==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 12-APR-96 1ZQE . COMPND 2 MOLECULE: DNA (5'-D(*CP*AP*TP*TP*AP*GP*AP*A)-3'); . SOURCE 2 SYNTHETIC: YES; . AUTHOR H.PELLETIER,M.R.SAWAYA . 327 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18116.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 225 68.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 2.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 28 8.6 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 . 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 . 17 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 120 36.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.8 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 2 1 0 4 2 0 1 1 1 0 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 1 0 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 9 A E 0 0 214 0, 0.0 39,-0.1 0, 0.0 38,-0.1 0.000 360.0 360.0 360.0 -16.2 67.1 57.7 56.2 2 10 A T + 0 0 126 37,-0.1 4,-0.3 3,-0.0 37,-0.0 0.202 360.0 69.6-168.8 -16.5 66.9 58.9 59.8 3 11 A L S S+ 0 0 57 1,-0.2 42,-0.2 36,-0.1 4,-0.1 0.895 116.5 28.9 -80.3 -33.8 64.8 62.0 59.9 4 12 A N S >> S+ 0 0 8 35,-0.2 4,-2.4 1,-0.1 3,-0.5 0.280 91.8 113.7-106.4 7.0 61.9 59.8 59.1 5 13 A G H >> S+ 0 0 14 1,-0.2 4,-3.3 2,-0.2 3,-0.5 0.884 73.0 48.9 -36.8 -80.0 63.1 56.6 60.8 6 14 A G H 3> S+ 0 0 40 -4,-0.3 4,-1.9 1,-0.3 -1,-0.2 0.749 113.2 50.8 -40.1 -37.5 60.8 56.2 63.7 7 15 A I H <> S+ 0 0 5 -3,-0.5 4,-2.2 2,-0.2 -1,-0.3 0.967 113.9 43.4 -69.1 -48.8 57.8 56.7 61.3 8 16 A T H S+ 0 0 38 -4,-1.3 5,-1.4 -3,-0.4 4,-0.5 0.956 106.9 44.9 -71.3 -48.3 51.9 42.4 61.7 18 26 A E H <5S+ 0 0 7 -4,-1.2 6,-0.8 -3,-0.3 -2,-0.2 0.881 115.1 53.8 -59.3 -39.4 48.7 42.6 59.5 19 27 A K H <5S+ 0 0 82 -4,-2.0 -2,-0.2 4,-0.2 -1,-0.2 0.932 124.7 17.9 -60.7 -53.0 50.7 40.5 57.0 20 28 A N T <5S+ 0 0 21 -4,-2.1 -3,-0.2 -5,-0.1 -2,-0.1 0.963 131.9 35.5 -86.8 -75.0 51.6 37.6 59.4 21 29 A V T 5S+ 0 0 27 -4,-0.5 2,-0.2 -5,-0.3 -3,-0.2 0.733 129.3 31.0 -53.3 -29.3 49.3 37.6 62.6 22 30 A S S + 0 0 24 -6,-0.8 4,-3.2 1,-0.2 5,-0.3 -0.238 17.6 165.2 -59.4 55.6 45.3 41.8 56.0 25 33 A I H > S+ 0 0 103 -2,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.810 78.2 46.6 -41.4 -38.7 47.2 41.7 52.7 26 34 A H H > S+ 0 0 147 2,-0.2 4,-4.0 3,-0.2 -1,-0.2 0.964 113.0 43.3 -70.2 -58.2 45.8 45.1 51.9 27 35 A K H > S+ 0 0 108 1,-0.3 4,-2.6 2,-0.2 -2,-0.2 0.883 118.3 50.2 -54.6 -43.9 46.3 46.9 55.2 28 36 A Y H X S+ 0 0 32 -4,-3.2 4,-1.0 2,-0.2 -1,-0.3 0.928 109.1 47.4 -63.0 -48.3 49.6 45.4 55.1 29 37 A N H >X S+ 0 0 82 -4,-2.1 4,-1.8 -5,-0.3 3,-0.7 0.928 110.6 57.6 -58.8 -41.8 50.2 46.6 51.6 30 38 A A H 3X S+ 0 0 32 -4,-4.0 4,-2.1 1,-0.2 -2,-0.2 0.911 100.4 53.2 -50.6 -55.1 49.0 49.9 52.8 31 39 A Y H 3X S+ 0 0 13 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.767 109.3 52.5 -56.7 -28.3 51.6 50.3 55.6 32 40 A R H X S+ 0 0 76 -4,-1.8 4,-3.6 2,-0.2 3,-0.6 0.965 119.2 46.5 -64.7 -42.1 53.6 52.1 50.4 34 42 A A H 3X S+ 0 0 0 -4,-2.1 4,-3.6 1,-0.2 5,-0.4 0.961 112.5 47.7 -54.9 -57.3 53.1 54.8 53.1 35 43 A A H 3< S+ 0 0 8 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.609 115.6 50.1 -56.7 -20.2 56.3 53.7 55.1 36 44 A S H XX S+ 0 0 52 -4,-1.1 4,-1.0 -3,-0.6 3,-0.7 0.923 113.3 41.7 -81.5 -59.1 57.9 53.9 51.6 37 45 A V H >X S+ 0 0 33 -4,-3.6 4,-1.3 1,-0.3 3,-1.0 0.906 112.0 52.9 -57.6 -51.8 56.6 57.3 50.7 38 46 A I H 3< S+ 0 0 0 -4,-3.6 -1,-0.3 1,-0.2 -3,-0.2 0.654 105.1 61.4 -59.6 -16.6 57.2 58.9 54.1 39 47 A A H <4 S+ 0 0 43 -3,-0.7 -1,-0.2 -5,-0.4 -2,-0.2 0.865 102.0 48.2 -73.8 -40.5 60.8 57.5 53.7 40 48 A K H << S+ 0 0 178 -4,-1.0 -2,-0.2 -3,-1.0 -1,-0.1 0.856 84.1 112.0 -65.0 -43.9 61.5 59.6 50.6 41 49 A Y < - 0 0 56 -4,-1.3 4,-0.1 1,-0.1 -37,-0.1 -0.163 60.2-149.0 -48.2 115.0 60.2 62.9 52.2 42 50 A P + 0 0 85 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.217 70.0 64.2 -69.1 -2.5 63.1 65.2 52.7 43 51 A H S S- 0 0 110 -39,-0.0 2,-0.5 -40,-0.0 3,-0.0 -0.937 91.9 -90.4-134.0 157.2 61.8 66.9 55.7 44 52 A K - 0 0 110 -2,-0.3 -40,-0.1 1,-0.1 2,-0.1 -0.508 42.6-125.6 -66.9 112.9 60.9 66.0 59.4 45 53 A I - 0 0 6 -2,-0.5 3,-0.1 1,-0.2 -1,-0.1 -0.404 30.7-178.0 -59.8 127.3 57.4 65.0 59.5 46 54 A K + 0 0 145 1,-0.4 2,-0.3 -2,-0.1 -1,-0.2 0.639 58.6 1.0-103.7 -18.2 55.9 67.3 62.1 47 55 A S >> - 0 0 37 1,-0.1 4,-1.5 -3,-0.0 3,-0.6 -0.979 68.3-107.5-165.0 157.6 52.4 66.1 62.3 48 56 A G H >> S+ 0 0 0 -2,-0.3 4,-3.8 1,-0.3 3,-1.1 0.925 120.8 56.8 -48.4 -55.0 50.0 63.6 60.8 49 57 A A H 3> S+ 0 0 66 1,-0.3 4,-0.6 2,-0.2 -1,-0.3 0.820 106.7 49.9 -42.1 -47.5 48.4 66.3 59.0 50 58 A E H <4 S+ 0 0 39 -3,-0.6 -1,-0.3 2,-0.2 -2,-0.2 0.723 114.9 43.5 -61.1 -38.1 51.8 67.0 57.4 51 59 A A H X< S+ 0 0 0 -4,-1.5 3,-4.9 -3,-1.1 -2,-0.2 0.919 101.6 70.1 -68.2 -55.4 52.3 63.4 56.5 52 60 A K H 3< S+ 0 0 93 -4,-3.8 -2,-0.2 1,-0.4 -1,-0.2 0.641 81.0 73.3 -37.9 -31.9 48.8 63.2 55.3 53 61 A K T 3< S+ 0 0 166 -4,-0.6 -1,-0.4 -5,-0.3 -2,-0.1 0.784 86.4 101.3 -63.5 -19.8 49.6 65.3 52.4 54 62 A L S < S- 0 0 39 -3,-4.9 2,-0.5 1,-0.1 -20,-0.1 -0.013 86.3 -96.5 -66.0 168.9 51.3 62.3 51.2 55 63 A P S S+ 0 0 90 0, 0.0 -18,-0.2 0, 0.0 -1,-0.1 -0.749 109.0 8.3 -86.5 125.1 50.4 59.7 48.8 56 64 A G S S+ 0 0 38 -2,-0.5 2,-1.1 1,-0.3 -22,-0.2 0.208 97.2 130.8 84.5 -8.2 48.8 56.6 50.4 57 65 A V + 0 0 12 -6,-0.2 -1,-0.3 -5,-0.1 2,-0.2 -0.599 36.7 176.6 -84.5 117.6 48.8 58.4 53.4 58 66 A G > - 0 0 24 -2,-1.1 4,-3.2 -3,-0.1 5,-0.3 -0.444 47.8 -94.9-107.8-179.5 45.4 58.2 55.0 59 67 A T H > S+ 0 0 90 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.935 121.2 57.1 -58.6 -44.2 43.4 59.1 58.0 60 68 A K H 4 S+ 0 0 144 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.856 114.2 32.8 -57.2 -42.6 44.3 55.8 59.4 61 69 A I H > S+ 0 0 14 2,-0.2 4,-2.7 -5,-0.2 -1,-0.2 0.808 114.8 59.5 -81.6 -37.3 48.0 56.2 59.3 62 70 A A H X S+ 0 0 8 -4,-3.2 4,-1.9 1,-0.3 -2,-0.2 0.939 102.9 52.8 -56.5 -50.5 48.0 59.9 59.9 63 71 A E H X S+ 0 0 133 -4,-2.9 4,-1.4 -5,-0.3 -1,-0.3 0.810 108.5 53.7 -53.7 -30.4 46.2 59.2 63.1 64 72 A K H > S+ 0 0 34 -4,-0.4 4,-2.0 -5,-0.2 -2,-0.3 0.959 102.3 54.9 -66.6 -54.6 49.1 56.9 63.8 65 73 A I H X S+ 0 0 0 -4,-2.7 4,-3.9 1,-0.2 -2,-0.2 0.887 104.6 53.0 -49.6 -51.4 51.8 59.3 63.2 66 74 A D H X S+ 0 0 66 -4,-1.9 4,-4.2 1,-0.2 5,-0.3 0.946 108.1 48.1 -54.1 -55.5 50.5 61.8 65.7 67 75 A E H X S+ 0 0 75 -4,-1.4 4,-2.5 1,-0.3 6,-0.5 0.833 116.9 45.6 -53.1 -36.1 50.3 59.5 68.6 68 76 A F H < S+ 0 0 53 -4,-2.0 -1,-0.3 2,-0.2 -2,-0.2 0.890 117.0 44.0 -72.4 -43.7 53.7 58.3 67.7 69 77 A L H < S+ 0 0 57 -4,-3.9 -2,-0.2 -5,-0.2 -3,-0.2 0.943 119.0 42.5 -63.1 -52.8 55.0 61.8 67.3 70 78 A A H < S+ 0 0 86 -4,-4.2 2,-0.4 -5,-0.2 -2,-0.2 0.962 125.5 29.4 -57.0 -64.6 53.2 63.1 70.4 71 79 A T S < S- 0 0 63 -4,-2.5 2,-1.0 2,-0.3 -1,-0.1 -0.859 89.1-115.9-103.7 136.1 54.1 60.1 72.7 72 80 A G S S+ 0 0 80 -2,-0.4 2,-0.2 -3,-0.1 -4,-0.1 0.309 92.8 30.7 -53.9 14.8 57.3 58.1 72.2 73 81 A K S S- 0 0 101 -2,-1.0 -2,-0.3 -6,-0.5 2,-0.3 -0.723 70.8-119.9-148.4-162.0 55.2 55.1 71.4 74 82 A L > - 0 0 2 -2,-0.2 4,-2.7 1,-0.1 5,-0.1 -0.915 13.2-148.5-155.4 120.7 52.0 53.5 70.0 75 83 A R H > S+ 0 0 157 -2,-0.3 4,-3.8 2,-0.3 5,-0.3 0.972 101.8 52.9 -56.9 -56.4 49.6 51.3 72.1 76 84 A K H > S+ 0 0 70 1,-0.3 4,-1.6 2,-0.3 -1,-0.2 0.837 114.5 45.4 -47.2 -36.8 48.5 49.2 69.1 77 85 A L H > S+ 0 0 16 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.918 115.5 45.8 -75.1 -39.2 52.2 48.7 68.7 78 86 A E H X S+ 0 0 75 -4,-2.7 4,-0.6 1,-0.2 -2,-0.3 0.783 112.6 50.1 -69.7 -31.7 52.5 48.1 72.5 79 87 A K H X S+ 0 0 127 -4,-3.8 4,-2.7 2,-0.2 -3,-0.2 0.851 114.0 44.3 -73.3 -41.1 49.5 45.7 72.7 80 88 A I H < S+ 0 0 25 -4,-1.6 7,-0.3 -5,-0.3 -2,-0.2 0.967 109.3 54.2 -67.5 -56.9 50.8 43.5 69.7 81 89 A R H < S+ 0 0 192 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.854 115.6 42.9 -47.3 -34.4 54.5 43.4 70.9 82 90 A Q H < S+ 0 0 138 -4,-0.6 -2,-0.2 -5,-0.2 -1,-0.2 0.960 88.9 109.8 -78.9 -49.0 52.9 42.1 74.1 83 91 A D X - 0 0 66 -4,-2.7 4,-4.1 1,-0.1 5,-0.3 -0.013 55.0-157.4 -40.1 97.3 50.3 39.7 72.4 84 92 A D H > S+ 0 0 101 1,-0.2 4,-2.3 2,-0.2 -1,-0.1 0.817 90.3 48.1 -47.3 -38.3 51.4 36.1 73.0 85 93 A T H > S+ 0 0 50 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.972 115.0 44.7 -70.8 -47.3 49.5 34.6 70.1 86 94 A S H > S+ 0 0 1 2,-0.2 4,-1.8 1,-0.2 3,-0.3 0.940 113.1 51.6 -56.2 -49.5 50.9 37.2 67.8 87 95 A S H X S+ 0 0 50 -4,-4.1 4,-1.6 -7,-0.3 3,-0.2 0.929 105.7 58.2 -46.0 -55.1 54.3 36.7 69.3 88 96 A S H >X S+ 0 0 16 -4,-2.3 4,-2.2 -5,-0.3 3,-0.7 0.852 102.4 50.4 -47.2 -51.2 53.9 33.1 68.7 89 97 A I H 3X S+ 0 0 5 -4,-2.3 4,-2.2 -3,-0.3 -1,-0.3 0.919 106.9 54.5 -60.1 -41.6 53.4 33.4 65.1 90 98 A N H 3< S+ 0 0 67 -4,-1.8 -1,-0.2 -3,-0.2 4,-0.2 0.768 114.1 44.3 -55.3 -31.9 56.5 35.6 64.7 91 99 A F H X< S+ 0 0 64 -4,-1.6 3,-1.0 -3,-0.7 -1,-0.2 0.825 107.9 52.4 -76.1 -51.3 58.5 32.9 66.5 92 100 A L H >< S+ 0 0 0 -4,-2.2 3,-2.5 1,-0.3 6,-0.2 0.921 99.2 66.7 -58.8 -47.4 57.2 29.8 64.8 93 101 A T T 3< S+ 0 0 41 -4,-2.2 5,-0.3 1,-0.3 -1,-0.3 0.797 82.6 75.6 -50.0 -29.2 58.0 31.4 61.4 94 102 A R T < S+ 0 0 119 -3,-1.0 2,-0.9 -4,-0.2 -1,-0.3 0.677 74.1 98.5 -59.5 -9.6 61.8 31.2 62.3 95 103 A V S X S- 0 0 0 -3,-2.5 3,-3.2 -4,-0.2 2,-0.3 -0.725 88.5-124.0 -81.1 110.1 61.4 27.6 61.5 96 104 A S T 3 S+ 0 0 38 -2,-0.9 35,-0.4 1,-0.3 36,-0.2 -0.430 103.8 33.0 -57.3 112.1 62.6 27.2 58.1 97 105 A G T 3 S+ 0 0 32 -2,-0.3 2,-0.6 1,-0.3 -1,-0.3 -0.125 96.3 102.9 130.0 -30.6 59.6 25.6 56.5 98 106 A I < + 0 0 9 -3,-3.2 -1,-0.3 -5,-0.3 -3,-0.0 -0.709 46.1 174.3 -84.3 116.5 57.1 27.4 58.6 99 107 A G > - 0 0 29 -2,-0.6 4,-2.5 -3,-0.1 5,-0.1 -0.496 49.9 -86.0-109.9-171.9 55.5 30.3 56.9 100 108 A P H > S+ 0 0 38 0, 0.0 4,-2.9 0, 0.0 5,-0.3 0.953 125.3 54.6 -58.4 -50.2 52.6 32.5 58.2 101 109 A S H > S+ 0 0 95 1,-0.3 4,-2.3 2,-0.2 5,-0.1 0.946 114.2 40.7 -46.1 -62.3 49.9 30.1 57.1 102 110 A A H > S+ 0 0 18 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.856 110.7 58.4 -58.9 -39.7 51.4 27.3 58.9 103 111 A A H X S+ 0 0 0 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.954 108.4 44.3 -52.2 -56.3 52.3 29.4 61.9 104 112 A R H X S+ 0 0 55 -4,-2.9 4,-2.7 2,-0.2 -1,-0.2 0.906 111.9 53.9 -55.4 -50.0 48.8 30.4 62.6 105 113 A K H >X S+ 0 0 104 -4,-2.3 4,-1.8 -5,-0.3 