==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 11-JUN-10 3NGD . COMPND 2 MOLECULE: 5'-D(*TP*CP*TP*(6OG) . SOURCE 2 SYNTHETIC: YES; . AUTHOR M.G.PENCE . 370 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19710.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 259 70.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 3.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 53 14.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 19 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 122 33.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 1 1 0 2 3 1 2 0 1 0 0 0 0 1 0 0 1 0 0 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 1 0 2 1 1 2 1 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 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 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 26 A S 0 0 182 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 87.4 -25.0 -27.7 -6.3 2 27 A S - 0 0 61 106,-0.1 175,-0.1 175,-0.0 2,-0.1 -0.881 360.0-139.9-107.3 133.0 -21.9 -25.6 -5.4 3 28 A R - 0 0 53 173,-0.6 2,-0.4 -2,-0.5 103,-0.0 -0.336 7.4-145.0 -91.3 165.7 -21.3 -24.6 -1.8 4 29 A V + 0 0 4 -2,-0.1 103,-2.2 2,-0.0 104,-0.5 -0.972 27.5 177.7-128.7 114.6 -20.1 -21.5 -0.1 5 30 A I E -AB 106 175A 0 170,-2.7 170,-2.2 -2,-0.4 2,-0.4 -0.906 17.4-153.1-119.9 142.4 -17.9 -22.2 3.0 6 31 A V E -AB 105 174A 0 99,-2.7 99,-1.9 -2,-0.4 2,-0.7 -0.965 3.6-156.1-111.6 131.6 -16.1 -19.9 5.4 7 32 A H E -AB 104 173A 0 166,-2.8 166,-1.5 -2,-0.4 2,-0.5 -0.922 11.6-162.5-103.0 110.6 -13.0 -21.0 7.3 8 33 A V E +AB 103 172A 1 95,-3.8 95,-2.6 -2,-0.7 2,-0.4 -0.840 10.8 179.2 -94.7 125.6 -12.6 -18.9 10.5 9 34 A D E -AB 102 171A 33 162,-2.5 162,-3.0 -2,-0.5 93,-0.2 -0.969 21.1-135.9-132.2 113.4 -9.1 -19.0 12.0 10 35 A L E > - B 0 170A 2 91,-2.7 3,-0.6 -2,-0.4 2,-0.3 -0.426 25.0-110.8 -76.1 142.5 -8.3 -17.0 15.2 11 36 A D T 3 S- 0 0 7 158,-1.3 5,-0.3 1,-0.2 158,-0.2 -0.547 83.1 -31.5 -69.6 130.6 -5.0 -15.0 15.4 12 37 A C T >> S- 0 0 14 -2,-0.3 3,-1.5 1,-0.1 4,-1.4 0.727 81.7-162.4 32.9 47.5 -2.4 -16.4 17.8 13 38 A F H <> S+ 0 0 6 -3,-0.6 4,-1.7 1,-0.3 5,-0.1 0.622 74.1 44.0 -42.2 -46.4 -5.2 -17.6 20.0 14 39 A Y H 3> S+ 0 0 42 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.899 112.8 53.0 -70.3 -35.7 -3.7 -18.2 23.4 15 40 A A H <> S+ 0 0 0 -3,-1.5 4,-2.8 1,-0.2 -1,-0.2 0.861 106.1 55.7 -67.7 -34.5 -1.8 -15.0 23.3 16 41 A Q H X S+ 0 0 15 -4,-1.4 4,-1.7 -5,-0.3 -1,-0.2 0.916 108.9 46.1 -56.3 -46.3 -5.0 -13.2 22.5 17 42 A V H X S+ 0 0 10 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.921 113.5 47.9 -68.8 -43.0 -6.7 -14.6 25.6 18 43 A E H X S+ 0 0 7 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.953 109.7 54.1 -61.3 -47.0 -3.7 -13.8 27.8 19 44 A M H < S+ 0 0 46 -4,-2.8 7,-0.3 1,-0.2 6,-0.3 0.792 108.7 48.9 -56.8 -34.3 -3.6 -10.3 26.4 20 45 A I H < S+ 0 0 91 -4,-1.7 -2,-0.2 -5,-0.1 -1,-0.2 0.971 112.4 48.3 -67.2 -54.8 -7.2 -9.8 27.3 21 46 A S H < S+ 0 0 67 -4,-2.7 -2,-0.2 1,-0.3 -3,-0.1 0.945 127.2 24.4 -44.3 -66.3 -6.6 -11.1 30.9 22 47 A N >< - 0 0 76 -4,-2.7 3,-2.6 1,-0.1 -1,-0.3 -0.762 69.1-176.0-109.8 84.5 -3.5 -8.9 31.5 23 48 A P G > S+ 0 0 76 0, 0.0 3,-1.2 0, 0.0 -1,-0.1 0.652 77.4 78.3 -55.7 -18.5 -3.8 -5.8 29.1 24 49 A E G 3 S+ 0 0 171 1,-0.3 -5,-0.1 -3,-0.1 -3,-0.0 0.605 89.7 59.3 -65.6 -8.2 -0.3 -4.7 30.4 25 50 A L G X S+ 0 0 19 -3,-2.6 3,-2.3 -6,-0.3 -1,-0.3 0.666 77.4 112.8 -89.8 -22.3 0.8 -7.4 28.0 26 51 A K T < S+ 0 0 119 -3,-1.2 -10,-0.0 -7,-0.3 -6,-0.0 -0.250 92.8 4.3 -53.4 139.6 -0.8 -5.8 24.9 27 52 A D T 3 S+ 0 0 103 1,-0.2 -1,-0.3 3,-0.0 -2,-0.1 0.575 107.7 109.8 47.6 14.4 1.9 -4.5 22.4 28 53 A K S < S- 0 0 26 -3,-2.3 2,-0.3 39,-0.0 -1,-0.2 -0.956 88.4-100.4-102.6 135.5 4.5 -6.1 24.8 29 54 A P - 0 0 24 0, 0.0 38,-2.5 0, 0.0 2,-0.4 -0.387 50.4-167.8 -69.5 119.4 6.0 -9.2 23.0 30 55 A L E -f 67 0B 0 -2,-0.3 12,-3.1 36,-0.2 2,-0.3 -0.909 19.4-178.7-123.6 130.8 4.3 -12.3 24.4 31 56 A G E -fG 68 41B 0 36,-1.7 38,-2.0 -2,-0.4 2,-0.5 -0.912 22.6-134.6-118.4 149.9 4.9 -16.0 24.2 32 57 A V E -fG 69 40B 0 8,-3.4 7,-2.6 -2,-0.3 8,-0.6 -0.910 25.1-148.5-109.1 128.2 2.7 -18.7 25.8 33 58 A Q E +fG 70 38B 51 36,-3.6 38,-3.5 -2,-0.5 2,-0.4 -0.761 26.9 169.6-111.0 136.6 4.6 -21.4 27.6 34 59 A Q E > S- G 0 37B 49 3,-2.4 3,-2.3 -2,-0.4 -2,-0.0 -0.931 72.4 -50.5-138.6 