==== 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 16-DEC-95 9ICS . COMPND 2 MOLECULE: DNA (5'-D(*CP*AP*TP*CP*TP*GP*T)-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) . 17782.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 220 67.3 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 . 25 7.6 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 . 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 . 121 37.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.5 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 1 4 1 0 0 1 2 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 . 1 1 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 . 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 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,-0.1 0.000 360.0 360.0 360.0 -6.3 67.2 58.1 57.1 2 10 A T + 0 0 119 37,-0.1 4,-0.2 0, 0.0 37,-0.0 0.086 360.0 80.1-178.5 -7.1 67.1 59.1 60.8 3 11 A L S S+ 0 0 59 1,-0.2 3,-0.1 36,-0.2 42,-0.1 0.897 113.8 17.9 -82.0 -38.5 64.9 62.1 60.5 4 12 A N S > S+ 0 0 9 35,-0.2 4,-3.3 1,-0.1 5,-0.3 0.079 90.7 126.1-119.0 25.8 61.8 60.1 60.3 5 13 A G H > S+ 0 0 23 2,-0.2 4,-2.7 1,-0.2 -1,-0.1 0.867 71.6 47.5 -47.2 -56.0 63.3 56.8 61.7 6 14 A G H > S+ 0 0 40 2,-0.2 4,-3.4 1,-0.2 5,-0.3 0.964 114.6 46.8 -53.3 -58.9 60.8 56.2 64.6 7 15 A I H > S+ 0 0 7 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.919 113.6 47.9 -50.8 -53.2 57.8 56.8 62.4 8 16 A T H X S+ 0 0 22 -4,-3.3 4,-1.5 1,-0.2 -1,-0.3 0.869 115.3 47.1 -61.5 -34.6 59.2 54.7 59.7 9 17 A D H X S+ 0 0 101 -4,-2.7 4,-2.5 -5,-0.3 -2,-0.2 0.967 110.5 46.8 -70.2 -49.9 59.9 52.0 62.3 10 18 A M H X S+ 0 0 6 -4,-3.4 4,-3.3 1,-0.3 5,-0.2 0.931 111.9 53.9 -53.4 -47.4 56.6 51.9 64.2 11 19 A L H X S+ 0 0 0 -4,-2.4 4,-3.1 -5,-0.3 -1,-0.3 0.868 107.2 52.3 -53.3 -42.3 54.9 51.9 60.8 12 20 A T H X S+ 0 0 55 -4,-1.5 4,-3.6 2,-0.2 -2,-0.2 0.955 110.6 45.4 -61.4 -50.1 57.1 48.9 60.0 13 21 A E H X S+ 0 0 78 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.905 116.0 48.6 -54.1 -46.8 56.0 47.0 63.3 14 22 A L H X S+ 0 0 0 -4,-3.3 4,-1.7 2,-0.2 -1,-0.2 0.914 113.1 46.2 -59.8 -49.4 52.5 47.9 62.6 15 23 A A H X S+ 0 0 3 -4,-3.1 4,-1.7 -5,-0.2 3,-0.4 0.977 111.9 51.9 -58.8 -55.4 52.8 46.8 59.0 16 24 A N H X S+ 0 0 86 -4,-3.6 4,-2.3 1,-0.3 