3,-0.9 0.974 109.3 46.4 -51.9 -65.8 47.6 26.9 62.0 106 114 A F H 3<>S+ 0 0 0 -4,-2.7 5,-3.1 1,-0.3 4,-0.4 0.760 112.9 53.5 -46.3 -31.3 50.0 25.4 64.5 107 115 A V H ><5S+ 0 0 6 -4,-1.7 3,-0.9 -5,-0.3 -1,-0.3 0.901 103.9 51.5 -72.1 -42.8 48.9 28.1 66.9 108 116 A D H <<5S+ 0 0 140 -4,-2.7 -2,-0.2 -3,-0.9 -1,-0.2 0.853 109.3 55.1 -60.1 -30.9 45.4 27.4 66.6 109 117 A E T 3<5S- 0 0 100 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.542 123.6-105.6 -74.8 -17.6 46.4 23.9 67.4 110 118 A G T < 5S+ 0 0 38 -3,-0.9 2,-0.8 -4,-0.4 -3,-0.2 0.396 78.8 133.7 107.1 -12.3 48.1 25.0 70.5 111 119 A I < + 0 0 7 -5,-3.1 -1,-0.3 1,-0.2 -2,-0.2 -0.685 15.3 139.7 -78.0 109.2 51.6 24.6 69.1 112 120 A K + 0 0 69 -2,-0.8 -1,-0.2 -3,-0.1 2,-0.1 0.660 51.9 48.8-118.6 -34.5 53.4 27.8 70.2 113 121 A T S > S- 0 0 64 1,-0.1 4,-1.9 -22,-0.0 5,-0.1 -0.399 85.5-102.7-103.1 179.4 56.9 26.9 71.3 114 122 A L H > S+ 0 0 29 2,-0.2 4,-1.8 1,-0.2 -1,-0.1 0.933 123.9 50.4 -63.9 -47.5 59.9 24.9 70.0 115 123 A E H > S+ 0 0 123 2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.861 104.8 57.7 -58.3 -42.6 59.0 22.1 72.4 116 124 A D H > S+ 0 0 46 1,-0.3 4,-0.8 2,-0.2 -1,-0.2 0.940 107.1 49.5 -54.9 -48.0 55.4 22.1 71.1 117 125 A L H < S+ 0 0 1 -4,-1.9 3,-0.4 2,-0.2 -1,-0.3 0.845 109.8 49.7 -60.6 -39.1 56.9 21.5 67.8 118 126 A R H >< S+ 0 0 127 -4,-1.8 3,-2.6 1,-0.2 -2,-0.2 0.996 104.8 56.6 -61.0 -60.1 59.0 18.6 69.0 119 127 A K H 3< S+ 0 0 154 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.661 117.2 38.3 -42.1 -25.5 56.1 16.9 70.8 120 128 A N T >< + 0 0 38 -4,-0.8 3,-1.8 -3,-0.4 4,-0.5 -0.138 63.5 146.8-127.9 45.1 54.3 16.9 67.5 121 129 A E T < S+ 0 0 104 -3,-2.6 3,-0.3 1,-0.3 -1,-0.1 0.597 72.1 68.5 -50.9 -13.0 57.0 16.2 65.0 122 130 A D T 3 S+ 0 0 120 1,-0.2 -1,-0.3 -4,-0.1 -2,-0.1 0.867 88.4 58.3 -71.7 -44.5 54.1 14.4 63.2 123 131 A K S < S+ 0 0 80 -3,-1.8 2,-0.2 -6,-0.1 -1,-0.2 0.566 98.3 86.5 -63.9 -12.1 52.2 17.5 62.4 124 132 A L S S- 0 0 8 -4,-0.5 2,-0.2 -3,-0.3 3,-0.0 -0.589 73.8-132.3 -94.2 153.3 55.4 18.7 60.5 125 133 A N > - 0 0 85 -2,-0.2 4,-1.9 1,-0.1 5,-0.1 -0.548 38.1 -96.1 -96.1 168.0 56.5 18.0 57.0 126 134 A H H > S+ 0 0 116 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.887 124.6 51.9 -47.1 -54.3 60.1 16.8 56.1 127 135 A H H >> S+ 0 0 45 1,-0.3 4,-2.2 2,-0.2 3,-1.3 0.932 114.6 41.7 -40.8 -71.8 61.2 20.4 55.3 128 136 A Q H 3> S+ 0 0 13 1,-0.3 4,-3.1 2,-0.2 -1,-0.3 0.670 109.1 60.5 -47.5 -32.8 60.0 21.6 58.7 129 137 A R H 3X S+ 0 0 101 -4,-1.9 4,-2.5 2,-0.2 -1,-0.3 0.951 109.1 42.3 -63.6 -48.5 61.3 18.6 60.3 130 138 A I H < S+ 0 0 13 -4,-3.1 3,-1.0 1,-0.3 -1,-0.3 0.888 110.2 52.0 -56.9 -43.2 63.2 22.0 63.3 133 141 A K H 3< S+ 0 0 127 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.860 119.8 34.5 -64.0 -34.6 66.1 19.8 63.6 134 142 A Y T 3X S+ 0 0 17 -4,-2.9 4,-1.8 -3,-0.4 -1,-0.2 -0.108 76.9 125.4-114.2 34.3 68.6 22.5 62.6 135 143 A F H <> S+ 0 0 26 -3,-1.0 4,-1.5 2,-0.2 -1,-0.1 0.916 78.2 42.5 -55.1 -58.4 67.0 25.6 64.2 136 144 A G H >> S+ 0 0 40 -4,-0.2 3,-2.3 1,-0.2 4,-0.9 0.983 120.2 41.2 -56.1 -71.4 70.0 26.7 66.2 137 145 A D H 34 S+ 0 0 36 1,-0.3 -1,-0.2 2,-0.2 -2,-0.2 0.651 112.2 59.4 -47.1 -26.0 72.6 26.0 63.4 138 146 A F H 3< S+ 0 0 35 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.776 105.7 45.6 -76.6 -29.5 70.2 27.5 60.8 139 147 A E H << S+ 0 0 90 -3,-2.3 -2,-0.2 -4,-1.5 -1,-0.2 0.672 97.1 98.1 -85.5 -15.2 70.0 30.7 62.5 140 148 A K S < S- 0 0 112 -4,-0.9 2,-0.0 1,-0.1 -3,-0.0 -0.325 74.9-114.0 -72.5 149.5 73.9 30.9 63.0 141 149 A R - 0 0 131 -2,-0.1 40,-0.2 104,-0.0 -1,-0.1 -0.240 22.3-118.8 -77.6 169.8 76.2 32.8 60.6 142 150 A I E -A 180 0A 0 38,-3.4 38,-1.4 40,-0.1 5,-0.2 -0.852 21.3-135.3-121.0 101.0 78.7 31.2 58.3 143 151 A P E >> -A 179 0A 41 0, 0.0 4,-1.9 0, 0.0 3,-1.3 -0.230 12.4-135.8 -51.9 131.0 82.5 32.3 58.9 144 152 A R H 3> S+ 0 0 67 34,-1.1 4,-2.9 1,-0.3 5,-0.2 0.781 110.8 66.2 -54.0 -36.7 84.2 33.0 55.6 145 153 A E H 3> S+ 0 0 121 33,-0.3 4,-1.1 1,-0.2 -1,-0.3 0.904 111.1 36.2 -51.1 -44.9 87.0 30.9 57.1 146 154 A E H <> S+ 0 0 23 -3,-1.3 4,-2.9 2,-0.2 -2,-0.3 0.813 109.5 61.6 -70.5 -42.0 84.3 28.2 56.7 147 155 A M H X S+ 0 0 1 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.815 106.3 49.9 -51.3 -37.9 82.9 29.7 53.5 148 156 A L H X S+ 0 0 76 -4,-2.9 4,-2.2 2,-0.2 -1,-0.2 0.897 109.9 47.0 -68.2 -51.9 86.4 28.9 52.1 149 157 A Q H X S+ 0 0 66 -4,-1.1 4,-1.9 2,-0.2 -2,-0.2 0.909 115.4 45.8 -63.4 -41.3 86.6 25.4 53.3 150 158 A M H X S+ 0 0 4 -4,-2.9 4,-3.2 1,-0.2 -2,-0.2 0.959 111.7 50.4 -63.3 -51.0 83.2 24.6 51.9 151 159 A Q H X S+ 0 0 57 -4,-2.0 4,-2.1 -5,-0.3 -1,-0.2 0.880 108.1 58.4 -53.0 -42.0 83.8 26.2 48.7 152 160 A D H >X S+ 0 0 81 -4,-2.2 3,-1.1 2,-0.2 4,-1.1 0.974 109.5 38.3 -52.5 -71.1 86.9 24.3 48.5 153 161 A I H >X S+ 0 0 36 -4,-1.9 4,-1.6 1,-0.3 3,-1.4 0.877 112.5 58.8 -47.4 -51.7 85.4 20.9 48.7 154 162 A V H 3X S+ 0 0 3 -4,-3.2 4,-1.4 1,-0.3 -1,-0.3 0.794 104.6 48.2 -51.2 -38.4 82.5 21.8 46.6 155 163 A L H < - 0 0 46 -4,-1.9 3,-0.8 -5,-0.2 -1,-0.3 -0.992 53.4-154.7-139.2 131.2 82.9 16.3 35.2 163 171 A S T 3 S+ 0 0 81 -2,-0.4 -4,-0.1 1,-0.2 -1,-0.1 0.404 92.5 73.9 -79.3 -4.8 85.7 18.7 34.5 164 172 A E T 3 S+ 0 0 110 -6,-0.1 2,-0.3 -5,-0.1 -1,-0.2 0.151 76.2 111.7 -93.3 10.8 83.3 20.5 32.1 165 173 A Y < - 0 0 21 -3,-0.8 2,-0.5 24,-0.1 24,-0.2 -0.686 51.9-159.3 -91.5 140.9 81.4 22.0 35.1 166 174 A I E +B 188 0B 58 22,-2.3 22,-1.2 -2,-0.3 2,-0.3 -0.985 17.4 171.8-125.5 112.5 81.4 25.7 36.1 167 175 A A E -B 187 0B 19 -2,-0.5 2,-0.3 20,-0.2 20,-0.2 -0.866 7.4-178.9-121.6 156.1 80.5 26.5 39.6 168 176 A T E -B 186 0B 30 18,-0.6 18,-2.8 -2,-0.3 2,-1.3 -0.955 28.0-133.7-156.0 130.6 80.7 29.8 41.4 169 177 A V E -B 185 0B 5 -2,-0.3 16,-0.2 16,-0.2 5,-0.1 -0.729 36.5-173.5 -90.9 99.6 79.8 30.6 44.8 170 178 A C E +B 184 0B 3 -2,-1.3 14,-0.5 14,-1.0 3,-0.4 -0.038 35.4 59.4 -77.8-173.3 77.8 33.8 44.4 171 179 A G S > S- 0 0 15 90,-0.3 4,-1.3 1,-0.2 3,-0.1 -0.454 108.1 -32.8 93.0-165.7 76.4 36.2 47.1 172 180 A S T 4>S+ 0 0 33 1,-0.2 5,-2.0 2,-0.2 -1,-0.2 0.722 135.1 60.6 -63.5 -26.2 78.1 38.3 49.9 173 181 A F T >45S+ 0 0 13 -3,-0.4 3,-1.8 1,-0.2 -1,-0.2 0.902 103.9 47.0 -62.1 -52.9 80.7 35.5 50.1 174 182 A R T 345S+ 0 0 52 1,-0.3 -1,-0.2 -4,-0.3 -2,-0.2 0.795 109.7 57.9 -54.7 -38.5 81.6 36.2 46.5 175 183 A R T 3<5S- 0 0 61 -4,-1.3 -1,-0.3 90,-0.1 -2,-0.2 0.014 124.2-102.9 -79.8 12.4 81.6 39.9 47.6 176 184 A G T < 5 + 0 0 29 -3,-1.8 -3,-0.2 1,-0.2 -2,-0.1 0.037 58.7 171.4 85.4 -24.6 84.3 39.3 50.3 177 185 A A < - 0 0 24 -5,-2.0 -1,-0.2 1,-0.2 -33,-0.1 0.326 39.4-133.5 -17.2 130.6 81.8 39.4 53.3 178 186 A E S S+ 0 0 152 1,-0.1 -34,-1.1 -35,-0.1 2,-0.3 0.595 90.3 12.9 -72.0 -7.5 83.4 38.4 56.6 179 187 A S E -A 143 0A 44 -36,-0.2 2,-0.3 -35,-0.1 -1,-0.1 -0.975 65.7-165.6-162.7 156.4 80.3 36.2 57.1 180 188 