.4-106.0 9.5 8.7 -4.5 -6.9 104 104 A K S < S- 0 0 145 -3,-1.0 -3,-0.0 1,-0.1 0, 0.0 -0.416 77.2 -88.6 -69.3 147.5 7.5 -7.5 -9.0 105 105 A P - 0 0 80 0, 0.0 2,-0.5 0, 0.0 13,-0.2 -0.232 40.1-133.3 -58.5 146.2 4.3 -6.8 -10.8 106 106 A T E -B 117 0B 42 11,-2.5 11,-2.5 -3,-0.1 2,-0.2 -0.906 12.0-135.9-106.5 123.1 1.1 -7.6 -8.8 107 107 A K E -B 116 0B 184 -2,-0.5 2,-0.4 9,-0.2 9,-0.3 -0.535 17.5-148.7 -76.3 140.1 -1.7 -9.6 -10.5 108 108 A L E -B 115 0B 69 7,-2.2 2,-0.8 -2,-0.2 7,-0.6 -0.911 11.9-128.2-112.5 138.4 -5.2 -8.3 -9.9 109 109 A N + 0 0 176 -2,-0.4 2,-0.3 5,-0.1 5,-0.1 -0.763 49.1 143.0 -88.0 111.3 -8.3 -10.5 -9.8 110 110 A S > - 0 0 46 -2,-0.8 3,-0.7 3,-0.3 5,-0.2 -0.987 48.6-152.4-151.1 137.8 -10.9 -9.2 -12.2 111 111 A D T 3 S+ 0 0 150 -2,-0.3 3,-0.1 1,-0.2 -1,-0.1 0.448 91.8 79.1 -86.9 0.3 -13.4 -10.7 -14.5 112 112 A L T 3 S- 0 0 119 1,-0.3 2,-0.3 345,-0.0 -1,-0.2 0.611 113.2 -61.0 -81.9 -12.7 -13.1 -7.6 -16.7 113 113 A G S < S- 0 0 13 -3,-0.7 2,-1.1 344,-0.1 -3,-0.3 -0.929 75.0 -42.7 156.0-178.6 -9.9 -8.8 -18.2 114 114 A N E S+ C 0 454B 111 340,-2.0 340,-2.5 -2,-0.3 2,-0.3 -0.695 70.7 179.0 -80.8 102.3 -6.3 -9.9 -17.6 115 115 A A E +BC 108 453B 6 -2,-1.1 -7,-2.2 -7,-0.6 2,-0.3 -0.785 17.8 144.2-113.8 153.9 -5.2 -7.3 -15.1 116 116 A Y E -BC 107 452B 82 336,-2.0 336,-3.4 -2,-0.3 2,-0.4 -0.948 32.4-129.7-171.2 157.6 -2.0 -6.5 -13.1 117 117 A Y E -BC 106 451B 51 -11,-2.5 -11,-2.5 -2,-0.3 2,-0.3 -0.977 12.2-143.3-127.0 139.6 -0.1 -3.4 -12.0 118 118 A L E - 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0 0 9 26,-1.9 28,-0.4 -2,-0.5 2,-0.1 -0.815 18.0-125.0-121.4 158.3 15.9 16.2 6.2 130 130 A P - 0 0 16 0, 0.0 3,-0.5 0, 0.0 7,-0.2 -0.477 22.0-117.4 -95.5 165.5 16.6 17.2 9.9 131 131 A W S S+ 0 0 49 1,-0.2 4,-0.1 -2,-0.1 -57,-0.0 0.637 94.3 80.6 -75.7 -17.8 19.8 17.4 12.0 132 132 A N S S+ 0 0 4 1,-0.3 -1,-0.2 2,-0.1 129,-0.1 0.816 112.4 13.8 -66.0 -31.8 18.8 14.8 14.7 133 133 A F S > S+ 0 0 9 -3,-0.5 4,-2.9 1,-0.1 5,-0.4 -0.588 77.9 176.3-140.4 69.2 19.6 11.7 12.7 134 134 A P T 4 S+ 0 0 0 0, 0.0 4,-0.4 0, 0.0 -2,-0.1 0.741 78.9 31.9 -48.0 -36.5 21.7 13.2 9.8 135 135 A L T > S+ 0 0 2 2,-0.1 4,-3.0 3,-0.1 3,-0.3 0.908 119.3 49.2 -90.7 -50.1 22.5 9.8 8.2 136 136 A Y H > S+ 0 0 3 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.874 107.8 54.7 -56.8 -42.3 19.5 7.7 9.0 137 137 A Q