5,-0.2 0.861 106.5 51.9 -48.2 -47.0 54.4 43.6 59.9 17 25 A F H X>S+ 0 0 37 -4,-2.5 4,-2.6 -5,-0.2 5,-1.2 0.918 104.0 58.3 -61.2 -42.3 51.9 42.6 62.4 18 26 A E H <5S+ 0 0 7 -4,-1.7 6,-0.8 -3,-0.4 -2,-0.2 0.964 112.2 39.6 -51.9 -55.7 49.0 43.1 60.0 19 27 A K H <5S+ 0 0 88 -4,-1.7 -1,-0.2 5,-0.2 -2,-0.2 0.943 124.3 36.8 -59.1 -53.0 50.4 40.6 57.6 20 28 A N H <5S+ 0 0 22 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.885 128.6 22.2 -69.4 -50.6 51.6 38.0 60.2 21 29 A V T <5S+ 0 0 31 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.1 0.920 133.0 28.9 -84.7 -65.9 49.0 38.0 63.0 22 30 A S S + 0 0 23 -6,-0.8 4,-4.7 1,-0.2 -5,-0.2 -0.336 10.8 162.2 -68.3 76.2 45.4 42.3 56.8 25 33 A I H > S+ 0 0 96 -2,-2.2 4,-4.1 2,-0.2 5,-0.2 0.896 77.1 49.8 -58.7 -45.0 47.3 42.4 53.6 26 34 A H H > S+ 0 0 157 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.979 118.1 39.5 -60.1 -53.4 45.6 45.6 52.5 27 35 A K H > S+ 0 0 110 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.884 116.4 52.2 -60.9 -42.9 46.4 47.2 55.8 28 36 A Y H X S+ 0 0 32 -4,-4.7 4,-1.7 1,-0.2 -1,-0.2 0.951 109.1 47.1 -59.8 -46.3 49.6 45.6 55.8 29 37 A N H X S+ 0 0 79 -4,-4.1 4,-1.7 -5,-0.2 -2,-0.2 0.906 106.5 62.8 -59.2 -40.2 50.3 47.0 52.4 30 38 A A H >X S+ 0 0 32 -4,-2.7 4,-2.1 1,-0.2 3,-0.7 0.953 101.4 48.8 -50.1 -60.4 49.0 50.3 53.7 31 39 A Y H 3X S+ 0 0 12 -4,-2.1 4,-3.0 1,-0.3 -1,-0.2 0.864 108.9 57.4 -49.8 -41.2 51.8 50.7 56.4 32 40 A R H 3X S+ 0 0 144 -4,-1.7 4,-1.9 2,-0.2 -1,-0.3 0.866 105.5 42.7 -63.9 -40.8 54.4 49.9 53.9 33 41 A K H X S+ 0 0 28 -4,-2.5 4,-1.7 -3,-0.3 3,-0.9 0.971 114.0 49.6 -75.9 -50.7 57.1 57.7 51.6 38 46 A I H 3< S+ 0 0 0 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.689 110.5 59.7 -57.8 -16.7 57.6 59.1 55.0 39 47 A A H 3< S+ 0 0 44 -4,-0.8 -1,-0.2 -5,-0.4 -2,-0.2 0.835 105.2 42.2 -76.5 -42.3 61.1 57.6 54.5 40 48 A K H << S+ 0 0 180 -4,-1.2 -2,-0.2 -3,-0.9 -1,-0.2 0.695 90.8 118.8 -77.2 -26.6 62.1 59.5 51.5 41 49 A Y < - 0 0 46 -4,-1.7 4,-0.2 1,-0.1 -37,-0.1 -0.371 58.1-147.6 -62.9 117.6 60.6 62.7 53.0 42 50 A P + 0 0 81 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 0.350 65.2 60.7 -56.8 -21.2 63.1 65.3 53.5 43 51 A H S S- 0 0 116 -39,-0.0 2,-0.8 -40,-0.0 -40,-0.0 -0.345 89.2 -89.3-111.2-163.7 61.9 67.1 56.6 44 52 A K - 0 0 120 -2,-0.1 2,-0.5 -40,-0.0 -40,-0.1 -0.888 41.9-132.7-103.9 101.1 61.2 66.5 60.2 45 53 A I - 0 0 9 -2,-0.8 -38,-0.1 1,-0.2 3,-0.1 -0.356 27.6-179.1 -57.6 109.1 57.6 65.4 60.3 46 54 A K + 0 0 154 -2,-0.5 2,-0.3 1,-0.1 -1,-0.2 0.592 57.5 1.8 -88.9 -7.8 56.3 67.6 63.1 47 55 A S > - 0 0 38 1,-0.2 4,-1.6 22,-0.0 -1,-0.1 -0.991 69.8-100.6-165.9 172.7 52.9 66.3 63.1 48 56 A G H >> S+ 0 0 0 -2,-0.3 4,-2.6 2,-0.2 3,-1.0 0.985 117.4 50.9 -64.1 -61.4 50.3 64.1 61.9 49 57 A A H 3> S+ 0 0 65 1,-0.3 4,-0.9 2,-0.2 -1,-0.2 0.790 106.6 57.5 -50.2 -29.4 48.6 66.6 59.6 50 58 A E H 34 S+ 0 0 40 1,-0.2 3,-0.4 2,-0.2 -1,-0.3 0.928 111.2 41.7 -66.6 -43.3 51.9 67.3 58.2 51 59 A A H X< S+ 0 0 0 -4,-1.6 3,-4.7 -3,-1.0 -2,-0.2 0.901 101.0 68.4 -68.3 -42.4 52.3 63.7 57.3 52 60 A K H 3< S+ 0 0 95 -4,-2.6 -1,-0.2 1,-0.4 5,-0.2 0.767 86.1 75.2 -43.8 -33.6 48.7 63.3 56.0 53 61 A K T 3< S+ 0 0 162 -4,-0.9 -1,-0.4 -3,-0.4 -2,-0.2 0.576 82.8 87.2 -57.2 -17.3 49.9 65.6 53.4 54 62 A L S X S- 0 0 33 -3,-4.7 3,-1.1 4,-0.1 2,-0.3 -0.539 88.2-108.0 -90.6 161.8 51.7 62.6 51.9 55 63 A P T 3 S+ 0 0 102 0, 0.0 3,-0.1 0, 0.0 -18,-0.1 -0.607 110.8 32.5 -78.2 142.6 50.3 60.1 49.5 56 64 A G T 3 S+ 0 0 26 -2,-0.3 2,-1.0 1,-0.2 -22,-0.3 0.153 98.1 111.6 95.2 -23.5 49.8 56.8 51.2 57 65 A V < + 0 0 10 -3,-1.1 -1,-0.2 -5,-0.2 2,-0.1 -0.773 42.3 165.6 -99.5 108.4 49.1 58.8 54.3 58 66 A G > - 0 0 28 -2,-1.0 4,-1.6 -3,-0.1 -4,-0.1 -0.136 52.1 -81.8 -96.9-166.6 45.6 58.6 55.4 59 67 A T H > S+ 0 0 91 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.858 120.5 51.8 -70.3 -42.3 43.7 59.5 58.4 60 68 A K H > S+ 0 0 130 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.925 111.2 45.4 -64.5 -47.2 44.5 56.4 60.4 61 69 A I H > S+ 0 0 10 1,-0.2 4,-2.9 2,-0.2 3,-0.3 0.947 111.0 54.4 -61.6 -47.0 48.1 56.5 60.0 62 70 A A H X S+ 0 0 7 -4,-1.6 4,-2.5 1,-0.3 -1,-0.2 0.908 104.5 55.1 -53.6 -42.7 48.1 60.2 60.8 63 71 A E H X S+ 0 0 117 -4,-2.1 4,-1.9 1,-0.2 -1,-0.3 0.904 109.7 47.2 -57.7 -40.0 46.4 59.5 64.0 64 72 A K H X S+ 0 0 38 -4,-1.7 4,-2.2 -3,-0.3 -2,-0.2 0.914 106.6 54.7 -69.5 -45.0 49.0 57.2 64.9 65 73 A I H X S+ 0 0 0 -4,-2.9 4,-3.1 2,-0.2 5,-0.2 0.900 107.8 53.5 -57.7 -38.5 51.9 59.4 64.0 66 74 A D H X S+ 0 0 69 -4,-2.5 4,-4.0 -5,-0.2 3,-0.2 0.989 108.9 44.7 -58.6 -64.0 50.4 