A S E -A 142 0A 3 -38,-1.4 -38,-3.4 -2,-0.3 3,-0.1 -0.901 23.1-133.6-140.8 167.7 77.4 34.8 55.2 181 189 A G S S- 0 0 33 1,-0.4 65,-0.3 -2,-0.3 2,-0.3 0.721 83.6 -13.4 -98.0 -23.5 74.1 33.1 56.0 182 190 A D S S- 0 0 58 -40,-0.1 2,-0.5 63,-0.1 -1,-0.4 -0.903 73.7-105.0-171.5 142.0 74.1 30.1 53.6 183 191 A M E - c 0 247B 1 63,-1.1 65,-1.4 -2,-0.3 2,-0.5 -0.672 27.8-160.7 -87.5 133.4 76.2 29.2 50.7 184 192 A D E -Bc 170 248B 30 -14,-0.5 -14,-1.0 -2,-0.5 2,-0.6 -0.890 3.0-165.1-109.1 125.3 74.8 29.6 47.1 185 193 A V E -Bc 169 249B 2 63,-3.1 65,-1.3 -2,-0.5 2,-0.7 -0.885 7.2-152.0-112.3 122.6 76.3 27.8 44.3 186 194 A L E -Bc 168 250B 2 -18,-2.8 -18,-0.6 -2,-0.6 2,-0.3 -0.746 21.2-163.2 -91.4 118.8 75.5 28.7 40.7 187 195 A L E +B 167 0B 2 63,-2.3 2,-0.3 -2,-0.7 -20,-0.2 -0.762 18.5 152.5-112.6 154.8 75.9 25.9 38.3 188 196 A T E -B 166 0B 0 -22,-1.2 -22,-2.3 -2,-0.3 5,-0.1 -0.972 17.7-162.8-166.4 158.1 76.2 25.4 34.6 189 197 A H B > -f 253 0C 13 63,-0.8 3,-1.8 3,-0.5 65,-1.1 -0.979 30.2-125.3-145.7 143.4 77.5 23.2 32.0 190 198 A P T 3 S+ 0 0 63 0, 0.0 65,-0.1 0, 0.0 -25,-0.1 0.865 112.1 66.1 -53.3 -39.5 78.1 23.7 28.2 191 199 A S T 3 S+ 0 0 53 -27,-0.2 2,-0.3 1,-0.1 11,-0.1 0.219 100.5 59.8 -69.2 13.4 76.0 20.8 27.6 192 200 A F < + 0 0 16 -3,-1.8 62,-3.8 60,-0.1 -3,-0.5 -0.845 62.3 136.6-155.7 111.7 73.0 22.9 29.0 193 201 A T - 0 0 31 60,-0.4 3,-0.3 -2,-0.3 5,-0.2 -0.970 67.1 -61.5-153.2 155.7 71.7 26.1 27.6 194 202 A S S S+ 0 0 63 -2,-0.3 4,-0.1 1,-0.2 62,-0.0 0.342 130.0 17.8 3.6 -64.8 68.5 28.0 26.8 195 203 A E S S+ 0 0 150 2,-0.1 2,-0.9 3,-0.0 -1,-0.2 0.881 90.9 101.6 -90.0 -48.8 67.3 25.4 24.2 196 204 A S S S- 0 0 49 -3,-0.3 2,-1.2 1,-0.2 -3,-0.3 -0.093 87.8-120.1 -45.8 82.7 69.3 22.1 24.7 197 205 A T - 0 0 127 -2,-0.9 -1,-0.2 -5,-0.1 -2,-0.1 0.010 49.0 -82.4 -35.3 74.8 66.3 20.6 26.5 198 206 A K - 0 0 94 -2,-1.2 -5,-0.1 -5,-0.2 27,-0.0 0.243 21.4-144.0 58.7-176.6 67.8 19.8 29.8 199 207 A Q >> - 0 0 76 25,-0.2 3,-2.7 -7,-0.1 4,-0.6 -0.233 18.2-174.5 166.8 72.3 69.9 17.1 31.3 200 208 A P H >> S+ 0 0 45 0, 0.0 4,-2.2 0, 0.0 3,-1.2 0.841 82.8 67.6 -47.9 -38.6 68.3 17.0 34.8 201 209 A K H 3> S+ 0 0 135 1,-0.3 4,-4.0 2,-0.2 5,-0.2 0.827 82.5 75.3 -53.8 -34.7 71.0 14.6 35.6 202 210 A L H <> S+ 0 0 2 -3,-2.7 4,-0.8 1,-0.3 -1,-0.3 0.893 106.9 32.5 -44.7 -47.7 73.4 17.4 35.2 203 211 A L H S+ 0 0 1 -4,-2.3 5,-3.0 1,-0.2 6,-0.5 0.806 113.2 46.9 -55.5 -39.7 78.4 15.7 47.5 211 219 A Q H ><5S+ 0 0 79 -4,-2.2 3,-1.5 3,-0.2 -1,-0.2 0.900 103.5 60.8 -69.5 -46.4 76.3 13.2 49.4 212 220 A K H 3<5S+ 0 0 152 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.820 112.3 39.6 -51.1 -41.1 78.5 10.3 48.6 213 221 A V T 3<5S- 0 0 54 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.438 121.5-106.6 -93.7 -1.1 81.3 12.0 50.3 214 222 A H T < 5S+ 0 0 136 -3,-1.5 -3,-0.2 -4,-0.2 18,-0.2 0.412 84.6 119.2 91.7 6.5 79.2 13.4 53.2 215 223 A F S -f 189 0C 19 0, 0.0 3,-3.1 0, 0.0 -60,-0.4 -0.465 33.7-129.7 -60.1 120.7 72.1 27.1 30.8 254 262 A K G > S+ 0 0 51 -62,-3.8 3,-1.0 -65,-1.1 4,-0.3 0.775 108.5 67.0 -37.2 -36.5 75.8 27.9 30.1 255 263 A D G 3 S+ 0 0 69 1,-0.2 -1,-0.3 -63,-0.2 50,-0.2 0.240 105.2 37.1 -72.8 8.8 74.3 30.6 27.9 256 264 A Q G <> S+ 0 0 41 -3,-3.1 4,-1.2 -4,-0.1 -1,-0.2 0.376 84.8 107.5-146.0 15.5 72.9 32.5 30.9 257 265 A Y H X> S+ 0 0 3 -3,-1.0 4,-3.1 -4,-0.3 3,-1.1 0.981 73.7 44.8 -50.9 -86.2 75.5 32.2 33.6 258 266 A Y H 3> S+ 0 0 