H X S+ 0 0 6 -4,-2.9 4,-0.7 2,-0.2 -1,-0.2 0.893 114.2 42.1 -61.1 -38.8 17.0 10.4 7.8 138 138 A V H >> S+ 0 0 5 -4,-0.4 4,-3.1 -5,-0.4 3,-0.9 0.955 116.2 46.5 -71.6 -51.7 18.8 10.4 4.5 139 139 A I H 3X S+ 0 0 0 -4,-3.0 4,-2.0 1,-0.2 -2,-0.2 0.849 102.3 65.7 -60.5 -34.7 19.2 6.7 4.2 140 140 A R H 3< S+ 0 0 5 -4,-2.8 298,-0.5 -5,-0.2 -1,-0.2 0.853 116.4 28.2 -55.9 -36.2 15.6 6.1 5.2 141 141 A V H S+ 0 0 2 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.914 119.2 49.2 -62.1 -42.2 14.2 2.3 -1.1 145 145 A N H X>S+ 0 0 3 -4,-1.4 5,-3.0 2,-0.2 4,-2.5 0.802 104.7 58.1 -69.2 -27.7 14.0 5.0 -3.8 146 146 A F H <5S+ 0 0 1 -4,-2.7 -1,-0.2 3,-0.2 -3,-0.1 0.939 110.4 44.7 -64.4 -44.7 17.4 4.1 -5.2 147 147 A I H <5S+ 0 0 0 -4,-1.6 -2,-0.2 -5,-0.3 -1,-0.2 0.925 113.1 50.0 -64.2 -45.8 16.1 0.6 -5.8 148 148 A V H <5S- 0 0 9 -4,-2.3 -27,-0.2 -5,-0.1 -1,-0.2 0.875 118.3-112.6 -60.6 -38.6 12.8 1.9 -7.2 149 149 A G T <5 + 0 0 0 -4,-2.5 -3,-0.2 1,-0.2 -109,-0.1 0.676 68.7 138.9 109.6 25.6 14.7 4.2 -9.5 150 150 A N < - 0 0 1 -5,-3.0 -1,-0.2 -8,-0.1 -26,-0.2 -0.894 46.0-139.9-103.9 108.0 13.8 7.6 -8.1 151 151 A P - 0 0 0 0, 0.0 -26,-2.8 0, 0.0 2,-0.4 -0.270 19.5-136.8 -62.0 154.5 16.8 10.0 -8.1 152 152 A I E -ef 125 181C 3 28,-1.9 30,-2.4 27,-0.4 2,-0.5 -0.963 16.4-163.4-124.8 131.7 17.1 12.2 -5.0 153 153 A L E -ef 126 182C 0 -28,-3.0 -26,-3.1 -2,-0.4 2,-0.5 -0.950 26.2-150.0-105.0 125.6 17.9 15.8 -4.5 154 154 A L E -ef 127 183C 1 28,-3.1 30,-2.8 -2,-0.5 2,-0.6 -0.871 24.6-179.7-109.7 130.8 18.8 16.4 -0.9 155 155 A K E -ef 128 184C 22 -28,-3.0 -26,-1.9 -2,-0.5 2,-0.1 -0.960 22.9-170.8-119.9 103.3 18.3 19.6 1.2 156 156 A H - 0 0 1 28,-0.6 -25,-0.1 -2,-0.6 -28,-0.0 -0.471 36.6 -68.4 -92.2 169.0 19.7 18.7 4.6 157 157 A A > - 0 0 11 -28,-0.4 3,-1.9 -2,-0.1 -1,-0.2 -0.179 45.4-115.7 -55.5 146.4 19.4 20.8 7.8 158 158 A H T 3 S+ 0 0 92 1,-0.3 -153,-2.1 2,-0.1 -1,-0.1 0.740 112.4 54.7 -56.7 -23.4 21.3 24.0 7.8 159 159 A N T 3 S+ 0 0 12 1,-0.2 -152,-0.4 -155,-0.2 -1,-0.3 0.339 103.5 50.6 -97.9 7.9 23.5 22.7 10.7 160 160 A V <> + 0 0 0 -3,-1.9 4,-2.4 -154,-0.1 -1,-0.2 -0.114 62.4 131.0-132.3 39.8 24.7 19.4 9.2 161 161 A P H > S+ 0 0 0 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.812 75.1 51.7 -62.4 -30.8 26.1 20.5 5.8 162 162 A G H > S+ 0 0 2 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.910 111.1 