==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 15-DEC-95 8ICA . 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) . 17891.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 227 69.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 2.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 26 8.0 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 . 2 0.6 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 . 16 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 126 38.5 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 1 2 1 1 2 2 1 0 2 1 0 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 2 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 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 0 216 0, 0.0 39,-0.1 0, 0.0 38,-0.0 0.000 360.0 360.0 360.0 -30.4 67.3 58.1 56.8 2 10 A T + 0 0 128 3,-0.1 4,-0.3 4,-0.0 0, 0.0 0.294 360.0 60.3-149.7 -25.3 67.5 59.4 60.4 3 11 A L S S+ 0 0 63 1,-0.2 42,-0.3 2,-0.1 4,-0.2 0.926 118.1 32.1 -77.2 -41.7 65.2 62.3 60.3 4 12 A N S > S+ 0 0 6 35,-0.2 4,-1.9 1,-0.1 3,-0.5 0.577 93.6 111.8 -90.6 -3.9 62.4 60.2 59.4 5 13 A G H > S+ 0 0 13 1,-0.2 4,-3.4 2,-0.2 5,-0.2 0.779 72.9 41.2 -27.0 -86.6 63.6 57.1 61.3 6 14 A G H > S+ 0 0 40 -4,-0.3 4,-3.1 1,-0.2 5,-0.3 0.823 116.7 55.3 -42.0 -40.0 61.2 56.4 64.2 7 15 A I H > S+ 0 0 8 -3,-0.5 4,-2.1 2,-0.2 -1,-0.2 0.969 112.1 37.5 -59.0 -60.4 58.4 57.2 61.9 8 16 A T H X S+ 0 0 20 -4,-1.9 4,-3.0 1,-0.2 -2,-0.2 0.872 116.9 56.6 -57.5 -43.0 59.1 54.8 59.3 9 17 A D H X S+ 0 0 100 -4,-3.4 4,-2.7 -5,-0.3 -1,-0.2 0.911 108.3 42.8 -57.9 -46.2 60.2 52.4 61.9 10 18 A M H X S+ 0 0 6 -4,-3.1 4,-2.1 -5,-0.2 -1,-0.2 0.884 114.2 55.4 -66.7 -35.9 57.0 52.4 63.8 11 19 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 -5,-0.3 -2,-0.2 0.879 109.5 44.0 -59.9 -46.7 55.3 52.3 60.4 12 20 A T H X S+ 0 0 54 -4,-3.0 4,-3.3 2,-0.2 5,-0.3 0.955 111.1 54.0 -66.1 -49.6 57.1 49.1 59.3 13 21 A E H X S+ 0 0 100 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.893 113.2 46.7 -44.9 -49.3 56.6 47.5 62.8 14 22 A L H X S+ 0 0 1 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.904 112.1 46.8 -58.0 -55.6 52.9 48.2 62.2 15 23 A A H X S+ 0 0 2 -4,-2.5 4,-2.4 2,-0.2 5,-0.3 0.924 111.4 52.6 -57.9 -50.4 52.7 46.9 58.7 16 24 A N H X S+ 0 0 85 -4,-3.3 4,-2.3 1,-0.3 -1,-0.2 0.913 106.6 52.8 -54.5 -45.3 54.6 43.8 59.6 17 25 A F H X>S+ 0 0 34 -4,-2.0 5,-1.4 -5,-0.3 4,-0.7 0.885 107.0 52.1 -61.4 -38.5 52.3 43.1 62.3 18 26 A E H <5S+ 0 0 8 -4,-1.8 6,-1.1 -3,-0.2 4,-0.3 0.981 112.6 43.2 -62.8 -53.7 49.3 43.4 60.1 19 27 A K H <5S+ 0 0 83 -4,-2.4 -1,-0.2 4,-0.2 -2,-0.2 0.842 122.2 40.4 -60.7 -32.6 50.5 41.0 57.5 20 28 A N H <5S+ 0 0 25 -4,-2.3 -3,-0.2 -5,-0.3 -2,-0.1 0.970 128.1 19.8 -79.0 -81.4 51.8 38.5 60.2 21 29 A V T <5S+ 0 0 31 -4,-0.7 2,-0.2 -5,-0.2 -3,-0.2 0.932 131.5 46.5 -56.5 -47.9 49.4 38.2 63.1 22 30 A S S + 0 0 28 -6,-1.1 4,-2.1 1,-0.2 5,-0.2 -0.505 20.3 168.1 -82.0 76.0 45.4 42.1 56.6 25 33 A I H > S+ 0 0 99 -2,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.873 73.5 49.7 -52.1 -47.0 47.3 42.4 53.4 26 34 A H H > S+ 0 0 150 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.955 114.0 40.1 -60.0 -62.1 45.8 45.9 52.6 27 35 A K H > S+ 0 0 110 2,-0.3 4,-2.2 1,-0.3 5,-0.2 0.844 116.0 56.4 -55.8 -35.5 46.5 47.7 55.8 28 36 A Y H X S+ 0 0 36 -4,-2.1 4,-0.7 1,-0.2 -1,-0.3 0.971 110.5 41.2 -58.7 -49.9 49.7 45.8 55.7 29 37 A N H X S+ 0 0 74 -4,-2.4 4,-1.6 -5,-0.2 3,-0.3 0.819 110.1 61.4 -65.2 -34.8 50.3 47.3 52.4 30 38 A A H >X S+ 0 0 32 -4,-2.8 4,-1.9 1,-0.2 3,-1.2 0.992 100.7 50.8 -53.1 -68.6 49.0 50.7 53.6 31 39 A Y H 3X S+ 0 0 12 -4,-2.2 4,-1.6 1,-0.3 -1,-0.2 0.640 110.7 55.4 -41.0 -28.4 51.6 51.1 56.3 32 40 A R H 3X S+ 0 0 129 -4,-0.7 4,-1.8 -3,-0.3 -1,-0.3 0.850 102.8 44.4 -85.0 -39.3 54.2 50.4 53.7 33 41 A K H X S+ 0 0 32 -4,-1.9 4,-1.6 -3,-0.3 3,-1.5 0.960 112.3 49.9 -78.0 -54.6 56.9 58.0 51.3 38 46 A I H 3< S+ 0 0 0 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.674 106.0 66.3 -55.5 -20.3 57.5 59.7 54.6 39 47 A A H 3< S+ 0 0 39 -4,-0.6 -1,-0.3 -5,-0.4 -35,-0.2 0.905 103.3 40.4 -66.0 -45.6 60.8 58.0 54.2 40 48 A K H << S+ 0 0 167 -3,-1.5 -2,-0.2 -4,-0.7 -1,-0.2 0.819 87.9 116.5 -72.0 -37.4 61.8 60.1 51.2 41 49 A Y < - 0 0 59 -4,-1.6 2,-0.2 1,-0.2 4,-0.1 -0.158 63.0-141.1 -47.7 118.6 60.4 63.3 52.7 42 50 A P + 0 0 88 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.069 68.3 57.0 -70.3 19.2 63.2 65.7 53.2 43 51 A H S S- 0 0 107 -2,-0.2 3,-0.1 -39,-0.0 -2,-0.0 -0.982 90.9 -82.1-160.9 150.7 62.2 67.2 56.5 44 52 A K - 0 0 116 -2,-0.3 2,-0.5 1,-0.1 -40,-0.1 -0.114 48.7-126.7 -47.6 122.0 61.4 66.6 60.0 45 53 A I - 0 0 6 -42,-0.3 -1,-0.1 1,-0.2 3,-0.1 -0.651 27.4-174.3 -78.3 129.2 57.9 65.6 60.2 46 54 A K - 0 0 138 -2,-0.5 2,-0.3 1,-0.3 -1,-0.2 0.590 55.4 -15.3-100.1 -9.6 56.2 67.8 62.7 47 55 A S > - 0 0 33 1,-0.2 4,-2.1 22,-0.0 -1,-0.3 -0.964 69.9 -91.4-177.5 169.4 52.7 66.4 63.0 48 56 A G H > S+ 0 0 0 -2,-0.3 4,-5.3 1,-0.2 5,-0.2 0.971 122.1 57.2 -59.7 -51.7 50.2 64.2 61.4 49 57 A A H > S+ 0 0 67 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.850 106.6 49.1 -44.8 -45.0 48.8 67.0 59.4 50 58 A E H >4 S+ 0 0 40 2,-0.2 3,-0.6 1,-0.2 -1,-0.2 0.935 119.9 36.8 -60.7 -49.5 52.2 67.7 57.9 51 59 A A H >< S+ 0 0 0 -4,-2.1 3,-4.0 -3,-0.2 -2,-0.2 0.912 104.8 70.6 -64.2 -51.1 52.6 64.1 57.0 52 60 A K H 3< S+ 0 0 89 -4,-5.3 -1,-0.2 1,-0.3 -2,-0.2 0.662 82.4 74.0 -39.9 -29.7 49.0 63.8 56.2 53 61 A K T << S+ 0 0 166 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.617 85.9 100.5 -62.2 -17.4 49.7 65.9 53.1 54 62 A L S X S- 0 0 33 -3,-4.0 3,-1.8 1,-0.1 2,-0.3 -0.364 84.5-101.0 -82.3 155.3 51.3 62.9 51.8 55 63 A P T 3 S+ 0 0 92 0, 0.0 -18,-0.2 0, 0.0 -17,-0.1 -0.507 110.7 14.6 -72.8 132.6 50.3 60.3 49.4 56 64 A G T 3 S+ 0 0 35 -2,-0.3 2,-1.2 1,-0.2 -22,-0.2 0.323 100.1 120.5 81.6 -1.0 49.2 57.2 51.1 57 65 A V < + 0 0 8 -3,-1.8 -1,-0.2 -6,-0.2 2,-0.1 -0.773 39.1 168.9-100.1 104.6 49.0 59.2 54.2 58 66 A G > - 0 0 24 -2,-1.2 4,-1.4 -3,-0.1 -4,-0.1 -0.122 51.3 -91.5 -93.0-164.7 45.7 59.1 55.5 59 67 A T H > S+ 0 0 73 2,-0.2 4,-1.7 3,-0.2 5,-0.1 0.739 117.9 60.9 -79.0 -36.1 44.1 60.1 58.6 60 68 A K H > S+ 0 0 137 2,-0.2 4,-0.5 1,-0.2 -1,-0.1 0.945 113.7 32.4 -59.5 -57.1 44.6 56.7 60.2 61 69 A I H >> S+ 0 0 11 1,-0.2 4,-2.4 2,-0.2 3,-2.3 0.933 115.4 59.4 -63.7 -53.4 48.3 56.6 60.0 62 70 A A H 3X S+ 0 0 6 -4,-1.4 4,-2.1 1,-0.3 -1,-0.2 0.824 102.3 55.3 -43.6 -40.6 48.6 60.4 60.5 63 71 A E H 3X S+ 0 0 128 -4,-1.7 4,-1.5 2,-0.2 -1,-0.3 0.777 106.5 49.3 -68.0 -28.8 46.9 60.0 63.7 64 72 A K H - 0 0 4 -2,-0.1 4,-1.9 1,-0.1 5,-0.1 -0.772 15.4-136.4-174.4 127.4 52.2 54.1 70.7 75 83 A R H >> S+ 0 0 161 -2,-0.2 4,-2.9 1,-0.2 3,-1.1 0.987 105.1 48.0 -59.5 -58.9 49.6 52.1 