114.0 4.0 -25.1 28.1 35 60 A K T 3 S- 0 0 75 -2,-0.4 -1,-0.1 1,-0.3 36,-0.1 -0.304 123.0 -19.1 53.9-139.6 7.0 -26.9 29.6 36 61 A Y T 3 S+ 0 0 121 -3,-0.1 20,-2.9 19,-0.1 21,-0.5 0.394 121.3 102.7 -72.6 4.2 10.1 -26.1 27.6 37 62 A L E < -GH 34 55B 40 -3,-2.3 -3,-2.4 18,-0.2 2,-0.9 -0.725 61.4-154.2-104.8 137.8 7.8 -25.0 24.7 38 63 A V E -GH 33 54B 0 16,-2.7 15,-1.6 -2,-0.4 16,-1.1 -0.873 24.1-179.1-100.5 100.3 6.8 -21.6 23.3 39 64 A V E - 0 0 28 -7,-2.6 14,-0.5 -2,-0.9 2,-0.3 0.938 59.2 -12.6 -80.5 -44.1 3.6 -22.8 21.9 40 65 A T E -G 32 0B 14 -8,-0.6 -8,-3.4 12,-0.2 2,-0.3 -0.931 62.1-167.7-146.6 171.2 2.3 -19.5 20.4 41 66 A C E -G 31 0B 0 -10,-0.3 -10,-0.3 -2,-0.3 -26,-0.1 -0.977 28.6 -93.2-158.6 156.8 3.3 -15.8 20.7 42 67 A N >> - 0 0 4 -12,-3.1 4,-2.1 -2,-0.3 3,-0.8 -0.214 36.4-108.7 -81.4 171.2 1.8 -12.4 19.7 43 68 A Y H 3> S+ 0 0 52 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.895 120.5 61.7 -68.6 -33.8 2.5 -10.6 16.5 44 69 A E H 34 S+ 0 0 79 1,-0.2 4,-0.5 2,-0.2 -1,-0.3 0.845 112.2 40.1 -53.0 -33.2 4.6 -8.1 18.5 45 70 A A H <4>S+ 0 0 0 -3,-0.8 5,-1.2 -15,-0.2 3,-0.3 0.787 106.8 60.6 -90.0 -29.9 6.7 -11.1 19.3 46 71 A R H ><5S+ 0 0 45 -4,-2.1 3,-1.9 1,-0.2 4,-0.4 0.928 98.7 59.6 -61.3 -45.8 6.7 -12.8 15.9 47 72 A K T 3<5S+ 0 0 166 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.828 97.7 60.5 -46.6 -41.0 8.3 -9.7 14.3 48 73 A L T 3 5S- 0 0 68 -4,-0.5 -1,-0.3 -3,-0.3 -2,-0.2 0.162 131.1 -89.8 -80.1 16.1 11.3 -10.1 16.7 49 74 A G T < 5S+ 0 0 23 -3,-1.9 2,-0.4 1,-0.3 -3,-0.2 0.645 80.3 140.0 85.2 17.2 12.0 -13.6 15.2 50 75 A V < - 0 0 0 -5,-1.2 2,-0.3 -4,-0.4 -1,-0.3 -0.751 29.9-168.6 -88.0 139.3 9.9 -15.9 17.5 51 76 A K > - 0 0 138 -2,-0.4 3,-0.9 -11,-0.1 -13,-0.1 -0.887 33.0 -87.3-123.7 159.3 8.1 -18.7 15.7 52 77 A K T 3 S+ 0 0 112 -2,-0.3 -13,-0.2 1,-0.2 -12,-0.2 -0.354 111.9 18.6 -67.4 145.1 5.4 -21.0 17.0 53 78 A L T 3 S+ 0 0 113 -15,-1.6 2,-0.3 -14,-0.5 -1,-0.2 0.862 87.1 149.7 57.9 39.8 6.7 -24.1 18.8 54 79 A M E < -H 38 0B 37 -16,-1.1 -16,-2.7 -3,-0.9 -1,-0.2 -0.725 55.2 -99.0 -89.2 149.7 10.2 -22.6 19.4 55 80 A N E > -H 37 0B 46 -2,-0.3 4,-2.6 -18,-0.2 -18,-0.2 -0.431 16.2-133.9 -63.6 143.8 12.0 -23.8 22.5 56 81 A V H > S+ 0 0 31 -20,-2.9 4,-1.6 1,-0.2 5,-0.2 0.806 108.9 68.8 -62.3 -28.4 11.8 -21.4 25.5 57 82 A R H > S+ 0 0 159 -21,-0.5 4,-0.7 2,-0.2 -1,-0.2 0.952 112.7 21.8 -50.2 -66.9 15.5 -22.2 25.4 58 83 A D H >> S+ 0 0 61 2,-0.2 4,-0.8 1,-0.2 3,-0.7 0.895 113.2 72.2 -68.7 -41.8 16.3 -20.4 22.1 59 84 A A H >X S+ 0 0 0 -4,-2.6 4,-1.6 1,-0.3 3,-0.6 0.796 99.3 45.1 -55.1 -39.7 13.4 -18.1 22.2 60 85 A K H 3< S+ 0 0 96 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.904 108.7 57.9 -67.2 -37.4 14.7 -16.0 24.9 61 86 A E H << S+ 0 0 160 -3,-0.7 -2,-0.2 -4,-0.7 -1,-0.2 0.534 112.2 41.7 -71.0 -8.1 18.1 -16.0 23.2 62 87 A K H << S+ 0 0 133 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.595 133.2 22.1-108.0 -26.1 16.4 -14.5 20.2 63 88 A C >< - 0 0 2 -4,-1.6 2,-0.7 -5,-0.3 3,-0.6 -0.781 62.5-177.4-142.3 99.0 14.3 -12.2 22.3 64 89 A P T 3 S+ 0 0 106 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 -0.286 86.7 50.8 -86.8 46.8 15.6 -11.3 25.9 65 90 A Q T 3 S+ 0 0 115 -2,-0.7 -5,-0.1 -5,-0.1 -2,-0.0 0.276 74.9 134.2-143.2 -22.5 12.5 -9.2 26.7 66 91 A L < - 0 0 3 -3,-0.6 2,-0.6 -7,-0.2 -36,-0.2 -0.025 51.9-140.0 -37.1 118.7 10.0 -11.8 25.7 67 92 A V E -f 30 0B 61 -38,-2.5 -36,-1.7 -42,-0.1 2,-0.4 -0.837 18.7-153.9 -93.2 120.7 7.4 -11.9 28.4 68 93 A L E -f 31 0B 37 -2,-0.6 2,-0.4 -38,-0.2 -36,-0.2 -0.788 13.5-173.8-103.1 133.1 6.3 -15.5 29.0 69 94 A V E -f 32 0B 38 -38,-2.0 -36,-3.6 -2,-0.4 2,-0.5 -0.955 29.4-114.3-124.1 143.4 3.0 -16.6 30.4 70 95 A N E +f 33 0B 82 -2,-0.4 3,-0.2 -38,-0.2 -36,-0.2 -0.662 31.6 174.0 -86.1 124.6 2.2 -20.2 31.3 71 96 A G + 0 0 0 -38,-3.5 -37,-0.1 -2,-0.5 -1,-0.1 -0.140 40.3 116.5-124.1 41.6 -0.5 -21.9 29.3 72 97 A E + 0 0 85 -39,-0.2 2,-0.6 1,-0.1 -1,-0.1 0.661 69.1 69.2 -75.3 -20.9 -0.5 -25.6 30.5 73 98 A D - 0 0 100 -3,-0.2 3,-0.3 1,-0.1 4,-0.3 -0.918 64.1-172.1-104.7 113.8 -4.0 -25.2 31.8 74 99 A L > + 0 0 52 -2,-0.6 4,-3.1 1,-0.2 5,-0.3 0.449 50.7 112.3 -90.8 1.7 -6.4 -24.8 28.9 75 100 A T H > S+ 0 0 44 1,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.869 84.0 37.5 -42.1 -60.2 -9.5 -24.0 31.0 76 101 A R H > S+ 