45.6 -72.5 -44.0 29.4 18.7 6.4 163 163 A S H > S+ 0 0 4 -94,-0.2 4,-2.4 2,-0.2 5,-0.2 0.885 113.3 52.1 -65.5 -38.5 27.7 15.4 7.3 164 164 A A H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.937 111.6 45.0 -62.9 -47.7 25.3 15.8 4.3 165 165 A A H X S+ 0 0 36 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.913 113.8 50.0 -62.8 -44.1 28.2 16.4 1.8 166 166 A L H X S+ 0 0 13 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.910 109.9 50.8 -62.3 -43.6 30.2 13.5 3.2 167 167 A T H X S+ 0 0 2 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.949 111.5 47.2 -60.0 -49.0 27.2 11.2 3.0 168 168 A A H X S+ 0 0 13 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.875 112.4 50.5 -61.4 -38.6 26.6 12.1 -0.6 169 169 A K H X S+ 0 0 88 -4,-2.2 4,-2.8 2,-0.2 5,-0.3 0.937 109.6 48.9 -66.0 -47.6 30.3 11.7 -1.5 170 170 A I H X S+ 0 0 3 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.907 112.4 49.5 -58.9 -42.9 30.6 8.2 0.1 171 171 A I H X>S+ 0 0 2 -4,-2.2 5,-1.9 -5,-0.2 4,-0.7 0.888 112.3 46.9 -65.6 -40.5 27.5 7.1 -1.8 172 172 A K H ><5S+ 0 0 105 -4,-2.0 3,-1.5 1,-0.2 -2,-0.2 0.972 114.0 46.2 -65.9 -53.0 28.6 8.4 -5.1 173 173 A R H 3<5S+ 0 0 192 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.802 103.8 64.5 -60.3 -28.3 32.1 6.9 -4.8 174 174 A A H 3<5S- 0 0 26 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.772 133.3 -82.7 -67.1 -24.6 30.6 3.6 -3.6 175 175 A G T <<5S+ 0 0 35 -3,-1.5 -3,-0.2 -4,-0.7 -2,-0.2 0.294 82.2 138.1 142.7 -12.0 29.0 3.3 -7.1 176 176 A A < - 0 0 2 -5,-1.9 -1,-0.3 -125,-0.2 5,-0.1 -0.498 59.6-114.0 -66.6 119.4 25.8 5.3 -7.1 177 177 A P > - 0 0 47 0, 0.0 3,-2.5 0, 0.0 4,-0.3 -0.132 41.6 -84.8 -52.3 146.0 25.7 7.1 -10.5 178 178 A E T 3 S+ 0 0 83 1,-0.3 4,-0.1 2,-0.1 -142,-0.1 -0.324 121.5 36.3 -53.5 129.5 25.9 10.9 -10.4 179 179 A G T 3 S+ 0 0 1 2,-0.2 -27,-0.4 -3,-0.1 3,-0.4 0.138 85.1 102.2 109.8 -18.6 22.4 12.1 -9.9 180 180 A S S < S+ 0 0 2 -3,-2.5 -28,-1.9 1,-0.3 2,-0.3 0.887 103.6 1.5 -62.4 -41.2 21.3 9.3 -7.5 181 181 A L E S-f 152 0C 16 -4,-0.3 2,-0.6 -30,-0.2 -1,-0.3 -0.794 74.5-177.5-152.3 100.9 21.8 11.5 -4.5 182 182 A I E -f 153 0C 20 -30,-2.4 -28,-3.1 -3,-0.4 2,-0.4 -0.910 17.2-145.0-107.3 120.0 22.8 15.2 -5.0 183 183 A N E +f 154 0C 27 -2,-0.6 2,-0.3 -30,-0.2 -28,-0.2 -0.685 23.9 177.5 -84.6 133.1 23.3 17.3 -1.9 184 184 A L E -f 155 0C 16 -30,-2.8 -28,-0.6 -2,-0.4 -164,-0.1 -0.957 30.7-146.0-134.1 153.1 22.3 20.9 -2.3 185 185 A Y + 0 0 33 -2,-0.3 -181,-0.1 -166,-0.2 -30,-0.1 -0.491 37.3 171.3-115.2 61.1 22.3 24.0 0.0 186 186 A P - 0 0 1 0, 0.0 2,-0.1 0, 0.0 -2,-0.1 -0.360 32.3-124.0 -75.6 150.5 19.2 25.8 -1.3 187 187 A S > - 0 0 34 -166,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.361 39.7 -98.5 -78.4 168.8 17.5 28.8 0.4 188 188 A Y H > S+ 0 0 120 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.888 126.6 51.1 -59.0 -38.1 13.8 28.4 1.2 189 189 A D H > S+ 0 0 129 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.896 109.8 48.2 -66.1 -41.3 13.0 30.3 -2.0 190 190 A Q H > S+ 0 0 33 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.899 109.8 53.8 -65.0 -39.9 15.2 28.1 -4.2 191 191 A L H X S+ 0 0 7 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.936 107.5 50.4 -58.8 -47.6 13.6 25.0 -2.5 192 192 A A H X S+ 0 0 39 -4,-2.3 4,-1.1 1,-0.2 -1,-0.2 0.899 110.5 49.9 -57.9 -41.5 10.2 26.3 -3.4 193 193 A D H < S+ 0 0 114 -4,-2.0 4,-0.4 2,-0.2 -1,-0.2 0.857 108.5 52.3 -66.4 -36.9 11.3 26.8 -7.1 194 194 A I H >< S+ 0 0 4 -4,-2.2 3,-1.6 1,-0.2 6,-0.2 0.926 106.7 53.0 -64.6 -44.6 12.8 23.3 -7.2 195 195 A I H 3< S+ 0 0 1 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.801 106.1 55.5 -61.1 -27.4 9.5 21.8 -6.0 196 196 A A T 3< S+ 0 0 45 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.538 82.8 105.3 -83.9 -6.9 7.8 23.7 -8.8 197 197 A D S X S- 0 0 31 -3,-1.6 3,-2.1 -4,-0.4 -3,-0.0 -0.608 73.0-135.8 -76.9 131.1 10.0 22.1 -11.5 198 198 A P T 3 S+ 0 0 98 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.671 102.0 66.3 -59.6 -18.4 8.1 19.5 -13.5 199 199 A R T 3 S+ 0 0 47 -5,-0.1 -75,-1.4 -76,-0.1 2,-0.6 0.641 87.0 79.8 -79.3 -13.7 11.1 17.1 -13.3 200 200 A I E < +d 124 0C 0 -3,-2.1 -75,-0.2 -6,-0.2 3,-0.1 -0.848 53.9 168.2 -93.9 123.1 10.5 16.9 -9.6 201 201 A Q E + 0 0 78 -77,-2.5 24,-0.7 -2,-0.6 2,-0.3 0.320 56.4 35.5-121.1 8.3 7.7 14.4 -8.9 202 202 A G E -dg 125 225C 0 -78,-1.0 -76,-2.8 22,-0.2 2,-0.4 -0.985 55.2-156.7-159.3 149.7 7.8 13.8 -5.2 203 203 A V E -dg 126 226C 0 22,-2.0 24,-1.7 -2,-0.3 2,-0.5 -0.984 12.2-176.1-133.8 120.5 8.6 15.7 -2.0 204 204 A A E +dg 127 227C 0 -78,-2.4 -76,-2.9 -2,-0.4 2,-0.4 -0.969 8.6 177.3-119.4 127.4 9.7 13.9 1.2 205 205 A L E -dg 128 228C 10 22,-2.3 24,-3.2 -2,-0.5 2,-0.4 -0.991 18.3-179.5-137.6 142.2 10.3 15.7 4.4 206 206 A T E + g 0 229C 6 -78,-2.1 2,-0.3 -2,-0.4 24,-0.2 -0.998 51.0 65.4-131.1 128.9 11.2 14.9 8.0 207 207 A G S S- 0 0 18 22,-2.0 24,-0.3 -2,-0.4 2,-0.1 -0.975 77.4 -5.5 162.4-145.0 11.5 17.7 10.5 208 208 A S > - 0 0 60 -2,-0.3 4,-2.8 22,-0.2 5,-0.1 -0.358 53.2-117.7 -86.1 165.4 9.4 20.4 12.3 209 209 A E H > S+ 0 0 45 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.899 115.5 53.3 -64.7 -43.1 5.8 21.4 12.0 210 210 A R H > S+ 0 0 182 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.953 114.8 38.2 -58.2 -55.2 6.9 24.9 10.8 211 211 A G H > S+ 0 0 23 1,-0.2 4,-2.4 2,-0.2 5,-0.3 0.911 115.4 55.4 -64.3 -42.1 9.2 23.6 8.1 212 212 A G H X S+ 0 0 1 -4,-2.8 4,-3.7 1,-0.2 5,-0.3 0.942 104.5 52.1 -55.8 -52.4 6.7 20.9 7.2 213 213 A S H X S+ 0 0 76 -4,-3.0 4,-2.5 1,-0.2 -1,-0.2 0.924 111.7 46.0 -50.5 -52.3 3.8 23.3 6.6 214 214 A A H X S+ 0 0 61 -4,-1.6 4,-1.6 2,-0.2 -1,-0.2 0.915 118.1 41.6 -59.6 -46.8 5.8 25.5 4.2 215 215 A V H X S+ 0 0 14 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.916 115.8 49.0 -69.8 -42.7 7.2 22.6 2.2 216 216 A A H X S+ 0 0 23 -4,-3.7 4,-2.4 -5,-0.3 -2,-0.2 0.859 109.2 54.0 -64.9 -35.2 3.9 20.6 2.2 217 217 A E H X S+ 0 0 144 -4,-2.5 4,-2.6 -5,-0.3 -1,-0.2 0.894 110.4 46.8 -65.2 -39.6 2.0 23.8 1.1 218 218 A A H X S+ 0 0 18 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.899 110.8 51.3 -68.8 -42.4 4.4 24.2 -1.8 219 219 A A H <>S+ 0 0 0 -4,-2.4 5,-2.8 2,-0.2 -2,-0.2 0.934 112.7 47.4 -60.3 -44.1 4.2 20.5 -2.8 220 220 A G H ><5S+ 0 0 42 -4,-2.4 3,-2.3 3,-0.2 -2,-0.2 0.951 108.1 53.0 -62.0 -51.6 0.4 20.9 -2.8 221 221 A K H 3<5S+ 0 0 175 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.877 116.1 41.6 -50.7 -40.3 0.3 24.1 -4.8 222 222 A N T 3<5S- 0 0 49 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.332 113.0-122.4 -91.6 6.2 2.4 22.3 -7.4 223 223 A L T < 5 + 0 0 155 -3,-2.3 2,-0.4 1,-0.2 -3,-0.2 0.886 57.3 152.3 53.4 47.9 0.4 19.1 -7.0 224 224 A K < - 0 0 22 -5,-2.8 -1,-0.2 -6,-0.1 -22,-0.2 -0.886 49.6-111.7-108.8 137.0 3.4 16.9 -6.1 225 225 A K E -g 202 0C 118 -24,-0.7 -22,-2.0 -2,-0.4 2,-0.3 -0.368 44.5-174.7 -63.5 143.2 2.9 13.8 -4.0 226 226 A S E -g 203 0C 22 -24,-0.2 2,-0.4 -22,-0.0 -22,-0.2 -0.966 26.4-153.3-144.0 160.1 4.5 14.1 -0.5 227 227 A T E -g 204 0C 6 -24,-1.7 -22,-2.3 -2,-0.3 2,-0.5 -0.994 15.1-158.3-129.8 135.6 5.3 12.3 2.7 228 228 A X E -gH 205 434C 3 206,-2.2 206,-1.4 -2,-0.4 2,-0.7 -0.962 11.9-178.6-123.5 116.7 5.6 14.2 6.0 229 229 A E E +gH 206 433C 2 -24,-3.2 -22,-2.0 -2,-0.5 204,-0.2 -0.872 28.5 160.8-112.3 92.9 7.5 12.8 9.0 230 230 A L - 0 0 15 202,-2.5 -22,-0.2 -2,-0.7 202,-0.1 -0.184 37.6 -56.8-103.2-164.4 7.1 15.4 11.7 231 231 A G - 0 0 0 -24,-0.3 156,-0.4 200,-0.3 2,-0.3 -0.021 43.8-157.1 -70.4 174.7 7.5 15.6 15.4 232 232 A G - 0 0 0 30,-0.1 33,-0.1 154,-0.1 30,-0.1 -0.931 24.3-156.2-146.6 168.1 5.7 13.7 18.1 233 233 A N - 0 0 1 -2,-0.3 153,-0.1 156,-0.2 31,-0.1 -0.409 39.3-159.8-144.2 54.2 4.8 13.9 21.8 234 234 A D - 0 0 6 29,-0.5 34,-2.7 31,-0.4 2,-0.6 -0.003 14.4-126.8 -47.2 135.6 4.5 10.2 22.3 235 235 A A E -ij 268 390D 4 154,-0.6 156,-2.2 32,-0.2 2,-0.9 -0.749 16.3-163.6 -87.2 121.0 2.6 8.6 25.2 236 236 A F E -ij 269 391D 0 32,-2.8 34,-1.8 -2,-0.6 2,-0.5 -0.889 17.3-160.2-105.2 96.6 4.8 6.2 27.2 237 237 A I E -ij 270 392D 0 154,-3.0 156,-3.2 -2,-0.9 2,-0.7 -0.718 10.6-165.9 -89.1 122.2 2.1 4.3 29.1 238 238 A V E -ij 271 393D 0 32,-2.8 34,-2.2 -2,-0.5 37,-0.2 -0.912 13.2-154.0-107.8 108.4 3.1 2.5 32.3 239 239 A L > - 0 0 0 154,-2.7 3,-2.0 -2,-0.7 156,-0.1 -0.387 29.2-108.4 -78.9 159.9 0.4 0.0 33.4 240 240 A D T 3 S+ 0 0 72 1,-0.3 -1,-0.1 -2,-0.1 154,-0.1 0.719 119.7 52.8 -60.7 -21.0 -0.0 -1.1 37.0 241 241 A D T 3 S+ 0 0 33 152,-0.2 154,-1.9 155,-0.1 -1,-0.3 0.114 75.8 140.7-102.7 22.5 1.3 -4.5 36.0 242 242 A A < - 0 0 2 -3,-2.0 152,-0.1 152,-0.3 -4,-0.0 -0.401 61.9-111.6 -63.2 137.5 4.4 -3.3 34.4 243 243 A D > - 0 0 68 1,-0.2 4,-2.8 -2,-0.1 5,-0.3 -0.610 20.7-136.6 -72.8 126.2 7.3 -5.6 35.2 244 244 A P H > S+ 0 0 76 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.843 102.4 47.0 -50.4 -40.4 9.7 -3.6 37.5 245 245 A Q H > S+ 0 0 84 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.912 112.5 47.2 -71.6 -44.3 12.8 -4.9 35.6 246 246 A V H > S+ 0 0 40 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.968 113.3 50.2 -60.0 -51.6 11.4 -4.2 32.1 247 247 A L H X S+ 0 0 2 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.918 111.6 47.9 -52.3 -49.9 10.4 -0.7 33.2 248 248 A R H X S+ 0 0 132 -4,-2.1 4,-0.7 -5,-0.3 -1,-0.2 0.938 111.7 49.3 -58.7 -49.8 13.8 0.0 34.7 249 249 A N H >< S+ 0 0 93 -4,-2.6 3,-0.6 1,-0.2 4,-0.3 0.905 114.2 45.9 -56.9 -44.4 