40 1,-0.3 4,-3.8 2,-0.3 -1,-0.2 0.648 111.1 54.8 -38.3 -40.7 77.4 35.4 34.1 259 267 A C H 3> S+ 0 0 7 29,-0.2 4,-3.7 2,-0.2 -1,-0.3 0.950 116.3 40.5 -57.5 -50.5 74.3 37.5 34.0 260 268 A G H < S+ 0 0 64 -4,-3.7 3,-1.3 1,-0.2 -1,-0.2 0.856 109.4 48.4 -57.9 -56.6 73.2 39.2 39.4 264 272 A F H 3< S+ 0 0 72 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.698 102.7 66.3 -64.3 -23.9 73.2 36.9 42.3 265 273 A T T 3< S+ 0 0 1 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.653 88.0 143.8 -73.3 -20.7 76.4 38.5 43.5 266 274 A G < - 0 0 4 -3,-1.3 2,-0.2 -4,-0.3 -1,-0.2 -0.227 62.3-151.3 59.9-149.0 74.6 41.7 44.1 267 275 A S > - 0 0 12 59,-0.3 4,-2.5 -3,-0.1 3,-0.2 0.694 38.5-126.5 -73.9 164.5 74.7 43.8 46.0 268 276 A D H > S+ 0 0 127 1,-0.3 4,-2.1 -2,-0.2 5,-0.1 0.841 112.3 41.2 -41.1 -44.8 71.1 44.6 45.7 269 277 A I H > S+ 0 0 74 57,-0.3 4,-2.8 2,-0.2 5,-0.3 0.861 107.9 59.2 -74.6 -38.3 72.1 48.2 45.0 270 278 A F H > S+ 0 0 0 56,-0.5 4,-3.1 55,-0.3 -2,-0.2 0.901 111.9 43.6 -56.2 -40.0 75.1 47.4 42.8 271 279 A N H X S+ 0 0 8 -4,-2.5 4,-4.7 2,-0.2 5,-0.3 0.981 112.4 47.8 -64.8 -65.2 72.7 45.6 40.5 272 280 A K H X S+ 0 0 146 -4,-2.1 4,-3.7 1,-0.2 -2,-0.2 0.912 117.9 45.2 -43.7 -54.5 69.9 48.1 40.5 273 281 A N H X S+ 0 0 94 -4,-2.8 4,-2.0 2,-0.2 -1,-0.2 0.933 114.3 45.8 -58.7 -53.1 72.4 50.8 39.9 274 282 A M H X S+ 0 0 2 -4,-3.1 4,-1.7 -5,-0.3 -2,-0.2 0.941 116.6 48.6 -55.1 -46.6 74.4 48.9 37.2 275 283 A R H X S+ 0 0 64 -4,-4.7 4,-0.9 1,-0.2 -2,-0.2 0.881 105.4 55.1 -56.4 -47.1 71.0 48.0 35.7 276 284 A A H >< S+ 0 0 52 -4,-3.7 3,-0.8 -5,-0.3 4,-0.5 0.900 109.1 50.7 -52.2 -44.9 69.8 51.6 35.8 277 285 A H H >X S+ 0 0 40 -4,-2.0 4,-3.4 1,-0.3 3,-1.1 0.819 98.7 62.2 -59.3 -43.9 72.9 52.5 33.8 278 286 A A H 3<>S+ 0 0 0 -4,-1.7 5,-3.9 1,-0.3 -1,-0.3 0.744 99.0 60.9 -56.5 -27.7 72.4 49.8 31.2 279 287 A L T <<5S+ 0 0 86 -4,-0.9 3,-0.4 -3,-0.8 -1,-0.3 0.727 109.6 38.7 -69.3 -34.6 69.1 51.8 30.4 280 288 A E T <45S+ 0 0 136 -3,-1.1 2,-0.4 -4,-0.5 -2,-0.2 0.946 109.8 59.7 -80.0 -55.5 71.0 54.9 29.5 281 289 A K T <5S- 0 0 84 -4,-3.4 -1,-0.2 1,-0.2 -2,-0.2 0.228 128.0-101.2 -57.6 13.9 73.6 52.8 27.8 282 290 A G T 5S+ 0 0 32 -3,-0.4 11,-2.5 -2,-0.4 2,-0.3 0.771 85.3 103.1 67.5 37.8 70.8 51.6 25.6 283 291 A F E < -G 292 0D 32 -5,-3.9 2,-0.4 9,-0.3 -1,-0.2 -0.820 59.2-133.9-140.4-179.4 70.3 48.3 27.3 284 292 A T E -G 291 0D 34 7,-1.4 7,-1.3 -2,-0.3 2,-0.4 -0.996 15.3-166.4-141.6 129.4 68.5 46.0 29.6 285 293 A I E +G 290 0D 19 -2,-0.4 2,-0.3 5,-0.2 5,-0.2 -0.949 15.6 159.6-120.3 142.2 69.8 43.8 32.2 286 294 A N E > -G 289 0D 41 3,-1.2 3,-3.1 -2,-0.4 2,-0.3 -0.895 60.3 -82.6-163.6 141.5 67.9 41.0 34.0 287 295 A E T 3 S+ 0 0 66 1,-0.3 -24,-0.2 -2,-0.3 -23,-0.1 0.413 126.3 30.8 -17.3 -25.2 68.9 37.9 35.9 288 296 A Y T 3 S- 0 0 132 -2,-0.3 -1,-0.3 -29,-0.2 -29,-0.2 0.588 119.9 -11.6-121.1 -18.6 69.3 36.0 32.6 289 297 A T E < -G 286 0D 21 -3,-3.1 -3,-1.2 -30,-0.1 2,-0.2 -0.652 50.5-111.0-152.0-149.2 70.4 38.3 29.9 290 298 A I E -G 285 0D 0 -2,-0.2 13,-3.4 -5,-0.2 -5,-0.2 -0.633 27.3-174.0-174.4 103.9 71.1 41.6 28.4 291 299 A R E -G 284 0D 91 -7,-1.3 -7,-1.4 11,-0.3 2,-0.3 -0.847 24.7-121.4-108.4 137.9 69.1 43.1 25.5 292 300 A P E -G 283 0D 39 0, 0.0 -9,-0.3 0, 0.0 -10,-0.1 -0.584 34.8-117.4 -77.3 129.2 69.7 46.3 23.5 293 301 A L - 0 0 54 -11,-2.5 2,-0.5 -2,-0.3 5,-0.1 -0.287 17.4-148.6 -70.3 155.1 66.9 48.7 23.6 294 302 A G > - 0 0 20 1,-0.1 