72.5 76 84 A K H 3> S+ 0 0 86 1,-0.3 4,-2.4 2,-0.2 5,-0.4 0.830 111.4 53.0 -48.8 -34.4 48.9 49.5 69.8 77 85 A L H 3> S+ 0 0 15 2,-0.2 4,-1.6 3,-0.2 -1,-0.3 0.915 113.1 44.2 -71.7 -33.1 52.7 49.1 69.5 78 86 A E H X S+ 0 0 123 -4,-2.9 4,-2.9 1,-0.2 3,-0.9 0.932 115.9 43.1 -47.5 -59.1 49.8 46.1 73.2 80 88 A I H 3< S+ 0 0 15 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.880 109.9 56.1 -54.2 -44.0 51.1 44.0 70.2 81 89 A R H 3< S+ 0 0 186 -4,-1.6 -1,-0.3 -5,-0.4 -2,-0.2 0.841 115.4 39.3 -59.1 -32.6 54.7 43.9 71.5 82 90 A Q H << S+ 0 0 136 -4,-1.6 -2,-0.2 -3,-0.9 -1,-0.2 0.897 91.0 115.7 -82.3 -46.1 53.2 42.5 74.7 83 91 A D X - 0 0 63 -4,-2.9 4,-4.0 -5,-0.2 5,-0.2 0.062 51.6-157.9 -37.6 109.0 50.6 40.2 73.0 84 92 A D H > S+ 0 0 98 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.937 91.0 48.1 -50.8 -60.2 51.2 36.6 73.5 85 93 A T H > S+ 0 0 54 1,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.911 118.3 42.7 -51.9 -46.7 49.4 35.3 70.6 86 94 A S H > S+ 0 0 1 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.901 110.1 55.4 -70.2 -36.9 51.2 37.7 68.5 87 95 A S H X S+ 0 0 49 -4,-4.0 4,-1.2 1,-0.2 -2,-0.2 0.894 107.3 53.8 -58.2 -39.9 54.6 37.2 70.1 88 96 A S H X S+ 0 0 11 -4,-2.7 4,-2.6 1,-0.2 5,-0.3 0.854 105.9 49.2 -61.0 -47.6 54.3 33.5 69.4 89 97 A I H X S+ 0 0 4 -4,-1.6 4,-1.5 -5,-0.2 -1,-0.2 0.925 106.5 56.5 -62.6 -45.1 53.6 33.9 65.8 90 98 A N H < S+ 0 0 69 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.835 114.6 40.8 -51.4 -38.3 56.6 36.2 65.4 91 99 A F H >< S+ 0 0 57 -4,-1.2 3,-2.6 2,-0.2 4,-0.3 0.862 106.9 54.5 -76.8 -56.7 58.8 33.6 66.8 92 100 A L H >< S+ 0 0 0 -4,-2.6 3,-2.4 1,-0.3 6,-0.2 0.885 97.7 70.2 -51.0 -37.1 57.6 30.2 65.3 93 101 A T T 3< S+ 0 0 42 -4,-1.5 5,-0.3 1,-0.3 -1,-0.3 0.688 81.8 74.2 -53.2 -24.6 58.1 31.8 62.0 94 102 A R T < S+ 0 0 114 -3,-2.6 -1,-0.3 2,-0.1 2,-0.2 0.661 73.4 96.5 -67.3 -20.0 61.8 31.6 62.7 95 103 A V S X S- 0 0 3 -3,-2.4 3,-2.3 -4,-0.3 2,-0.4 -0.498 93.2-106.8 -70.8 133.5 61.9 28.0 62.1 96 104 A S T 3 S+ 0 0 43 1,-0.3 35,-0.3 -2,-0.2 36,-0.2 -0.572 108.1 24.1 -69.2 125.3 62.9 27.4 58.6 97 105 A G T 3 S+ 0 0 36 -2,-0.4 2,-0.7 1,-0.2 -1,-0.3 0.249 93.5 112.0 106.2 -8.5 59.8 26.3 56.8 98 106 A I < + 0 0 7 -3,-2.3 -1,-0.2 -5,-0.3 -3,-0.0 -0.916 43.1 179.6-103.0 112.1 57.4 28.0 59.1 99 107 A G > - 0 0 32 -2,-0.7 4,-1.9 -3,-0.1 5,-0.1 -0.319 46.2 -91.0 -97.2-177.2 55.7 30.8 57.4 100 108 A P H > S+ 0 0 41 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.886 122.1 57.9 -62.8 -43.6 53.0 33.0 59.0 101 109 A S H > S+ 0 0 78 1,-0.3 4,-2.0 2,-0.2 5,-0.1 0.918 112.2 38.1 -52.6 -52.3 50.2 30.9 57.8 102 110 A A H > S+ 0 0 14 1,-0.2 4,-2.7 2,-0.2 -1,-0.3 0.861 110.0 64.4 -69.3 -34.6 51.5 27.9 59.5 103 111 A A H X S+ 0 0 0 -4,-1.9 4,-1.4 1,-0.2 -2,-0.2 0.860 105.6 43.3 -58.7 -35.3 52.5 30.0 62.4 104 112 A R H X S+ 0 0 51 -4,-2.4 4,-3.0 2,-0.2 -1,-0.2 0.956 111.2 53.7 -73.7 -45.9 49.0 30.9 63.1 105 113 A K H X S+ 0 0 100 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.871 110.0 48.5 -53.3 -41.2 47.7 27.4 62.6 106 114 A F H X>S+ 0 0 1 -4,-2.7 5,-4.0 2,-0.2 4,-0.8 0.908 111.6 49.0 -64.5 -44.9 50.2 26.1 65.1 107 115 A V H <5S+ 0 0 2 -4,-1.4 -2,-0.2 3,-0.3 -1,-0.2 0.859 108.0 55.7 -60.7 -44.2 49.4 28.7 67.7 108 116 A D H <5S+ 0 0 124 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.976 109.1 43.4 -55.6 -60.7 45.8 