0 0 100 -3,-0.3 4,-2.4 2,-0.2 -1,-0.3 0.834 116.9 50.2 -63.6 -36.6 -9.8 -20.4 29.7 77 102 A Y H > S+ 0 0 0 -3,-0.3 4,-2.1 -4,-0.3 -1,-0.2 0.857 112.8 48.6 -73.2 -32.1 -8.8 -21.1 26.1 78 103 A R H X S+ 0 0 36 -4,-3.1 4,-2.0 2,-0.2 -2,-0.2 0.955 111.8 48.6 -64.6 -49.9 -11.2 -23.9 26.0 79 104 A E H X S+ 0 0 101 -4,-2.7 4,-1.3 -5,-0.3 -2,-0.2 0.939 114.8 43.8 -59.6 -46.0 -14.0 -21.7 27.4 80 105 A M H X S+ 0 0 43 -4,-2.4 4,-2.2 1,-0.2 3,-0.4 0.902 107.6 60.6 -67.0 -42.6 -13.3 -18.8 25.0 81 106 A S H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.886 105.0 49.2 -45.9 -48.2 -13.0 -21.2 22.1 82 107 A Y H X S+ 0 0 57 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.831 104.3 57.5 -65.2 -33.6 -16.6 -22.4 22.7 83 108 A K H X S+ 0 0 110 -4,-1.3 4,-2.4 -3,-0.4 -2,-0.2 0.946 107.2 50.8 -63.6 -45.2 -18.0 -18.8 22.8 84 109 A V H >X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 3,-0.6 0.979 111.2 45.7 -50.0 -64.8 -16.5 -18.3 19.4 85 110 A T H 3X S+ 0 0 4 -4,-1.9 4,-2.4 1,-0.3 -1,-0.2 0.885 112.8 52.4 -46.9 -42.8 -18.2 -21.5 18.0 86 111 A E H 3X S+ 0 0 117 -4,-2.5 4,-0.9 2,-0.2 -1,-0.3 0.871 106.5 51.8 -69.0 -36.9 -21.4 -20.5 19.6 87 112 A L H XX S+ 0 0 10 -4,-2.4 3,-1.2 -3,-0.6 4,-0.8 0.967 112.1 46.6 -58.5 -53.6 -21.4 -17.1 18.1 88 113 A L H >X S+ 0 0 0 -4,-2.4 4,-1.6 1,-0.3 3,-0.8 0.868 103.5 62.8 -59.7 -33.4 -20.9 -18.7 14.6 89 114 A E H 3< S+ 0 0 60 -4,-2.4 -1,-0.3 -5,-0.3 -2,-0.2 0.829 95.8 61.7 -60.5 -26.1 -23.7 -21.2 15.4 90 115 A E H << S+ 0 0 147 -3,-1.2 -1,-0.3 -4,-0.9 -2,-0.2 0.837 104.0 47.5 -69.2 -35.2 -25.9 -18.2 15.6 91 116 A F H << S- 0 0 46 -4,-0.8 -2,-0.2 -3,-0.8 -1,-0.1 0.995 137.8 -7.2 -64.2 -70.4 -25.2 -17.4 11.9 92 117 A S < - 0 0 12 -4,-1.6 -1,-0.3 1,-0.1 14,-0.1 -1.000 65.5-133.3-127.7 136.6 -25.7 -21.0 10.6 93 118 A P S S+ 0 0 88 0, 0.0 2,-1.6 0, 0.0 -4,-0.1 0.798 89.9 82.6 -53.4 -28.2 -26.3 -24.0 12.9 94 119 A V + 0 0 53 12,-0.2 12,-1.3 176,-0.1 2,-0.4 -0.542 56.1 151.7 -92.1 78.2 -23.8 -26.1 11.0 95 120 A V E -C 105 0A 0 -2,-1.6 176,-2.5 10,-0.2 177,-0.4 -0.900 26.0-161.0-107.5 130.7 -20.3 -25.1 12.4 96 121 A E E -C 104 0A 40 8,-2.5 8,-2.8 -2,-0.4 2,-0.5 -0.927 12.0-141.2-113.1 134.8 -17.4 -27.6 12.4 97 122 A R E -C 103 0A 37 -2,-0.4 2,-0.6 6,-0.2 6,-0.2 -0.838 13.4-168.8-101.4 133.7 -14.4 -27.1 14.8 98 123 A L E > -C 102 0A 84 4,-2.3 4,-1.5 -2,-0.5 3,-0.5 -0.945 68.6 -48.5-113.9 103.7 -10.8 -27.7 13.9 99 124 A G T 4 S- 0 0 46 -2,-0.6 -1,-0.1 1,-0.2 0, 0.0 -0.249 96.0 -48.6 67.7-154.4 -9.0 -27.5 17.2 100 125 A F T 4 S+ 0 0 52 1,-0.1 -1,-0.2 -3,-0.1 3,-0.0 0.670 136.6 32.9 -90.1 -15.7 -9.6 -24.6 19.6 101 126 A D T 4 S+ 0 0 50 -3,-0.5 -91,-2.7 -91,-0.1 2,-0.4 0.344 98.9 79.1-129.3 1.8 -9.2 -21.8 17.1 102 127 A E E < +AC 9 98A 29 -4,-1.5 -4,-2.3 -93,-0.2 2,-0.3 -0.931 47.8 174.3-116.7 140.7 -10.4 -23.0 13.7 103 128 A N E -AC 8 97A 0 -95,-2.6 -95,-3.8 -2,-0.4 2,-0.4 -0.985 15.3-158.6-142.6 137.1 -14.1 -23.2 12.5 104 129 A F E -AC 7 96A 9 -8,-2.8 -8,-2.5 -2,-0.3 2,-0.4 -0.917 9.7-172.1-105.4 142.4 -15.8 -23.9 9.3 105 130 A V E -AC 6 95A 0 -99,-1.9 -99,-2.7 -2,-0.4 2,-0.9 -0.997 22.5-134.9-130.6 136.2 -19.3 -22.8 8.6 106 131 A D E +A 5 0A 38 -12,-1.3 3,-0.3 -2,-0.4 -101,-0.2 -0.839 24.8 179.3 -88.8 107.9 -21.2 -23.9 5.6 107 132 A L > + 0 0 0 -103,-2.2 4,-2.5 -2,-0.9 5,-0.3 0.302 45.5 109.8 -90.1 8.1 -22.8 -20.7 4.4 108 133 A T H > S+ 0 0 37 -104,-0.5 4,-1.6 1,-0.2 -1,-0.2 0.884 81.0 41.2 -59.9 -47.3 -24.6 -22.1 1.3 109 134 A E H > S+ 0 0 166 -3,-0.3 4,-1.6 1,-0.2 -1,-0.2 0.856 115.5 52.2 -66.2 -38.2 -28.2 -21.8 2.6 110 135 A M H > S+ 0 0 43 -4,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.901 108.2 48.1 -68.1 -46.2 -27.6 -18.4 4.1 111 136 A V H X S+ 0 0 1 -4,-2.5 4,-2.9 1,-0.2 -1,-0.2 0.899 113.0 49.9 -60.0 -43.3 -26.1 -16.8 0.9 112 137 A E H X S+ 0 0 75 -4,-1.6 4,-1.9 -5,-0.3 -1,-0.2 0.836 109.5 51.0 -66.2 -35.0 -29.0 -18.1 -1.2 113 138 A K H X S+ 0 0 131 -4,-1.6 4,-0.7 2,-0.2 -1,-0.2 0.910 111.2 48.6 -69.6 -41.8 -31.5 -16.7 1.3 114 139 A R H >X S+ 0 0 66 -4,-2.4 3,-2.1 1,-0.2 4,-0.8 0.979 110.1 50.4 -60.7 -54.5 -29.8 -13.4 1.1 115 140 A L H >< S+ 0 0 19 -4,-2.9 3,-1.0 1,-0.3 -1,-0.2 0.866 103.0 60.5 -52.1 -40.5 -29.7 -13.4 -2.7 116 141 A Q H 3< S+ 0 0 152 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.754 101.7 57.0 -54.2 -26.5 -33.5 -14.2 -2.8 