61.9 66.2 67 75 A E H X S+ 0 0 70 -4,-1.9 4,-1.9 1,-0.3 6,-0.5 0.792 115.2 51.2 -48.9 -34.4 50.1 59.8 69.4 68 76 A F H < S+ 0 0 51 -4,-2.2 -1,-0.3 -5,-0.2 5,-0.3 0.962 114.1 40.7 -72.9 -46.4 53.4 58.5 68.7 69 77 A L H < S+ 0 0 60 -4,-3.1 -2,-0.2 -5,-0.2 -3,-0.2 0.955 113.7 55.2 -63.3 -47.1 54.9 62.0 68.4 70 78 A A H < S+ 0 0 85 -4,-4.0 2,-0.3 -5,-0.2 -1,-0.2 0.879 125.8 12.4 -48.4 -49.6 52.9 63.2 71.3 71 79 A T S < S- 0 0 65 -4,-1.9 2,-2.4 2,-0.4 -1,-0.1 -0.970 87.5-104.3-131.6 141.1 54.2 60.4 73.7 72 80 A G S S+ 0 0 72 -2,-0.3 2,-0.3 -3,-0.1 -4,-0.1 0.293 97.0 46.6 -54.2 22.4 57.2 58.0 73.2 73 81 A K - 0 0 83 -2,-2.4 -2,-0.4 -6,-0.5 2,-0.3 -0.967 67.2-130.1-157.8 175.8 54.8 55.3 72.4 74 82 A L > - 0 0 2 -2,-0.3 4,-1.9 1,-0.1 5,-0.1 -0.992 15.6-146.1-132.4 130.7 51.8 53.8 70.8 75 83 A R H > S+ 0 0 168 -2,-0.3 4,-3.3 2,-0.2 3,-0.5 0.985 102.5 46.1 -58.7 -63.1 48.9 51.9 72.6 76 84 A K H > S+ 0 0 72 1,-0.3 4,-2.2 2,-0.3 -1,-0.2 0.815 114.1 50.1 -49.3 -37.5 48.2 49.5 69.8 77 85 A L H > S+ 0 0 1 2,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.854 113.0 48.1 -70.5 -35.4 51.9 48.9 69.5 78 86 A E H X S+ 0 0 72 -4,-1.9 4,-0.5 -3,-0.5 -2,-0.3 0.879 110.3 49.2 -70.8 -40.6 51.9 48.4 73.2 79 87 A K H >X S+ 0 0 131 -4,-3.3 4,-1.7 1,-0.2 3,-0.9 0.914 111.1 50.5 -64.4 -46.0 49.0 46.0 73.2 80 88 A I H 3< S+ 0 0 21 -4,-2.2 7,-0.2 1,-0.2 -2,-0.2 0.854 104.1 58.7 -60.3 -38.7 50.6 43.9 70.3 81 89 A R H 3< S+ 0 0 128 -4,-1.5 -1,-0.2 1,-0.1 -2,-0.2 0.659 112.7 40.7 -67.1 -19.6 54.0 43.6 72.2 82 90 A Q H << S+ 0 0 138 -3,-0.9 -2,-0.2 -4,-0.5 5,-0.1 0.939 85.2 102.4 -88.2 -69.8 52.3 41.9 75.1 83 91 A D X - 0 0 73 -4,-1.7 4,-2.2 1,-0.1 3,-0.4 0.206 61.6-148.4 -22.9 108.1 49.8 39.6 73.5 84 92 A D H > S+ 0 0 99 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.847 93.0 60.3 -58.2 -34.9 51.1 36.2 73.7 85 93 A T H > S+ 0 0 43 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.939 106.0 46.4 -59.2 -43.5 49.4 35.2 70.6 86 94 A S H > S+ 0 0 5 -3,-0.4 4,-1.5 1,-0.2 3,-0.3 0.968 112.6 50.5 -61.8 -47.4 51.1 37.7 68.5 87 95 A S H >X S+ 0 0 49 -4,-2.2 4,-1.5 -7,-0.2 3,-0.6 0.927 107.2 54.3 -55.5 -48.0 54.5 36.9 70.1 88 96 A S H 3X S+ 0 0 14 -4,-2.9 4,-2.9 1,-0.3 5,-0.3 0.863 105.0 52.8 -54.3 -41.1 54.0 33.2 69.4 89 97 A I H 3X S+ 0 0 5 -4,-1.9 4,-1.0 -3,-0.3 -1,-0.3 0.805 107.9 53.0 -66.0 -30.3 53.4 33.7 65.8 90 98 A N H << S+ 0 0 68 -4,-1.5 -1,-0.2 -3,-0.6 -2,-0.2 0.816 114.6 41.5 -73.7 -26.8 56.6 35.7 65.6 91 99 A F H >< S+ 0 0 62 -4,-1.5 3,-3.1 2,-0.2 4,-0.3 0.917 108.7 52.6 -82.4 -54.8 58.5 33.0 67.1 92 100 A L H >< S+ 0 0 0 -4,-2.9 3,-2.6 1,-0.3 6,-0.3 0.900 101.8 68.1 -50.0 -38.6 57.1 29.8 65.5 93 101 A T T 3< S+ 0 0 42 -4,-1.0 -1,-0.3 -5,-0.3 4,-0.2 0.667 81.5 72.9 -56.7 -18.5 57.9 31.6 62.3 94 102 A R T < S+ 0 0 109 -3,-3.1 2,-0.7 2,-0.1 -1,-0.3 0.642 75.0 98.1 -75.1 -11.6 61.6 31.4 63.0 95 103 A V S X S- 0 0 1 -3,-2.6 3,-3.2 -4,-0.3 2,-0.2 -0.696 86.1-122.4 -81.3 120.5 61.5 27.8 62.1 96 104 A S T 3 S+ 0 0 42 -2,-0.7 35,-0.4 1,-0.3 36,-0.2 -0.450 104.7 35.3 -57.2 118.5 62.5 27.3 58.6 97 105 A G T 3 S+ 0 0 31 1,-0.3 2,-0.5 -2,-0.2 -1,-0.3 -0.039 98.8 91.5 124.3 -32.5 59.5 25.7 57.3 98 106 A I < + 0 0 8 -3,-3.2 -1,-0.3 -6,-0.3 -3,-0.0 -0.902 49.2 174.0-104.7 128.0 56.9 27.5 59.3 99 107 A G > - 0 0 27 -2,-0.5 4,-2.9 -3,-0.1 5,-0.1 -0.407 51.7 -83.2-112.7-173.4 55.5 30.6 57.8 100 108 A P H > S+ 0 0 42 0, 0.0 4,-4.2 0, 0.0 5,-0.1 0.885 125.5 59.5 -60.6 -45.4 52.6 32.8 59.2 101 109 A S H > S+ 0 0 95 1,-0.2 4,-1.6 2,-0.2 -3,-0.1 0.937 116.6 31.4 -47.7 -59.6 50.0 30.6 57.8 102 110 A A H > S+ 0 0 17 2,-0.2 4,-1.8 1,-0.2 5,-0.4 0.846 111.2 64.4 -68.5 -40.0 51.3 27.6 59.7 103 111 A A H X S+ 0 0 0 -4,-2.9 4,-1.1 1,-0.2 -2,-0.2 0.932 106.1 50.7 -52.2 -43.2 52.4 29.8 62.6 104 112 A R H >X S+ 0 0 43 -4,-4.2 4,-1.9 2,-0.2 3,-0.6 0.951 107.6 47.9 -58.0 -57.5 48.7 30.5 62.9 105 113 A K H >< S+ 0 0 99 -4,-1.6 3,-1.3 1,-0.3 4,-0.3 0.952 111.2 50.5 -45.8 -68.7 47.4 26.8 62.8 106 114 A F H >X>S+ 0 0 0 -4,-1.8 5,-3.1 1,-0.3 3,-0.8 0.747 109.5 52.1 -43.2 -32.9 49.8 25.5 65.4 107 115 A V H X<5S+ 0 0 4 -4,-1.1 3,-0.6 -3,-0.6 -1,-0.3 0.902 103.8 54.8 -76.7 -35.3 49.0 28.3 67.7 108 116 A D T <<5S+ 0 0 122 -4,-1.9 -1,-0.3 -3,-1.3 -2,-0.2 0.447 109.6 48.8 -75.4 3.6 45.5 27.7 67.5 109 117 A E T <45S- 0 0 108 -3,-0.8 -1,-0.3 -4,-0.3 -2,-0.2 0.491 126.8 -98.9-114.2 -12.6 46.1 24.2 68.5 110 118 A G T <<5S+ 0 0 35 -4,-0.8 2,-0.8 -3,-0.6 3,-0.3 0.337 79.5 132.6 112.7 -5.3 48.3 25.3 71.4 111 119 A I < + 0 0 5 -5,-3.1 -1,-0.4 1,-0.2 -2,-0.2 -0.738 17.0 138.5 -82.6 117.0 51.7 24.8 69.9 112 120 A K + 0 