28.0 67.3 109 117 A E H <5S- 0 0 124 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.714 132.3-100.9 -56.6 -19.9 46.3 24.4 68.1 110 118 A G T <5S+ 0 0 31 -4,-0.8 2,-1.4 -5,-0.2 -3,-0.3 0.761 71.9 146.0 105.3 29.9 48.5 25.8 70.8 111 119 A I < + 0 0 9 -5,-4.0 -1,-0.2 1,-0.2 -3,-0.1 -0.665 14.8 144.3 -96.2 85.0 52.1 25.4 69.5 112 120 A K + 0 0 77 -2,-1.4 -1,-0.2 -5,-0.1 2,-0.2 0.924 52.8 47.3 -88.6 -43.0 53.6 28.4 71.1 113 121 A T S > S- 0 0 59 -3,-0.3 4,-2.5 1,-0.1 5,-0.1 -0.463 81.4-110.2 -99.8 169.2 57.0 27.2 71.9 114 122 A L H > S+ 0 0 32 1,-0.3 4,-1.3 2,-0.2 -1,-0.1 0.840 122.3 50.7 -59.4 -38.2 60.0 25.4 70.5 115 123 A E H > S+ 0 0 123 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.847 104.7 57.7 -70.7 -35.1 59.3 22.5 72.8 116 124 A D H > S+ 0 0 42 1,-0.3 4,-1.5 2,-0.2 -2,-0.2 0.937 104.9 52.1 -58.3 -43.7 55.7 22.6 71.6 117 125 A L H < S+ 0 0 1 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.887 107.2 53.9 -60.1 -37.6 57.1 22.1 68.3 118 126 A R H >< S+ 0 0 123 -4,-1.3 3,-2.0 1,-0.2 -2,-0.2 0.950 106.3 47.1 -61.8 -54.8 59.1 19.1 69.6 119 127 A K H 3< S+ 0 0 154 -4,-2.3 3,-0.3 1,-0.3 -1,-0.2 0.762 116.7 49.2 -59.3 -26.1 56.3 17.1 71.1 120 128 A N T >X + 0 0 36 -4,-1.5 3,-2.4 -5,-0.3 4,-0.5 0.052 65.1 135.0-105.5 30.3 54.4 17.8 68.0 121 129 A E G X4 + 0 0 101 -3,-2.0 3,-0.7 1,-0.3 -1,-0.2 0.699 67.6 65.9 -45.8 -27.4 57.1 16.8 65.5 122 130 A D G 34 S+ 0 0 118 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.679 92.6 57.4 -65.8 -31.8 54.4 14.9 63.6 123 131 A K G <4 S+ 0 0 85 -3,-2.4 2,-0.3 -6,-0.2 -1,-0.2 0.465 95.8 88.8 -79.4 -9.9 52.4 18.0 62.6 124 132 A L S << S- 0 0 5 -3,-0.7 2,-0.2 -4,-0.5 5,-0.0 -0.666 73.5-138.6 -92.0 145.1 55.5 19.2 61.0 125 133 A N > - 0 0 89 -2,-0.3 4,-1.1 -28,-0.1 5,-0.2 -0.592 38.9 -88.9 -97.7 165.8 56.5 18.4 57.4 126 134 A H H >> S+ 0 0 106 1,-0.2 4,-2.6 2,-0.2 3,-0.6 0.801 123.8 52.3 -41.3 -48.3 60.1 17.5 56.4 127 135 A H H 3> S+ 0 0 41 1,-0.3 4,-2.8 2,-0.2 -1,-0.2 0.979 114.9 40.7 -52.6 -60.7 61.2 21.1 55.8 128 136 A Q H 3> S+ 0 0 13 2,-0.2 4,-1.8 -31,-0.2 -1,-0.3 0.528 110.1 60.9 -63.1 -15.1 60.1 22.2 59.1 129 137 A R H < S+ 0 0 9 -4,-1.8 3,-1.0 1,-0.2 -1,-0.2 0.859 111.6 55.1 -60.4 -40.7 63.3 22.5 63.9 133 141 A K H 3< S+ 0 0 128 -4,-2.4 3,-0.4 1,-0.2 -2,-0.2 0.961 115.1 35.4 -61.9 -53.2 66.3 20.2 64.1 134 142 A Y T 3X S+ 0 0 17 -4,-3.0 4,-2.0 1,-0.2 5,-0.2 0.115 77.5 129.9 -91.8 26.5 68.9 22.8 63.1 135 143 A F H <> S+ 0 0 25 -3,-1.0 4,-1.2 2,-0.2 -1,-0.2 0.819 75.9 42.3 -44.2 -45.5 67.3 25.7 64.8 136 144 A G H >> S+ 0 0 44 -3,-0.4 3,-1.7 1,-0.2 4,-0.7 0.997 116.4 45.4 -67.2 -71.3 70.4 26.7 66.6 137 145 A D H 34 S+ 0 0 32 1,-0.3 109,-0.2 2,-0.2 -2,-0.2 0.657 110.0 58.7 -46.4 -20.4 72.9 26.2 63.7 138 146 A F H 3< S+ 0 0 41 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.904 100.5 51.7 -81.6 -33.2 70.5 27.9 61.4 139 147 A E H << S+ 0 0 102 -3,-1.7 2,-0.3 -4,-1.2 -1,-0.2 0.599 94.5 98.2 -73.8 -12.3 70.4 31.1 63.2 140 148 A K S < S- 0 0 102 -4,-0.7 2,-0.1 -3,-0.1 -4,-0.0 -0.603 72.9-120.6 -85.0 137.0 74.2 31.3 63.3 141 149 A R - 0 0 140 -2,-0.3 40,-0.2 1,-0.1 -1,-0.1 -0.387 27.8-115.2 -73.1 147.1 76.4 33.4 60.9 142 150 A I E -A 180 0A 0 38,-5.7 38,-2.5 -2,-0.1 5,-0.1 -0.799 22.6-133.1 -94.2 106.5 79.1 31.6 58.6 143 151 A P E >> -A 179 0A 42 0, 0.0 4,-2.2 0, 0.0 3,-1.9 -0.285 11.2-134.9 -54.9 135.0 82.8 32.5 59.3 