117 142 A Q H << S+ 0 0 137 -3,-2.1 -1,-0.2 -4,-0.7 -2,-0.2 0.767 93.3 80.6 -79.4 -29.7 -34.0 -11.0 -0.9 118 143 A L S << S- 0 0 59 -3,-1.0 2,-0.1 -4,-0.8 5,-0.0 -0.460 71.2-129.6 -86.9 152.5 -32.4 -8.6 -3.4 119 144 A Q > - 0 0 105 -2,-0.1 4,-0.7 1,-0.1 -1,-0.1 -0.461 34.6 -94.6 -91.3 166.9 -33.9 -7.2 -6.7 120 145 A S T >4 S+ 0 0 105 1,-0.2 3,-0.5 2,-0.2 4,-0.3 0.869 123.2 49.3 -39.9 -50.7 -32.4 -7.1 -10.2 121 146 A D G >4 S+ 0 0 115 1,-0.2 3,-1.6 2,-0.2 4,-0.3 0.948 108.6 45.8 -61.0 -58.4 -31.0 -3.6 -9.5 122 147 A E G 34 S+ 0 0 89 1,-0.3 -1,-0.2 2,-0.2 -2,-0.2 0.414 97.1 78.6 -70.7 4.6 -29.2 -4.0 -6.2 123 148 A L G << S+ 0 0 70 -4,-0.7 -1,-0.3 -3,-0.5 3,-0.2 0.641 90.9 51.9 -82.1 -18.1 -27.7 -7.2 -7.5 124 149 A S S < S+ 0 0 77 -3,-1.6 -1,-0.2 -4,-0.3 -2,-0.2 0.555 102.1 62.0 -88.6 -12.6 -25.2 -5.1 -9.5 125 150 A A S S+ 0 0 68 -4,-0.3 2,-0.4 2,-0.1 -1,-0.2 0.417 72.0 121.1 -93.9 -2.2 -24.3 -3.2 -6.3 126 151 A V - 0 0 10 -3,-0.2 2,-0.3 14,-0.1 24,-0.1 -0.507 43.6-179.4 -62.9 118.7 -23.0 -6.4 -4.6 127 152 A T - 0 0 92 -2,-0.4 26,-0.1 22,-0.1 2,-0.1 -0.797 26.5-101.7-121.8 165.0 -19.4 -5.7 -3.7 128 153 A V - 0 0 45 -2,-0.3 2,-0.5 2,-0.1 21,-0.1 -0.368 20.5-140.7 -83.6 160.5 -16.7 -7.8 -2.1 129 154 A S - 0 0 38 20,-0.2 2,-0.1 2,-0.2 27,-0.1 -0.987 67.4 -18.5-124.6 117.6 -15.6 -7.5 1.5 130 155 A G S S- 0 0 47 -2,-0.5 64,-0.2 64,-0.1 -2,-0.1 -0.425 106.6 -10.4 83.3-162.1 -11.9 -7.8 1.9 131 156 A H E -d 194 0A 59 62,-2.2 64,-1.6 -2,-0.1 2,-0.5 -0.321 52.1-144.5 -73.1 150.2 -9.2 -9.2 -0.3 132 157 A V E > -d 195 0A 21 62,-0.2 3,-1.7 -4,-0.1 64,-0.2 -0.989 36.5-103.3-114.1 127.3 -9.9 -11.2 -3.4 133 158 A Y G > S- 0 0 15 62,-3.2 3,-1.3 -2,-0.5 64,-0.3 -0.246 99.2 -1.8 -56.9 131.0 -7.4 -14.0 -4.0 134 159 A N G 3 S- 0 0 78 1,-0.3 -1,-0.3 62,-0.1 62,-0.0 0.747 116.5 -83.2 64.5 28.5 -4.7 -13.3 -6.7 135 160 A N G < S- 0 0 150 -3,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.783 72.6-176.7 46.0 37.9 -6.5 -9.9 -7.4 136 161 A Q < - 0 0 37 -3,-1.3 2,-0.2 -4,-0.1 -1,-0.2 -0.384 27.5-108.2 -73.2 138.2 -8.9 -11.7 -9.6 137 162 A S - 0 0 95 -2,-0.1 2,-0.3 1,-0.1 -1,-0.1 -0.435 27.8-130.4 -62.1 129.1 -11.5 -9.7 -11.5 138 163 A I - 0 0 63 -2,-0.2 2,-0.5 7,-0.0 -1,-0.1 -0.604 13.8-160.4 -77.6 142.6 -15.1 -10.0 -10.3 139 164 A N > - 0 0 87 -2,-0.3 3,-2.1 3,-0.1 7,-0.3 -0.960 2.2-162.6-123.3 104.6 -17.7 -10.7 -12.9 140 165 A L T 3 S+ 0 0 69 -2,-0.5 6,-0.1 1,-0.3 -1,-0.1 0.678 88.8 63.6 -67.7 -13.7 -21.0 -9.6 -11.5 141 166 A L T 3 S+ 0 0 165 4,-0.0 2,-0.8 -17,-0.0 -1,-0.3 0.520 82.2 97.4 -86.9 -3.9 -22.7 -11.7 -14.2 142 167 A D X> - 0 0 38 -3,-2.1 4,-2.7 1,-0.2 3,-1.1 -0.742 64.4-156.0 -89.2 110.4 -21.1 -14.8 -12.7 143 168 A V H 3> S+ 0 0 84 -2,-0.8 4,-1.9 1,-0.3 5,-0.2 0.880 95.9 50.6 -53.1 -36.1 -23.6 -16.6 -10.4 144 169 A L H 3> S+ 0 0 70 2,-0.2 4,-1.4 1,-0.2 -1,-0.3 0.747 109.5 50.2 -77.7 -22.6 -20.6 -18.2 -8.5 145 170 A H H <> S+ 0 0 2 -3,-1.1 4,-2.6 -6,-0.3 -2,-0.2 0.929 108.5 52.8 -74.2 -48.0 -18.9 -14.8 -8.1 146 171 A I H X S+ 0 0 8 -4,-2.7 4,-2.2 -7,-0.3 -2,-0.2 0.892 112.1 44.7 -51.9 -48.3 -22.0 -13.2 -6.7 147 172 A R H X S+ 0 0 52 -4,-1.9 4,-2.9 -5,-0.2 -1,-0.2 0.920 110.8 53.3 -64.6 -44.3 -22.4 -16.0 -4.1 148 173 A L H X S+ 0 0 6 -4,-1.4 4,-2.1 1,-0.2 -2,-0.2 0.911 110.4 48.0 -63.0 -37.1 -18.8 -16.0 -3.1 149 174 A L H X S+ 0 0 2 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.932 110.5 49.2 -66.3 -46.9 -19.0 -12.2 -2.5 150 175 A V H X S+ 0 0 3 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.919 110.0 55.5 -55.2 -42.7 -22.2 -12.4 -0.4 151 176 A G H X S+ 0 0 0 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.935 105.9 49.2 -48.9 -50.5 -20.2 -15.1 1.4 152 177 A S H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.872 107.1 55.2 -64.5 -35.3 -17.4 -12.7 2.0 153 178 A Q H X S+ 0 0 58 -4,-2.2 4,-1.3 1,-0.2 -1,-0.2 0.931 107.8 49.6 -63.0 -45.7 -20.0 -10.1 3.4 154 179 A I H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 3,-0.5 0.934 108.5 53.6 -55.7 -45.7 -21.2 -12.7 5.8 155 180 A A H X S+ 0 0 1 -4,-2.4 4,-2.7 1,-0.3 -2,-0.2 0.915 103.9 54.3 -57.1 -45.6 -17.5 -13.4 6.9 156 181 A A H X S+ 0 0 23 -4,-2.3 4,-3.0 2,-0.2 -1,-0.3 0.870 108.5 51.9 -54.3 -33.2 -16.9 -9.8 7.6 157 182 A E H X S+ 0 0 76 -4,-1.3 4,-2.8 -3,-0.5 5,-0.2 0.946 107.2 49.3 -75.3 -45.2 -19.9 -9.9 9.9 158 183 A M