3,-1.5 -11,-0.0 -1,-0.0 -0.990 21.9-125.9-122.1 128.3 65.0 49.8 20.5 295 303 A V T 3 S+ 0 0 152 -2,-0.5 4,-0.1 1,-0.3 -1,-0.1 0.752 95.2 89.3 -44.3 -35.8 63.6 53.3 20.5 296 304 A T T 3 S- 0 0 130 2,-0.2 -1,-0.3 1,-0.2 3,-0.1 0.579 124.3 -85.2 -37.3 -17.9 60.0 52.1 19.8 297 305 A G S < S+ 0 0 56 -3,-1.5 2,-0.2 1,-0.2 -1,-0.2 -0.525 104.0 16.2 140.8 -55.8 59.8 52.0 23.6 298 306 A V + 0 0 106 -5,-0.1 2,-0.3 -6,-0.0 -2,-0.2 -0.733 59.8 175.8-132.1 178.0 61.3 48.5 24.1 299 307 A A - 0 0 37 -2,-0.2 2,-0.2 -3,-0.1 -8,-0.1 -0.946 10.3-152.7-170.2 179.0 63.2 45.8 22.3 300 308 A G + 0 0 22 -2,-0.3 -16,-0.0 -7,-0.1 0, 0.0 -0.514 33.3 130.1-141.6-150.7 64.9 42.4 22.8 301 309 A E - 0 0 150 -2,-0.2 2,-0.1 -10,-0.2 -1,-0.1 0.964 53.7-124.0 86.3 67.5 67.7 40.3 21.3 302 310 A P - 0 0 64 0, 0.0 -11,-0.3 0, 0.0 -1,-0.1 -0.087 21.8-132.7 -42.7 107.2 70.0 38.9 24.0 303 311 A L - 0 0 48 -13,-3.4 2,-0.2 1,-0.1 -13,-0.1 -0.394 31.3 -98.1 -67.6 136.2 73.6 39.9 23.5 304 312 A P - 0 0 100 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.327 39.9-164.2 -62.7 126.9 76.1 37.1 23.8 305 313 A V + 0 0 26 -50,-0.2 -47,-0.2 -2,-0.2 -48,-0.2 -0.928 28.4 158.7-119.7 119.4 78.0 36.7 27.2 306 314 A D S S+ 0 0 113 -2,-0.5 2,-0.3 1,-0.3 -1,-0.1 0.485 72.8 6.1-109.9 -8.0 81.2 34.7 28.0 307 315 A S S >> S- 0 0 48 1,-0.0 3,-1.4 -50,-0.0 4,-1.0 -0.972 77.9 -93.5-170.5 163.3 82.1 36.6 31.1 308 316 A E H 3> S+ 0 0 5 -2,-0.3 4,-1.2 1,-0.3 -1,-0.0 0.650 121.5 61.7 -50.6 -24.7 81.4 39.2 33.8 309 317 A K H 3> S+ 0 0 88 2,-0.2 4,-3.8 1,-0.2 -1,-0.3 0.831 91.6 60.9 -69.9 -46.6 83.3 41.5 31.6 310 318 A D H <> S+ 0 0 44 -3,-1.4 4,-2.7 1,-0.2 -2,-0.2 0.875 106.2 47.4 -53.9 -45.7 81.0 41.3 28.4 311 319 A I H X S+ 0 0 0 -4,-1.0 4,-1.8 2,-0.2 -1,-0.2 0.971 114.6 46.8 -62.4 -51.4 78.2 42.7 30.3 312 320 A F H >X>S+ 0 0 0 -4,-1.2 3,-1.1 1,-0.2 5,-0.7 0.967 113.5 47.8 -51.6 -63.9 80.5 45.4 31.6 313 321 A D H ><5S+ 0 0 66 -4,-3.8 3,-1.2 1,-0.3 -1,-0.2 0.810 106.9 61.1 -42.0 -43.8 81.9 46.1 28.2 314 322 A Y H 3<5S+ 0 0 58 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.911 111.4 34.0 -53.8 -51.2 78.4 46.2 26.9 315 323 A I H <<5S- 0 0 0 -4,-1.8 -1,-0.3 -3,-1.1 -2,-0.2 0.260 113.7-118.7 -91.3 12.5 77.3 49.1 29.0 316 324 A Q T <<5 + 0 0 128 -3,-1.2 2,-0.2 -4,-0.5 -3,-0.2 0.922 64.1 138.5 49.6 61.4 80.8 50.7 28.7 317 325 A W < - 0 0 77 -5,-0.7 2,-0.4 -6,-0.1 -1,-0.2 -0.707 59.2 -83.4-124.1 175.0 81.6 50.7 32.4 318 326 A K - 0 0 136 -2,-0.2 2,-0.1 1,-0.1 -6,-0.0 -0.675 47.1-111.1 -81.2 127.9 84.6 49.9 34.7 319 327 A Y - 0 0 97 -2,-0.4 2,-0.6 1,-0.1 -1,-0.1 -0.411 37.0-154.3 -61.4 127.5 85.0 46.3 35.5 320 328 A R - 0 0 32 -2,-0.1 5,-0.1 5,-0.0 -1,-0.1 -0.935 12.0-127.6-107.4 122.2 84.2 46.2 39.2 321 329 A E > - 0 0 133 -2,-0.6 3,-0.5 1,-0.2 -146,-0.0 -0.320 25.8-115.6 -62.8 153.3 85.8 43.5 41.2 322 330 A P G > S+ 0 0 21 0, 0.0 3,-1.8 0, 0.0 -1,-0.2 0.832 113.9 70.5 -58.1 -30.7 83.2 41.6 43.1 323 331 A K G 3 S+ 0 0 142 1,-0.3 3,-0.2 2,-0.1 -148,-0.1 0.921 107.0 34.2 -48.5 -52.2 85.0 43.0 46.2 324 332 A D G < S+ 0 0 72 -3,-0.5 3,-0.4 1,-0.2 -1,-0.3 -0.186 85.1 105.3-100.7 38.6 83.8 46.5 45.5 325 333 A R < + 0 0 0 -3,-1.8 -55,-0.3 1,-0.2 -1,-0.2 0.061 43.6 117.4 -99.8 15.6 80.4 45.5 44.0 326 334 A S 0 0 67 -3,-0.2 -56,-0.5 1,-0.1 -59,-0.3 0.898 360.0 360.0 -54.8 -42.9 79.0 46.7 47.2 327 335 A E 0 0 144 -3,-0.4 -54,-0.2 -58,-0.2 -2,-0.1 0.578 360.0 360.0-153.3 360.0 77.0 49.5 45.5