144 152 A R H 3> S+ 0 0 64 34,-2.1 4,-3.1 1,-0.3 5,-0.3 0.898 109.1 66.3 -52.7 -45.4 84.7 33.2 56.1 145 153 A E H 34 S+ 0 0 120 33,-0.3 4,-0.3 1,-0.3 -1,-0.3 0.701 111.3 33.9 -43.4 -35.0 87.4 31.0 57.6 146 154 A E H <> S+ 0 0 28 -3,-1.9 4,-2.8 2,-0.2 -1,-0.3 0.700 110.8 62.9 -91.7 -36.7 84.8 28.2 57.2 147 155 A M H X S+ 0 0 1 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.885 104.3 50.6 -54.7 -41.8 83.3 29.7 54.0 148 156 A L H X S+ 0 0 74 -4,-3.1 4,-1.5 2,-0.2 -1,-0.2 0.789 109.2 49.3 -65.6 -40.0 86.8 29.1 52.5 149 157 A Q H > S+ 0 0 61 -4,-0.3 4,-1.8 -5,-0.3 -2,-0.2 0.928 114.7 44.9 -69.2 -42.9 86.9 25.5 53.7 150 158 A M H X S+ 0 0 2 -4,-2.8 4,-2.9 2,-0.2 5,-0.2 0.942 112.5 50.0 -61.4 -54.4 83.4 24.8 52.2 151 159 A Q H X S+ 0 0 54 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.876 106.9 58.8 -50.7 -42.7 84.1 26.5 49.0 152 160 A D H X S+ 0 0 86 -4,-1.5 4,-1.0 1,-0.2 -1,-0.2 0.946 109.0 41.4 -53.0 -55.8 87.1 24.5 48.7 153 161 A I H >X S+ 0 0 44 -4,-1.8 4,-1.8 1,-0.2 3,-0.7 0.895 109.8 55.2 -62.1 -46.9 85.4 21.3 48.9 154 162 A V H 3X S+ 0 0 2 -4,-2.9 4,-2.1 1,-0.3 5,-0.2 0.925 104.7 53.6 -55.2 -45.3 82.6 22.0 46.7 155 163 A L H 3X S+ 0 0 53 -4,-2.3 4,-1.5 1,-0.2 -1,-0.3 0.756 106.9 56.2 -60.2 -28.2 84.8 23.1 43.9 156 164 A N H + 0 0 3 14,-3.0 4,-0.6 -2,-0.9 14,-0.5 0.016 33.0 48.4 -89.9-164.2 78.1 33.9 45.2 171 179 A G H >> S- 0 0 16 93,-0.8 4,-1.3 90,-0.2 3,-0.6 -0.189 107.1 -23.0 73.9-165.6 76.8 36.4 47.6 172 180 A S H 34>S+ 0 0 31 1,-0.3 5,-1.3 2,-0.2 -1,-0.2 0.792 133.7 57.2 -48.7 -42.2 78.6 38.4 50.4 173 181 A F H >45S+ 0 0 9 -3,-0.4 3,-1.4 1,-0.2 -1,-0.3 0.932 103.7 53.1 -58.8 -45.3 81.3 35.9 50.6 174 182 A R H <<5S+ 0 0 50 -3,-0.6 2,-0.3 -4,-0.6 -1,-0.2 0.890 108.8 52.8 -50.9 -46.1 82.0 36.4 47.0 175 183 A R T 3<5S- 0 0 66 -4,-1.3 2,-0.7 147,-0.2 -1,-0.3 -0.286 128.9 -92.9 -83.3 34.0 82.2 40.1 47.9 176 184 A G T < 5 + 0 0 35 -3,-1.4 -3,-0.2 -2,-0.3 -2,-0.1 -0.115 65.8 168.5 80.9 -38.5 84.8 39.8 50.7 177 185 A A < - 0 0 25 -5,-1.3 -1,-0.2 -2,-0.7 3,-0.1 0.338 37.3-138.6 -13.8 124.8 82.2 39.5 53.6 178 186 A E S S+ 0 0 146 1,-0.2 -34,-2.1 -35,-0.1 2,-0.3 0.652 86.4 12.5 -66.1 -21.2 83.6 38.4 56.9 179 187 A S E -A 143 0A 41 -36,-0.2 2,-0.3 -35,-0.1 -1,-0.2 -0.989 68.1-156.8-156.7 147.4 80.7 36.1 57.5 180 188 A S E -A 142 0A 0 -38,-2.5 -38,-5.7 -2,-0.3 3,-0.1 -0.753 19.2-138.2-123.2 171.3 77.9 34.8 55.5 181 189 A G S S- 0 0 29 1,-0.4 65,-0.4 -2,-0.3 2,-0.3 0.811 82.6 -17.7 -93.5 -40.1 74.5 33.5 56.3 182 190 A D S S- 0 0 67 63,-0.1 2,-0.5 -40,-0.1 -1,-0.4 -0.973 74.2 -91.9-161.0 161.4 74.5 30.6 53.9 183 191 A M E - c 0 247B 0 63,-1.9 65,-2.0 -2,-0.3 2,-0.7 -0.731 27.8-166.7 -90.6 127.1 76.2 29.4 50.9 184 192 A D E - c 0 248B 26 -2,-0.5 -14,-3.0 -14,-0.5 2,-0.7 -0.856 5.6-174.7-110.1 101.1 75.1 30.1 47.3 185 193 A V E -Bc 169 249B 2 63,-2.6 65,-1.7 -2,-0.7 2,-0.3 -0.803 8.5-158.8 -95.2 116.7 76.7 28.1 44.7 186 194 A L E -Bc 168 250B 3 -18,-2.9 -18,-1.9 -2,-0.7 2,-0.4 -0.669 18.0-169.1 -87.5 148.9 75.7 29.1 41.1 187 195 A L E +Bc 167 251B 2 63,-1.5 65,-2.1 -2,-0.3 2,-0.3 -0.940 17.7 158.6-151.0 133.0 76.3 26.5 38.6 188 196 A T E -Bc 166 252B 0 -22,-1.8 -22,-1.8 -2,-0.4 5,-0.1 -0.805 14.2-160.9-136.6 178.7 76.3 25.9 35.0 189 197 A H E > - c 0 253B 13 63,-1.0 3,-1.0 3,-0.4 65,-0.9 -0.957 29.9-115.4-159.3 154.5 77.6 23.7 32.4 190 198 A P T 3 S+ 0 0 57 0, 0.0 65,-0.1 