H X S+ 0 0 1 -4,-2.2 4,-2.9 2,-0.2 5,-0.2 0.953 114.4 48.5 -50.2 -47.9 -18.8 -12.9 11.8 159 184 A R H X S+ 0 0 47 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.946 111.0 47.6 -65.0 -47.0 -15.5 -11.1 12.2 160 185 A E H X S+ 0 0 112 -4,-3.0 4,-3.0 1,-0.2 5,-0.2 0.909 114.9 49.4 -54.4 -41.9 -17.1 -7.8 13.4 161 186 A A H X>S+ 0 0 13 -4,-2.8 4,-3.0 2,-0.2 5,-0.5 0.906 106.9 52.7 -66.9 -42.7 -19.2 -9.8 15.8 162 187 A M H X5S+ 0 0 2 -4,-2.9 4,-1.9 -5,-0.2 6,-1.3 0.944 116.7 39.7 -61.8 -44.2 -16.2 -11.8 17.2 163 188 A Y H X5S+ 0 0 130 -4,-2.0 4,-1.9 4,-0.3 -2,-0.2 0.958 120.5 42.9 -67.5 -52.7 -14.4 -8.6 18.0 164 189 A N H <5S+ 0 0 110 -4,-3.0 -2,-0.2 -5,-0.2 -3,-0.2 0.885 126.8 31.4 -59.5 -41.2 -17.4 -6.6 19.2 165 190 A Q H <5S+ 0 0 122 -4,-3.0 -1,-0.2 -5,-0.2 -3,-0.2 0.657 138.1 17.7 -98.5 -22.6 -18.9 -9.3 21.2 166 191 A L H < S- 0 0 10 -172,-0.2 4,-2.6 -175,-0.1 5,-0.2 -0.969 82.5 -98.7-155.5 170.2 -15.1 -26.2 -0.2 178 203 A K H > S+ 0 0 23 88,-0.4 4,-2.5 86,-0.3 5,-0.2 0.888 116.6 52.6 -61.2 -49.4 -13.3 -26.8 3.1 179 204 A L H > S+ 0 0 5 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.944 114.7 42.4 -48.0 -55.1 -9.8 -27.4 1.7 180 205 A L H > S+ 0 0 6 82,-0.3 4,-3.1 2,-0.2 5,-0.3 0.921 112.3 51.3 -65.3 -45.5 -9.9 -24.2 -0.3 181 206 A A H X S+ 0 0 0 -4,-2.6 4,-1.5 1,-0.2 -174,-0.2 0.927 111.9 49.7 -58.0 -39.8 -11.4 -22.0 2.5 182 207 A K H X S+ 0 0 56 -4,-2.5 4,-0.5 -5,-0.2 -1,-0.2 0.894 113.9 44.9 -66.6 -37.9 -8.7 -23.3 4.8 183 208 A L H < S+ 0 0 24 -4,-2.0 3,-0.5 -5,-0.2 -2,-0.2 0.877 115.3 45.4 -74.3 -38.9 -5.9 -22.5 2.3 184 209 A V H >< S+ 0 0 0 -4,-3.1 3,-1.3 1,-0.2 4,-0.4 0.749 98.3 71.2 -78.9 -19.5 -7.2 -19.0 1.3 185 210 A S H 3< S+ 0 0 1 -4,-1.5 -13,-0.3 -5,-0.3 7,-0.2 0.789 98.3 50.5 -69.2 -26.2 -7.9 -17.8 4.9 186 211 A G T 3< S+ 0 0 36 -4,-0.5 -1,-0.3 -3,-0.5 3,-0.3 0.387 81.5 92.9 -90.4 1.1 -4.2 -17.6 5.7 187 212 A V S < S+ 0 0 61 -3,-1.3 2,-0.6 1,-0.3 -1,-0.2 0.964 97.0 27.6 -65.7 -49.6 -3.2 -15.6 2.6 188 213 A F S S- 0 0 70 -4,-0.4 4,-0.4 -3,-0.2 -1,-0.3 -0.925 93.6-157.8-113.5 110.4 -3.5 -12.2 4.4 189 214 A K + 0 0 93 -2,-0.6 2,-0.1 -3,-0.3 4,-0.0 -0.932 50.3 44.0-133.3 155.9 -3.0 -12.4 8.2 190 215 A P S S- 0 0 48 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.587 124.6 -19.7 -86.4 160.4 -3.4 -11.1 10.8 191 216 A N S S+ 0 0 72 1,-0.2 2,-0.3 -2,-0.1 -20,-0.2 0.869 103.6 109.0 57.3 49.4 -7.0 -10.0 11.0 192 217 A Q - 0 0 63 -4,-0.4 -20,-1.3 -7,-0.2 2,-0.3 -0.932 54.2-134.1-140.5 169.8 -7.9 -9.9 7.3 193 218 A Q E - e 0 172A 6 -2,-0.3 -62,-2.2 -22,-0.2 2,-0.4 -0.971 10.3-165.0-130.4 151.5 -10.1 -12.0 4.9 194 219 A T E -de 131 173A 2 -22,-2.0 -20,-2.1 -2,-0.3 2,-0.4 -0.991 6.4-155.6-132.5 133.3 -9.6 -13.4 1.5 195 220 A V E -de 132 174A 1 -64,-1.6 -62,-3.2 -2,-0.4 2,-0.6 -0.901 13.8-143.0-107.9 142.3 -12.3 -14.8 -0.9 196 221 A L - 0 0 5 -22,-2.7 -20,-0.1 -2,-0.4 -62,-0.1 -0.927 8.1-155.7-109.9 112.4 -11.3 -17.3 -3.6 197 222 A L > - 0 0 0 -2,-0.6 3,-2.3 -64,-0.3 -52,-0.1 -0.571 30.3-113.1 -81.7 147.9 -13.0 -17.1 -7.0 198 223 A P G > S+ 0 0 53 0, 0.0 3,-1.9 0, 0.0 4,-0.3 0.837 111.0 64.3 -58.3 -36.3 -13.0 -20.4 -8.9 199 224 A E G 3 S+ 0 0 115 1,-0.3 4,-0.3 2,-0.1 3,-0.2 0.680 101.9 54.4 -55.9 -17.5 -10.6 -19.2 -11.7 200 225 A S G <> S+ 0 0 3 -3,-2.3 4,-2.2 1,-0.1 -1,-0.3 0.198 76.6 100.8-105.6 18.9 -7.9 -18.8 -9.1 201 226 A C H <> S+ 0 0 22 -3,-1.9 4,-2.7 2,-0.2 5,-0.2 0.939 82.7 44.7 -74.1 -49.1 -8.0 -22.3 -7.7 202 227 A Q H > S+ 0 0 88 -4,-0.3 4,-3.1 2,-0.2 5,-0.2 0.932 111.3 56.9 -55.5 -46.7 -5.0 -23.9 -9.5 203 228 A H H > S+ 0 0 94 -4,-0.3 4,-1.0 1,-0.2 -2,-0.2 0.955 111.5 42.0 -49.6 -55.7 -3.0 -20.7 -8.6 204 229 A L H >X S+ 0 0 5 -4,-2.2 3,-1.0 1,-0.2 4,-0.5 0.936 115.6 49.1 -52.6 -51.2 -3.8 -21.2 -4.9 205 230 A I H >< S+ 0 0 0 -4,-2.7 3,-0.8 1,-0.3 -1,-0.2 0.869 112.3 48.7 -64.1 -31.8 -3.1 -24.9 -5.1 206 231 A H H 3< S+ 0 0 51 -4,-3.1 -1,-0.3 1,-0.2 -2,-0.2 0.626 92.9 75.2 -89.6 -8.4 0.1 -24.4 -6.9 207 232 A S H << S+ 0 0 57 -4,-1.0 -1,-0.2 -3,-1.0 -2,-0.2 0.690 74.8 101.2 -72.5 -16.5 1.4 -21.7 -4.4 208 233 A L << - 0 0 27 -3,-0.8 25,-0.4 -4,-0.5 3,-0.1 -0.383 63.3-153.4 -65.8 142.7 2.2 -24.5 -1.9 209 234 A N S S+ 0 0 133 1,-0.2 2,-0.3 23,-0.1 -1,-0.1 0.329 74.3 20.1-102.1 4.3 5.8 -25.5 -1.7 210 235 A H > - 0 0 48 1,-0.1 3,-2.5 22,-0.0 -1,-0.2 -0.867 69.5-120.7-171.7 