15.7 -1.2 31.6 250 250 A V H >X S+ 0 0 15 -4,-2.7 3,-1.5 1,-0.2 4,-1.3 0.903 104.9 58.7 -68.3 -42.7 13.5 0.9 29.3 251 251 A L H 3< S+ 0 0 2 -4,-2.6 4,-0.4 1,-0.3 -1,-0.2 0.642 83.3 87.0 -63.9 -11.8 13.6 4.1 31.3 252 252 A N T << S- 0 0 102 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.861 118.7 -5.2 -57.5 -34.9 17.4 4.1 30.9 253 253 A D T <> S+ 0 0 38 -3,-1.5 4,-1.6 -4,-0.3 -1,-0.2 0.290 95.9 114.1-143.9 12.9 17.1 5.9 27.6 254 254 A A T < S+ 0 0 1 -4,-1.3 12,-2.8 1,-0.2 164,-0.2 0.806 102.6 14.9 -56.8 -30.0 13.3 6.2 26.8 255 255 A R T 4 S+ 0 0 3 -4,-0.4 110,-0.2 10,-0.2 -1,-0.2 0.623 128.0 52.4-118.3 -21.3 13.6 10.0 27.2 256 256 A T T >4 + 0 0 19 -5,-0.2 3,-2.0 3,-0.1 -2,-0.2 0.477 69.8 121.6 -98.8 -3.2 17.4 10.7 27.2 257 257 A Y G >< S+ 0 0 29 -4,-1.6 3,-2.0 1,-0.3 4,-0.2 -0.405 94.4 2.0 -61.0 134.7 18.5 8.9 23.9 258 258 A N G > S- 0 0 0 1,-0.3 3,-1.8 2,-0.2 -1,-0.3 0.824 133.5 -65.7 53.1 33.4 20.1 11.6 21.7 259 259 A D G < S- 0 0 2 -3,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.763 90.6 -63.7 61.3 28.2 19.5 14.0 24.5 260 260 A G G < S+ 0 0 0 -3,-2.0 2,-1.8 1,-0.1 103,-1.0 0.487 103.7 131.0 76.9 2.7 15.7 13.6 24.0 261 261 A Q < + 0 0 2 -3,-1.8 2,-0.4 101,-0.3 -1,-0.1 -0.383 38.5 115.4 -85.5 58.4 16.0 15.1 20.6 262 262 A V > - 0 0 1 -2,-1.8 3,-2.1 -7,-0.1 -30,-0.1 -0.997 65.8-142.1-131.9 132.0 14.0 12.3 19.1 263 263 A C T 3 S+ 0 0 14 -2,-0.4 -29,-0.5 1,-0.3 126,-0.3 0.824 110.4 42.3 -60.8 -29.9 10.6 12.6 17.4 264 264 A T T 3 S+ 0 0 4 124,-0.1 154,-0.5 -31,-0.1 -1,-0.3 0.028 84.0 136.4-103.7 24.0 9.7 9.3 19.0 265 265 A S S < S- 0 0 2 -3,-2.1 2,-2.1 -5,-0.2 -31,-0.4 -0.381 72.5-104.5 -65.6 152.8 11.3 10.1 22.4 266 266 A S + 0 0 3 -12,-2.8 101,-0.3 1,-0.2 3,-0.2 -0.533 59.8 159.2 -82.6 77.4 9.0 9.1 25.3 267 267 A K + 0 0 0 -2,-2.1 2,-0.7 1,-0.2 100,-0.6 0.808 59.9 46.2 -72.5 -36.5 7.9 12.7 26.0 268 268 A R E S-ik 235 367D 7 -34,-2.7 -32,-2.8 -3,-0.2 2,-0.9 -0.830 70.9-166.5-114.4 93.7 4.6 12.1 27.9 269 269 A I E -ik 236 368D 0 98,-2.4 100,-3.1 -2,-0.7 2,-0.7 -0.701 6.8-167.9 -83.1 105.3 5.2 9.4 30.5 270 270 A I E -ik 237 369D 0 -34,-1.8 -32,-2.8 -2,-0.9 2,-0.4 -0.855 7.8-174.4-100.6 108.1 1.7 8.4 31.6 271 271 A V E -ik 238 370D 0 98,-2.9 100,-2.1 -2,-0.7 2,-0.2 -0.879 26.7-125.2-111.8 130.8 1.8 6.3 34.8 272 272 A E E > - 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