0, 0.0 -1,-0.1 0.747 109.2 59.4 -64.9 -35.3 78.3 23.8 28.7 191 199 A S T 3 S+ 0 0 53 1,-0.1 2,-0.5 63,-0.0 -3,-0.0 0.420 101.0 70.5 -77.8 4.2 75.8 21.2 27.6 192 200 A F < + 0 0 15 -3,-1.0 62,-3.1 60,-0.2 -3,-0.4 -0.972 58.8 125.2-130.3 127.2 73.1 23.3 29.1 193 201 A T - 0 0 34 -2,-0.5 5,-0.2 60,-0.3 -2,-0.0 -0.879 69.9 -53.4-157.1-177.1 71.8 26.5 27.9 194 202 A S S S+ 0 0 66 -2,-0.3 4,-0.1 1,-0.1 3,-0.0 0.783 127.9 17.8 -33.4 -60.5 68.6 28.4 26.8 195 203 A E S S+ 0 0 147 1,-0.1 3,-0.3 2,-0.1 2,-0.2 0.957 90.6 100.1 -80.2 -80.9 67.3 25.8 24.2 196 204 A S S S- 0 0 47 1,-0.2 -3,-0.2 -4,-0.0 -1,-0.1 0.289 87.7-117.3 -8.7 57.8 69.1 22.4 24.8 197 205 A T - 0 0 130 -2,-0.2 -1,-0.2 -5,-0.1 -2,-0.1 0.307 51.3 -79.7 -16.6 88.8 66.1 20.9 26.8 198 206 A K - 0 0 103 -3,-0.3 -5,-0.0 -5,-0.2 -3,-0.0 0.483 25.6-147.1 33.5-174.0 67.5 20.2 30.2 199 207 A Q > - 0 0 83 25,-0.2 3,-2.3 -7,-0.0 4,-0.3 -0.278 14.5-175.4 172.7 75.0 69.6 17.6 31.7 200 208 A P T >> S+ 0 0 52 0, 0.0 4,-1.9 0, 0.0 3,-1.5 0.800 80.9 70.1 -53.6 -35.3 68.4 17.3 35.3 201 209 A K H 3> S+ 0 0 131 1,-0.3 4,-3.7 2,-0.2 5,-0.3 0.788 83.9 74.7 -56.3 -25.6 71.1 14.8 36.0 202 210 A L H <> S+ 0 0 2 -3,-2.3 4,-0.8 2,-0.2 -1,-0.3 0.903 105.8 31.0 -52.1 -46.3 73.3 17.8 35.6 203 211 A L H <> S+ 0 0 0 -3,-1.5 4,-2.2 -4,-0.3 3,-0.3 0.942 119.8 56.3 -71.0 -51.5 72.2 19.0 39.0 204 212 A H H X S+ 0 0 42 -4,-1.9 4,-2.8 1,-0.2 5,-0.2 0.828 97.2 59.1 -45.5 -57.2 71.7 15.5 40.3 205 213 A Q H X S+ 0 0 79 -4,-3.7 4,-1.2 1,-0.2 -1,-0.2 0.893 112.5 41.3 -46.4 -52.4 75.2 14.2 39.7 206 214 A V H X S+ 0 0 2 -4,-0.8 4,-2.6 -3,-0.3 3,-0.4 0.900 110.3 52.7 -65.1 -48.5 76.7 16.8 41.9 207 215 A V H X S+ 0 0 1 -4,-2.2 4,-1.6 1,-0.3 -1,-0.2 0.910 112.3 52.6 -52.5 -39.3 74.2 16.8 44.7 208 216 A E H X S+ 0 0 130 -4,-2.8 4,-1.7 2,-0.2 -1,-0.3 0.808 107.6 47.5 -63.7 -37.1 75.0 13.2 44.7 209 217 A Q H X S+ 0 0 31 -4,-1.2 4,-1.8 -3,-0.4 3,-0.4 0.995 109.7 52.5 -69.2 -53.9 78.6 13.6 44.9 210 218 A L H <>S+ 0 0 2 -4,-2.6 5,-3.3 1,-0.3 6,-1.5 0.744 114.5 43.4 -47.5 -34.8 78.4 16.1 47.8 211 219 A Q H ><5S+ 0 0 82 -4,-1.6 3,-0.7 -5,-0.3 -1,-0.3 0.830 105.6 63.8 -77.7 -39.6 76.2 13.7 49.7 212 220 A K H 3<5S+ 0 0 149 -4,-1.7 -2,-0.2 -3,-0.4 -1,-0.2 0.881 109.5 38.3 -50.1 -50.3 78.5 10.9 48.8 213 221 A V T 3<5S- 0 0 57 -4,-1.8 -1,-0.3 -5,-0.0 -2,-0.2 0.438 120.7-106.5 -81.5 -9.4 81.4 12.4 50.6 214 222 A H T < 5S+ 0 0 139 -3,-0.7 -3,-0.2 -4,-0.3 -2,-0.1 0.814 85.9 117.8 83.2 38.2 79.2 13.7 53.6 215 223 A F S -c 189 0B 19 0, 0.0 3,-3.7 0, 0.0 -60,-0.3 -0.574 32.6-135.2 -66.2 116.4 72.1 27.8 31.3 254 262 A K G > S+ 0 0 62 -62,-3.1 3,-1.2 -65,-0.9 4,-0.3 0.824 103.6 66.3 -46.6 -36.5 75.6 28.5 30.5 255 263 A D G 3 S+ 0 0 74 -63,-0.3 -1,-0.3 1,-0.2 50,-0.3 0.638 108.4 39.6 -68.4 0.5 74.5 31.2 28.3 256 264 A Q G <> S+ 0 0 40 -3,-3.7 4,-2.0 2,-0.1 -1,-0.2 0.382 81.3 107.7-131.3 14.3 73.2 33.1 31.3 257 265 A Y H <> S+ 0 0 2 -3,-1.2 4,-3.1 -4,-0.2 3,-0.4 0.972 77.0 46.0 -50.8 -82.7 75.8 32.5 34.0 258 266 A Y H > S+ 0 0 41 1,-0.3 4,-4.4 2,-0.3 5,-0.2 0.731 114.4 47.1 -35.7 -51.9 77.5 36.0 34.3 259 267 A C H > S+ 0 0 6 29,-0.2 4,-3.5 2,-0.2 -1,-0.3 0.963 117.5 45.0 -58.0 -48.7 74.3 38.0 34.4 260 268 A G H X S+ 0 0 8 -4,-2.0 4,-2.4 -3,-0.4 -2,-0.3 0.900 118.5 42.0 -54.4 -47.5 73.1 35.5 36.9 261 269 A V H X S+ 0 0 2 -4,-3.1 4,-1.0 2,-0.2 -1,-0.2 0.850 112.4 55.3 -66.9 -39.1 76.4 