139.4 5.2 -29.1 -0.5 211 236 A I G > S+ 0 0 0 20,-1.4 3,-2.2 1,-0.3 6,-0.3 0.822 110.8 68.7 -50.1 -33.9 2.4 -31.8 -0.4 212 237 A K G 3 S+ 0 0 116 1,-0.3 -1,-0.3 19,-0.2 4,-0.2 0.761 86.8 68.4 -52.8 -29.3 2.8 -31.7 3.5 213 238 A E G < S+ 0 0 88 -3,-2.5 -1,-0.3 2,-0.1 -2,-0.2 0.525 79.7 97.9 -74.1 -5.9 1.3 -28.1 3.3 214 239 A I S X S- 0 0 1 -3,-2.2 3,-2.2 -4,-0.2 2,-0.3 -0.761 84.7-119.5 -84.3 116.8 -2.1 -29.7 2.3 215 240 A P T 3 S+ 0 0 44 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.413 106.7 37.2 -50.0 114.6 -4.6 -30.2 5.1 216 241 A G T 3 S+ 0 0 46 -2,-0.3 2,-0.8 1,-0.2 5,-0.1 -0.341 94.8 91.3 126.9 -48.1 -5.0 -34.0 5.0 217 242 A I < + 0 0 5 -3,-2.2 -1,-0.2 -6,-0.3 -3,-0.1 -0.705 62.6 179.0 -86.1 110.6 -1.4 -34.8 4.2 218 243 A G > - 0 0 31 -2,-0.8 4,-2.0 -3,-0.1 5,-0.2 -0.066 45.3 -68.8-101.5-162.5 0.3 -35.3 7.6 219 244 A Y H > S+ 0 0 165 1,-0.2 4,-1.4 2,-0.2 -7,-0.1 0.882 129.9 40.1 -60.3 -39.3 3.8 -36.3 8.9 220 245 A K H > S+ 0 0 150 2,-0.2 4,-2.2 1,-0.1 -1,-0.2 0.946 112.9 50.0 -80.3 -45.8 3.5 -39.9 7.7 221 246 A T H > S+ 0 0 32 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.910 108.1 56.6 -58.4 -42.4 1.9 -39.4 4.3 222 247 A A H >X S+ 0 0 2 -4,-2.0 4,-3.3 1,-0.2 3,-1.0 0.976 108.0 46.8 -46.2 -61.5 4.4 -36.7 3.4 223 248 A K H 3X S+ 0 0 101 -4,-1.4 4,-1.2 1,-0.3 -1,-0.2 0.843 109.7 55.1 -56.2 -35.4 7.3 -39.2 4.1 224 249 A C H 3< S+ 0 0 60 -4,-2.2 -1,-0.3 2,-0.2 -2,-0.2 0.848 115.0 37.9 -63.8 -36.0 5.4 -41.8 2.0 225 250 A L H X<>S+ 0 0 0 -4,-2.2 3,-2.8 -3,-1.0 5,-1.4 0.920 111.4 57.7 -80.0 -45.8 5.2 -39.5 -1.0 226 251 A E H ><5S+ 0 0 65 -4,-3.3 3,-0.7 1,-0.3 -2,-0.2 0.759 103.8 56.0 -53.4 -27.9 8.7 -38.0 -0.5 227 252 A A T 3<5S+ 0 0 79 -4,-1.2 -1,-0.3 -5,-0.3 -2,-0.1 0.174 105.5 52.4 -92.6 16.6 10.0 -41.5 -0.7 228 253 A L T < 5S- 0 0 47 -3,-2.8 -1,-0.2 2,-0.2 -2,-0.2 0.273 121.1 -97.7-130.5 5.5 8.4 -41.9 -4.1 229 254 A G T < 5S+ 0 0 54 -3,-0.7 2,-0.6 -4,-0.3 -3,-0.2 0.283 83.8 131.5 92.3 -10.1 9.7 -38.9 -6.0 230 255 A I < + 0 0 2 -5,-1.4 -1,-0.3 1,-0.2 -2,-0.2 -0.682 12.9 133.4 -80.1 114.5 6.5 -36.9 -5.2 231 256 A N + 0 0 67 -2,-0.6 -20,-1.4 -3,-0.1 -19,-0.2 0.644 52.6 57.1-129.2 -42.1 7.3 -33.4 -3.8 232 257 A S S > S- 0 0 47 -22,-0.2 4,-1.3 1,-0.1 -23,-0.1 -0.436 85.3-111.7 -87.2 167.7 5.3 -30.7 -5.5 233 258 A V H > S+ 0 0 3 -25,-0.4 4,-3.1 2,-0.2 5,-0.1 0.838 121.6 53.1 -57.9 -35.0 1.6 -30.5 -5.8 234 259 A R H > S+ 0 0 137 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.915 102.0 57.2 -75.5 -40.3 1.9 -31.1 -9.5 235 260 A D H 4 S+ 0 0 62 2,-0.2 4,-0.5 1,-0.2 -1,-0.2 0.859 113.0 42.5 -46.0 -47.0 4.0 -34.2 -8.9 236 261 A L H >< S+ 0 0 0 -4,-1.3 3,-1.2 2,-0.2 -2,-0.2 0.951 111.6 53.3 -69.2 -52.2 1.0 -35.5 -6.8 237 262 A Q H 3< S+ 0 0 20 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.820 119.9 35.3 -47.2 -36.2 -1.5 -34.2 -9.4 238 263 A T T 3< S+ 0 0 102 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.413 87.8 114.5-106.4 1.9 0.3 -36.2 -12.1 239 264 A F S < S- 0 0 46 -3,-1.2 3,-0.1 -4,-0.5 -3,-0.0 -0.331 83.3 -85.7 -68.1 158.1 1.5 -39.3 -10.3 240 265 A S > - 0 0 45 1,-0.2 4,-2.2 2,-0.0 3,-0.3 -0.551 31.3-150.0 -67.9 120.3 -0.0 -42.5 -11.5 241 266 A P H > S+ 0 0 58 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.960 94.9 54.4 -43.4 -59.3 -3.4 -43.2 -9.7 242 267 A K H > S+ 0 0 156 1,-0.3 4,-1.6 2,-0.2 -2,-0.0 0.808 111.3 41.9 -52.8 -40.3 -2.9 -46.9 -10.0 243 268 A I H > S+ 0 0 83 -3,-0.3 4,-1.2 2,-0.2 -1,-0.3 0.879 111.2 55.8 -78.6 -38.1 0.5 -47.0 -8.3 244 269 A L H X S+ 0 0 1 -4,-2.2 4,-2.0 1,-0.2 5,-0.3 0.839 105.8 53.5 -62.2 -35.7 -0.5 -44.5 -5.6 245 270 A E H X S+ 0 0 64 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.977 106.1 52.4 -58.3 -55.5 -3.4 -46.8 -4.7 246 271 A K H < S+ 0 0 183 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.700 113.6 43.9 -57.0 -25.4 -1.0 -49.8 -4.3 247 272 A E H < S+ 0 0 105 -4,-1.2 -1,-0.2 -3,-0.1 -2,-0.2 0.915 130.4 14.5 -92.0 -43.6 1.2 -47.9 -1.9 248 273 A L H < S- 0 0 35 -4,-2.0 4,-0.5 -5,-0.1 -2,-0.2 0.463 112.8 -93.4-112.7 -5.9 -1.2 -46.0 0.5 249 274 A G X - 0 0 27 -4,-2.9 4,-3.2 -5,-0.3 3,-0.4 0.255 33.4 -93.5 95.4 136.8 -4.5 -47.7 -0.1 250 275 A I H > S+ 0 0 102 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.722 124.5 62.3 -51.5 -27.9 -7.3 -46.7 -2.5 251 276 A S H > S+ 0 0 89 2,-0.2 