35.7 38.7 262 270 A L H >X S+ 0 0 2 -4,-4.4 3,-0.7 -5,-0.3 4,-0.6 0.978 112.2 45.7 -55.2 -54.5 76.5 39.4 38.3 263 271 A Y H >< S+ 0 0 68 -4,-3.5 3,-2.4 1,-0.2 -2,-0.2 0.930 110.8 44.4 -51.6 -72.4 73.2 39.5 39.9 264 272 A F H 3< S+ 0 0 66 -4,-2.4 -93,-0.8 1,-0.3 -1,-0.2 0.461 104.3 69.6 -58.0 -9.4 73.4 37.2 43.0 265 273 A T H << S+ 0 0 0 -4,-1.0 -1,-0.3 -3,-0.7 -2,-0.2 0.687 89.7 134.5 -81.9 -23.7 76.8 38.8 43.7 266 274 A G << - 0 0 6 -3,-2.4 -1,-0.2 -4,-0.6 2,-0.2 -0.205 69.4-144.4 68.5-158.6 75.1 42.1 44.7 267 275 A S > - 0 0 8 59,-0.3 4,-2.3 -3,-0.1 -1,-0.2 0.648 37.7-126.4 -79.0 176.2 75.0 44.1 46.5 268 276 A D H > S+ 0 0 117 1,-0.2 4,-1.2 2,-0.2 -2,-0.1 0.771 114.4 38.9 -49.3 -28.2 71.3 44.7 46.3 269 277 A I H > S+ 0 0 58 57,-0.2 4,-4.0 2,-0.2 5,-0.4 0.874 107.8 57.0 -89.7 -48.0 72.3 48.3 45.6 270 278 A F H > S+ 0 0 0 55,-0.5 4,-1.8 1,-0.2 -2,-0.2 0.796 111.5 51.6 -53.0 -26.7 75.3 47.8 43.4 271 279 A N H X S+ 0 0 10 -4,-2.3 4,-4.7 2,-0.2 -1,-0.2 0.989 110.3 41.7 -67.9 -70.0 72.8 46.0 41.4 272 280 A K H X S+ 0 0 134 -4,-1.2 4,-3.5 1,-0.3 5,-0.2 0.883 119.5 48.5 -48.2 -46.9 70.1 48.5 41.2 273 281 A N H X S+ 0 0 94 -4,-4.0 4,-1.3 2,-0.2 -1,-0.3 0.916 113.2 45.2 -64.3 -42.5 72.8 51.1 40.6 274 282 A M H X S+ 0 0 2 -4,-1.8 4,-1.7 -5,-0.4 3,-0.5 0.955 115.1 50.6 -61.7 -45.7 74.3 49.0 38.0 275 283 A R H X S+ 0 0 65 -4,-4.7 4,-0.9 1,-0.3 10,-0.3 0.868 104.2 54.7 -55.4 -49.1 70.9 48.4 36.6 276 284 A A H X S+ 0 0 58 -4,-3.5 4,-0.8 1,-0.2 -1,-0.3 0.802 108.4 53.9 -60.1 -28.9 69.9 52.0 36.4 277 285 A H H >X S+ 0 0 39 -4,-1.3 4,-2.5 -3,-0.5 3,-0.9 0.934 97.0 57.2 -73.6 -47.6 73.0 52.6 34.4 278 286 A A H 3<>S+ 0 0 0 -4,-1.7 5,-3.4 1,-0.2 -1,-0.2 0.752 103.0 65.6 -53.5 -21.8 72.6 50.1 31.6 279 287 A L H ><5S+ 0 0 69 -4,-0.9 3,-0.8 3,-0.3 -1,-0.2 0.886 105.1 36.4 -64.1 -49.8 69.4 52.0 31.1 280 288 A E H <<5S+ 0 0 146 -3,-0.9 -2,-0.2 -4,-0.8 -1,-0.2 0.911 111.3 61.6 -70.1 -46.7 70.9 55.3 30.1 281 289 A K T 3<5S- 0 0 88 -4,-2.5 -1,-0.2 1,-0.1 -2,-0.2 0.229 129.5 -98.9 -66.2 14.2 73.6 53.4 28.3 282 290 A G T < 5S+ 0 0 27 -3,-0.8 11,-3.3 1,-0.2 -3,-0.3 0.803 85.1 105.5 69.1 40.4 70.7 52.0 26.1 283 291 A F < - 0 0 27 -5,-3.4 2,-0.2 9,-0.3 -1,-0.2 -0.528 57.5-133.1-131.0-164.2 70.3 48.6 27.9 284 292 A T - 0 0 32 -2,-0.2 7,-2.0 -3,-0.1 2,-0.3 -0.757 15.2-169.0-165.0 109.0 68.5 46.2 30.1 285 293 A I E +F 290 0C 20 -10,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.784 16.1 155.8-101.9 144.4 69.9 44.0 32.9 286 294 A N E > -F 289 0C 34 3,-1.6 3,-1.9 -2,-0.3 -23,-0.1 -0.933 62.0 -77.0-163.7 149.2 68.0 41.3 34.7 287 295 A E T 3 S+ 0 0 63 -2,-0.3 -23,-0.1 1,-0.3 -24,-0.1 0.559 128.8 24.3 -22.8 -23.0 68.9 38.1 36.6 288 296 A Y T 3 S+ 0 0 124 1,-0.2 2,-0.3 -29,-0.2 -1,-0.3 0.654 119.3 6.9-129.2 -14.6 69.6 36.4 33.2 289 297 A T E < -F 286 0C 25 -3,-1.9 -3,-1.6 -30,-0.1 2,-0.4 -0.952 47.1-127.0-158.4-178.6 70.4 38.8 30.4 290 298 A I E -F 285 0C 0 13,-0.4 13,-1.4 -2,-0.3 -5,-0.2 -0.924 26.5-169.9-143.2 111.5 71.2 42.1 29.0 291 299 A R - 0 0 83 -7,-2.0 2,-0.2 -2,-0.4 10,-0.1 -0.851 25.1-117.2-110.2 138.3 69.2 43.5 26.1 292 300 A P - 0 0 41 0, 0.0 2,-0.3 0, 0.0 -9,-0.3 -0.463 37.7-119.4 -68.9 137.7 69.9 46.5 24.0 293 301 A L - 0 0 57 -11,-3.3 2,-0.4 -2,-0.2 7,-0.1 -0.612 20.1-150.3 -85.1 137.8 67.2 49.1 24.3 294 302 A G > - 0 0 22 -2,-0.3 3,-1.0 1,-0.1 -12,-0.0 -0.857 17.7-129.3-107.0 138.1 65.0 50.2 21.4 295 303 A V T 3 S+ 0 0 152 -2,-0.4 4,-0.1 1,-0.2 -1,-0.1 0.831 90.6 87.1 -56.0 -38.3 63.6 53.7 21.1 296 304 A T T 3 S- 0 0 132 1,-0.2 -1,-0.2 2,-0.2 3,-0.1 0.495 126.2 -80.9 -41.5 -5.4 59.9 52.7 20.4 297 305 A G S < S+ 0 0 60 -3,-1.0 2,-0.2 1,-0.0 -1,-0.2 -0.528 107.2 12.4 135.9 -59.0 59.6 52.6 24.1 298 306 A V + 0 0 111 -5,-0.1 2,-0.3 -2,-0.0 -2,-0.2 -0.758 61.9 179.2-135.3 175.1 61.1 49.1 24.6 299 307 A A - 0 0 38 -2,-0.2 -8,-0.1 -4,-0.1 2,-0.1 -0.951 10.5-148.6-176.9 159.0 63.1 46.4 22.8 300 308 A G + 0 0 30 -2,-0.3 -16,-0.0 -7,-0.1 0, 0.0 -0.049 33.6 129.0-111.9-149.4 64.8 42.9 23.0 301 309 A E - 0 0 147 -10,-0.1 2,-0.2 1,-0.1 -1,-0.0 0.952 54.3-122.3 87.3 61.5 67.7 40.9 21.5 302 310 A P - 0 0 64 0, 0.0 -11,-0.2 0, 0.0 -1,-0.1 -0.017 23.9-138.9 -34.1 87.9 69.9 39.3 24.2 303 311 A L - 0 0 48 -13,-1.4 -13,-0.4 -2,-0.2 2,-0.2 -0.222 27.3 -98.0 -56.4 134.7 73.5 40.4 23.9 304 312 A P - 0 0 98 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.400 36.8-168.0 -65.6 119.5 76.4 37.8 24.3 305 313 A V + 0 0 19 -50,-0.3 -48,-0.1 -2,-0.2 -47,-0.1 -0.894 23.3 160.1-112.1 132.4 78.1 37.4 27.7 306 314 A D S S+ 0 0 110 1,-0.5 2,-0.3 -2,-0.4 -1,-0.1 0.441 73.4 6.0-126.8 -7.1 81.4 35.5 28.4 307 315 A S S >> S- 0 0 49 1,-0.0 4,-1.0 -50,-0.0 3,-0.8 -0.916 81.6 -95.0-173.8 153.1 82.5 37.1 31.7 308 316 A E H 3> S+ 0 0 3 -2,-0.3 4,-1.3 1,-0.3 -1,-0.0 0.734 122.9 63.9 -38.3 -35.7 81.3 39.6 34.4 309 317 A K H 3> S+ 0 0 89 2,-0.2 4,-2.1 1,-0.2 3,-0.4 0.907 90.4 58.9 -51.8 -66.2 83.4 42.0 32.2 310 318 A D H <> S+ 0 0 44 -3,-0.8 4,-3.0 1,-0.3 6,-0.2 0.829 106.6 49.9 -38.4 -49.2 81.4 41.8 29.0 311 319 A I H X S+ 0 0 0 -4,-1.0 4,-2.3 2,-0.2 -1,-0.3 0.960 111.4 49.3 -56.3 -52.5 78.4 43.1 30.9 312 320 A F H <>S+ 0 0 0 -4,-1.3 5,-1.0 -3,-0.4 3,-0.3 0.931 113.3 45.1 -48.8 -62.7 80.6 45.9 32.2 313 321 A D H ><5S+ 0 0 57 -4,-2.1 3,-1.2 3,-0.3 -1,-0.2 0.815 107.7 60.5 -48.6 -47.2 82.0 46.9 28.8 314 322 A Y H 3<5S+ 0 0 65 -4,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.944 113.8 33.8 -49.4 -56.8 78.5 46.6 27.3 315 323 A I T 3<5S- 0 0 0 -4,-2.3 -1,-0.3 -3,-0.3 -2,-0.2 0.363 117.5-124.4 -82.1 8.1 77.3 49.3 29.6 316 324 A Q T < 5 + 0 0 120 -3,-1.2 -3,-0.3 -6,-0.2 2,-0.2 0.944 60.3 138.8 47.6 67.1 80.8 50.7 29.2 317 325 A W < - 0 0 78 -5,-1.0 2,-0.5 -8,-0.2 -1,-0.1 -0.560 60.1 -82.8-123.3-173.1 81.7 50.8 32.9 318 326 A K - 0 0 136 -2,-0.2 2,-0.1 -6,-0.1 0, 0.0 -0.869 49.0-111.7 -95.8 123.5 84.7 50.1 35.0 319 327 A Y - 0 0 104 -2,-0.5 2,-0.6 1,-0.1 -10,-0.1 -0.430 37.8-153.9 -59.4 127.5 85.1 46.4 35.9 320 328 A R - 0 0 34 -2,-0.1 -1,-0.1 -11,-0.0 5,-0.1 -0.948 10.3-125.8-112.2 120.7 84.3 46.4 39.6 321 329 A E > - 0 0 122 -2,-0.6 3,-0.5 1,-0.1 4,-0.1 -0.127 24.9-113.9 -56.4 156.6 85.8 43.7 41.7 322 330 A P G > S+ 0 0 20 0, 0.0 3,-3.1 0, 0.0 -147,-0.2 0.936 116.8 66.6 -59.0 -43.8 83.4 41.8 43.7 323 331 A K G 3 S+ 0 0 145 1,-0.3 3,-0.2 -149,-0.2 -148,-0.1 0.821 107.9 39.1 -41.3 -45.8 85.1 43.3 46.8 324 332 A D G X S+ 0 0 64 -3,-0.5 3,-0.7 1,-0.2 -1,-0.3 0.178 80.3 103.5 -94.9 13.9 83.8 46.7 45.7 325 333 A R T < + 0 0 0 -3,-3.1 -55,-0.5 1,-0.2 -1,-0.2 0.308 47.9 120.6 -76.9 12.5 80.3 45.7 44.5 326 334 A S T 3 0 0 69 -3,-0.2 -59,-0.3 1,-0.2 -1,-0.2 0.749 360.0 360.0 -46.9 -35.0 79.4 47.2 47.8 327 335 A E < 0 0 152 -3,-0.7 -1,-0.2 -58,-0.2 -2,-0.1 0.263 360.0 360.0-176.1 360.0 77.0 49.8 46.3