4,-0.7 3,-0.1 -1,-0.2 0.956 114.6 25.0 -59.9 -61.6 -8.7 -44.9 0.5 252 277 A V H > S+ 0 0 39 -4,-0.5 4,-2.3 -3,-0.4 5,-0.3 0.865 122.4 58.3 -70.4 -40.6 -5.9 -42.4 1.1 253 278 A A H X S+ 0 0 2 -4,-3.2 4,-1.5 1,-0.2 -3,-0.2 0.944 105.6 45.0 -58.3 -51.1 -4.8 -42.5 -2.5 254 279 A Q H X S+ 0 0 110 -4,-1.6 4,-1.0 -5,-0.3 -1,-0.2 0.744 116.6 44.7 -75.3 -23.7 -7.9 -41.4 -4.1 255 280 A R H X S+ 0 0 122 -4,-0.7 4,-2.5 -3,-0.2 -1,-0.2 0.819 109.3 51.9 -85.5 -38.8 -8.7 -38.6 -1.7 256 281 A I H X S+ 0 0 2 -4,-2.3 4,-1.6 2,-0.2 -2,-0.2 0.786 108.0 54.9 -74.1 -19.4 -5.3 -37.0 -1.5 257 282 A Q H X S+ 0 0 30 -4,-1.5 4,-0.6 -5,-0.3 -1,-0.2 0.941 107.6 48.4 -71.4 -44.6 -5.2 -36.9 -5.3 258 283 A K H >X>S+ 0 0 86 -4,-1.0 3,-2.3 1,-0.2 5,-2.0 0.957 109.5 55.1 -54.3 -47.5 -8.5 -35.0 -5.3 259 284 A L H ><5S+ 0 0 8 -4,-2.5 3,-1.5 1,-0.3 -1,-0.2 0.875 98.6 60.3 -56.4 -40.0 -7.0 -32.7 -2.7 260 285 A S H 3<5S+ 0 0 0 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.660 105.9 49.2 -66.8 -12.1 -4.0 -31.9 -5.0 261 286 A F H <<5S- 0 0 67 -3,-2.3 -1,-0.3 -4,-0.6 -2,-0.2 0.631 122.8-104.1 -94.5 -12.1 -6.5 -30.6 -7.5 262 287 A G T <<5S+ 0 0 4 -3,-1.5 2,-0.4 -4,-0.7 -82,-0.3 0.467 77.5 138.9 97.1 12.2 -8.3 -28.4 -5.0 263 288 A E < + 0 0 89 -5,-2.0 2,-0.3 -6,-0.2 -1,-0.3 -0.764 18.9 161.4-101.3 129.8 -11.3 -30.8 -4.8 264 289 A D + 0 0 28 -2,-0.4 -86,-0.3 -3,-0.1 -84,-0.1 -0.807 15.4 175.8-153.9 102.3 -12.9 -31.6 -1.5 265 290 A N + 0 0 137 -2,-0.3 -1,-0.1 -88,-0.1 -2,-0.0 0.572 41.6 124.8 -87.9 -7.3 -16.3 -33.1 -1.3 266 291 A S - 0 0 36 1,-0.1 -88,-0.4 3,-0.0 -87,-0.1 -0.297 58.5-127.2 -63.6 126.4 -16.3 -33.5 2.5 267 292 A P - 0 0 73 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.240 21.9-105.2 -69.5 154.9 -19.3 -31.9 4.2 268 293 A V - 0 0 11 -174,-0.1 2,-0.4 -172,-0.0 -162,-0.1 -0.759 43.2-147.7 -75.4 124.7 -19.0 -29.4 7.1 269 294 A I - 0 0 94 -2,-0.5 2,-0.7 -3,-0.0 -165,-0.1 -0.797 14.8-115.3 -97.9 140.1 -20.1 -31.5 10.1 270 295 A L - 0 0 83 -2,-0.4 -174,-0.2 1,-0.2 -176,-0.1 -0.670 25.8-163.7 -72.5 113.8 -21.9 -30.0 13.1 271 296 A S + 0 0 39 -176,-2.5 -1,-0.2 -2,-0.7 -175,-0.1 0.924 23.2 164.5 -65.7 -49.4 -19.4 -30.4 16.0 272 297 A G - 0 0 22 -177,-0.4 -1,-0.1 2,-0.0 3,-0.1 -0.191 56.0 -4.7 60.3-152.3 -21.9 -29.8 18.8 273 298 A P S S- 0 0 70 0, 0.0 37,-0.0 0, 0.0 0, 0.0 -0.346 93.7 -83.6 -71.6 158.2 -20.8 -30.9 22.2 274 299 A P - 0 0 31 0, 0.0 98,-0.1 0, 0.0 3,-0.1 -0.181 20.6-143.5 -56.7 145.4 -17.4 -32.8 22.7 275 300 A Q S S+ 0 0 146 1,-0.1 96,-0.5 -3,-0.1 97,-0.5 0.608 83.0 5.8 -80.3 -16.6 -17.0 -36.5 22.1 276 301 A S E -I 370 0C 58 94,-0.2 2,-0.4 95,-0.1 94,-0.2 -0.978 57.7-143.6-161.1 163.0 -14.5 -36.7 25.0 277 302 A F E +I 369 0C 16 92,-2.1 92,-3.0 -2,-0.3 2,-0.3 -0.996 27.8 166.8-132.6 133.4 -12.7 -34.8 27.8 278 303 A S E -I 368 0C 50 -2,-0.4 2,-0.4 90,-0.2 90,-0.2 -0.991 24.4-152.7-144.5 156.6 -9.1 -35.4 28.9 279 304 A E E -I 367 0C 39 88,-1.8 88,-1.6 -2,-0.3 2,-0.2 -0.989 17.7-165.6-122.0 141.8 -6.2 -33.9 30.9 280 305 A E E -I 366 0C 127 -2,-0.4 2,-0.2 86,-0.2 86,-0.2 -0.727 8.9-173.6-116.5 165.5 -2.6 -34.5 30.1 281 306 A D E -I 365 0C 48 84,-0.9 84,-1.9 -2,-0.2 2,-0.3 -0.797 7.0-162.0-163.4 123.5 0.7 -34.0 32.0 282 307 A S E +I 364 0C 37 -2,-0.2 2,-0.3 82,-0.2 82,-0.2 -0.724 18.2 160.3-107.5 147.7 4.2 -34.4 30.7 283 308 A F - 0 0 29 80,-2.2 3,-0.1 -2,-0.3 -2,-0.0 -0.984 47.9-102.4-160.2 168.2 7.3 -34.8 32.8 284 309 A K S S- 0 0 150 1,-0.3 2,-0.2 -2,-0.3 -1,-0.1 0.814 92.9 -32.3 -78.0 -23.9 10.9 -36.0 32.8 285 310 A K - 0 0 110 78,-0.1 -1,-0.3 -3,-0.0 2,-0.3 -0.724 50.3-176.6-177.5 148.4 10.4 -39.3 34.5 286 311 A C + 0 0 11 -2,-0.2 78,-0.1 -3,-0.1 -3,-0.0 -0.818 24.7 145.8-148.7 105.2 8.1 -40.5 37.2 287 312 A S + 0 0 70 -2,-0.3 -1,-0.0 1,-0.1 0, 0.0 0.311 47.9 96.5-124.4 1.1 8.9 -44.1 38.2 288 313 A S - 0 0 78 1,-0.1 -1,-0.1 -3,-0.0 5,-0.0 0.686 68.8-164.8 -64.5 -22.5 7.9 -43.8 41.9 289 314 A E S S+ 0 0 105 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.604 77.6 59.8 47.1 23.1 4.6 -45.2 40.6 290 315 A V S > S+ 0 0 106 3,-0.0 4,-0.8 0, 0.0 -1,-0.3 0.230 106.0 46.4-139.1 -29.3 2.6 -44.3 43.7 291 316 A E H > S+ 0 0 76 2,-0.2 4,-2.0 1,-0.2 3,-0.3 0.803 104.1 64.7 -68.2 -38.3 3.5 -40.6 43.2 292 317 A A H 4 S+ 0 0 1 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.609 97.7 55.6 -56.5 -14.5 2.4 -41.7 39.7 293 318 A K H > S+ 0 0 79 2,-0.2 4,-1.4 3,-0.1 -1,-0.2 0.838 100.9 55.9 -81.7 -42.2 -1.0 -42.2 41.5 294 319 A N H >X S+ 0 0 99 -4,-0.8 4,-1.8 -3,-0.3 3,-1.1 0.947 103.2 53.8 -53.9 -54.2 -1.0 -38.6 42.7 295 320 A K H 3X S+ 0 0 45 -4,-2.0 4,-2.4 1,-0.3 3,-0.5 0.893 109.1 51.4 -38.5 -46.0 -0.6 -37.3 39.2 296 321 A I H 3> S+ 0 0 0 -4,-0.5 4,-1.4 1,-0.3 -1,-0.3 0.725 105.5 53.8 -76.8 -22.7 -3.7 -39.5 38.5 297 322 A E H X S+ 0 0 47 -4,-2.0 4,-1.5 2,-0.2 3,-0.6 0.968 113.9 50.3 -74.1 -54.3 -10.0 -31.5 37.5 303 328 A L H 3X S+ 0 0 0 -4,-2.7 4,-1.7 -5,-0.2 5,-0.2 0.832 105.8 60.2 -49.3 -36.4 -11.6 -33.7 34.8 304 329 A L H 3X S+ 0 0 37 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.888 101.5 51.5 -64.5 -43.7 -14.4 -34.4 37.3 305 330 A N H - 0 0 75 0, 0.0 3,-1.8 0, 0.0 -21,-0.0 -0.296 21.3-129.0 -53.4 131.9 -19.5 -48.9 36.5 338 366 A S G > S+ 0 0 97 1,-0.3 3,-1.8 2,-0.2 -2,-0.0 0.845 106.8 60.1 -57.3 -41.9 -23.1 -47.8 36.4 339 367 A H G 3 S+ 0 0 87 1,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.767 109.8 45.9 -53.7 -26.8 -23.4 -47.5 40.2 340 368 A V G < S+ 0 0 45 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.100 82.9 91.8-110.7 22.4 -20.6 -44.9 40.0 341 369 A I < + 0 0 15 -3,-1.8 2,-0.7 -5,-0.1 -1,-0.2 -0.268 53.2 121.1 -98.1 39.4 -21.9 -42.8 37.0 342 370 A Q 0 0 115 -3,-0.1 -1,-0.1 1,-0.0 -3,-0.0 -0.549 360.0 360.0-108.8 68.9 -23.6 -40.6 39.6 343 371 A K 0 0 112 -2,-0.7 -35,-0.0 -36,-0.0 -1,-0.0 -0.574 360.0 360.0 103.8 360.0 -22.0 -37.2 38.8 344 ! 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 0.0 345 378 A D 0 0 147 0, 0.0 -5,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 95.3 -17.4 -40.0 46.7 346 379 A V + 0 0 17 1,-0.2 4,-0.2 -3,-0.0 -3,-0.0 0.249 360.0 55.0 75.9 -12.3 -16.6 -40.7 43.1 347 380 A M S > S+ 0 0 41 2,-0.1 4,-2.6 3,-0.1 5,-0.3 0.665 98.8 64.6-110.4 -46.7 -12.8 -40.2 43.1 348 381 A T T 4 S+ 0 0 114 1,-0.2 4,-0.3 2,-0.2 0, 0.0 0.816 113.3 32.2 -43.6 -43.7 -12.6 -42.7 45.8 349 382 A P T > S+ 0 0 52 0, 0.0 4,-1.5 0, 0.0 3,-0.5 0.824 116.6 57.4 -82.3 -29.9 -13.9 -45.4 43.4 350 383 A M H > S+ 0 0 11 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.804 95.3 62.6 -69.2 -34.1 -12.3 -44.0 40.2 351 384 A V H X S+ 0 0 11 -4,-2.6 4,-1.2 1,-0.2 -1,-0.2 0.781 104.9 48.8 -68.8 -26.5 -8.7 -43.9 41.4 352 385 A D H >> S+ 0 0 106 -3,-0.5 4,-2.3 -5,-0.3 3,-0.8 0.977 105.8 53.7 -74.3 -57.2 -8.8 -47.7 41.7 353 386 A I H 3X S+ 0 0 34 -4,-1.5 4,-1.7 1,-0.3 3,-0.2 0.901 115.1 44.0 -40.2 -51.7 -10.3 -48.4 38.3 354 387 A L H 3X S+ 0 0 0 -4,-2.1 4,-1.4 1,-0.2 -1,-0.3 0.800 110.4 54.8 -65.8 -32.4 -7.4 -46.3 36.9 355 388 A M H < S+ 0 0 28 -4,-1.4 3,-1.2 1,-0.2 -2,-0.2 0.931 105.9 48.6 -62.2 -47.9 -2.3 -48.7 35.5 359 392 A R H 3< S+ 0 0 159 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.664 92.3 76.7 -75.0 -18.1 -0.7 -52.0 36.6 360 393 A N T 3< 0 0 107 -4,-1.1 -1,-0.3 -5,-0.1 -2,-0.1 0.419 360.0 360.0 -66.8 4.8 -1.8 -53.7 33.4 361 394 A M < 0 0 47 -3,-1.2 -1,-0.1 -31,-0.0 -29,-0.0 -0.977 360.0 360.0-135.5 360.0 1.1 -51.8 31.9 362 ! 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 0.0 363 404 A T 0 0 17 0, 0.0 -80,-2.2 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 -21.3 7.2 -39.6 30.7 364 405 A L E -IJ 282 322C 8 -42,-0.8 -42,-1.0 -82,-0.2 2,-0.4 -0.987 360.0-167.4-143.4 131.6 3.4 -38.9 30.4 365 406 A L E +IJ 281 321C 9 -84,-1.9 -84,-0.9 -2,-0.4 2,-0.3 -0.929 17.6 173.7-115.0 144.7 0.2 -39.6 32.3 366 407 A S E -IJ 280 320C 6 -46,-1.5 -46,-2.8 -2,-0.4 2,-0.4 -0.975 18.2-162.7-156.1 127.7 -3.2 -39.0 30.8 367 408 A V E -IJ 279 319C 0 -88,-1.6 -88,-1.8 -2,-0.3 2,-0.4 -0.949 12.5-173.4-113.2 135.4 -6.9 -39.7 31.7 368 409 A C E -IJ 278 318C 12 -50,-2.4 -50,-1.9 -2,-0.4 2,-0.5 -0.996 10.9-158.9-131.1 126.9 -9.7 -39.5 29.1 369 410 A F E +IJ 277 317C 9 -92,-3.0 -92,-2.1 -2,-0.4 -52,-0.2 -0.922 31.8 148.8-100.7 127.5 -13.4 -39.8 29.7 370 411 A C E +IJ 276 316C 13 -54,-2.7 -54,-2.0 -2,-0.5 -55,-1.0 -0.705 31.6 73.2-143.4-166.0 -15.4 -40.8 26.7 371 412 A N E - 0 0 78 -96,-0.5 -56,-2.1 -2,-0.2 2,-0.3 0.981 69.1-166.0 50.1 61.7 -18.5 -42.6 25.3 372 413 A L E J 0 314C 25 -97,-0.5 -1,-0.2 -58,-0.3 -96,-0.0 -0.599 360.0 360.0 -79.6 136.0 -20.8 -39.8 26.6 373 414 A K 0 0 149 -60,-2.9 -60,-2.1 -2,-0.3 -1,-0.0 -0.974 360.0 360.0-120.5 360.0 -24.6 -40.2 26.9