0 66 -2,-0.8 2,-0.3 -3,-0.1 -1,-0.2 0.437 54.3 48.9-132.4 -19.0 53.5 28.0 70.8 113 121 A T S > S- 0 0 57 -3,-0.3 4,-2.5 1,-0.1 -1,-0.1 -0.716 84.9-103.2-125.2 177.9 56.8 27.0 71.8 114 122 A L H > S+ 0 0 35 -2,-0.3 4,-2.5 2,-0.2 5,-0.1 0.863 121.7 50.0 -63.2 -41.3 59.7 25.0 70.7 115 123 A E H > S+ 0 0 128 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.957 106.8 54.2 -62.6 -47.7 58.9 22.3 73.1 116 124 A D H > S+ 0 0 44 1,-0.3 4,-2.5 2,-0.2 -2,-0.2 0.909 108.4 53.2 -47.3 -49.7 55.3 22.2 71.9 117 125 A L H < S+ 0 0 1 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.945 107.6 47.6 -53.9 -56.3 56.8 21.7 68.6 118 126 A R H >< S+ 0 0 119 -4,-2.5 3,-1.5 1,-0.3 -2,-0.2 0.895 111.6 51.0 -54.0 -45.2 58.9 18.8 69.6 119 127 A K H 3< S+ 0 0 155 -4,-3.1 3,-0.4 1,-0.3 -1,-0.3 0.875 115.1 44.2 -60.1 -38.2 56.0 17.1 71.3 120 128 A N T >< + 0 0 48 -4,-2.5 3,-1.1 -5,-0.3 4,-0.4 -0.006 67.9 136.4-101.1 38.0 54.0 17.6 68.2 121 129 A E G X + 0 0 92 -3,-1.5 3,-0.6 1,-0.3 -1,-0.2 0.657 64.7 70.1 -54.1 -15.2 56.6 16.5 65.8 122 130 A D G 3 S+ 0 0 108 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.955 91.7 53.6 -72.7 -45.9 53.9 14.6 64.1 123 131 A K G < S+ 0 0 95 -3,-1.1 2,-0.3 -6,-0.1 -1,-0.2 0.572 96.3 88.1 -66.3 -0.2 52.0 17.6 62.8 124 132 A L S < S- 0 0 5 -3,-0.6 2,-0.1 -4,-0.4 -26,-0.0 -0.726 71.4-132.4 -99.0 151.4 55.1 19.0 61.2 125 133 A N > - 0 0 75 -2,-0.3 4,-1.8 -28,-0.1 5,-0.2 -0.296 35.4 -87.7 -89.5-179.3 56.3 18.2 57.7 126 134 A H H > S+ 0 0 107 2,-0.2 4,-2.2 1,-0.2 3,-0.2 0.895 124.1 45.1 -52.7 -55.0 59.7 17.2 56.6 127 135 A H H >> S+ 0 0 43 1,-0.3 4,-3.0 2,-0.2 3,-0.6 0.981 114.4 50.1 -56.9 -56.4 61.1 20.6 56.0 128 136 A Q H 3> S+ 0 0 11 1,-0.3 4,-2.2 -31,-0.2 -1,-0.3 0.740 108.3 55.6 -53.2 -26.4 59.8 21.9 59.3 129 137 A R H 3X S+ 0 0 97 -4,-1.8 4,-2.5 -3,-0.2 -1,-0.3 0.922 107.8 45.4 -73.8 -42.1 61.2 19.0 60.9 130 138 A I H < S+ 0 0 12 -4,-2.2 3,-1.2 -5,-0.2 -1,-0.3 0.906 107.7 53.8 -65.6 -40.4 63.2 22.2 64.1 133 141 A K H 3< S+ 0 0 137 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.863 120.9 32.4 -61.7 -37.0 66.1 19.8 64.4 134 142 A Y T 3X S+ 0 0 18 -4,-2.4 4,-2.8 -5,-0.2 -1,-0.3 -0.070 76.1 128.7-112.2 32.7 68.5 22.5 63.5 135 143 A F H <> S+ 0 0 24 -3,-1.2 4,-0.8 2,-0.2 -1,-0.2 0.914 79.7 43.0 -50.9 -52.6 66.8 25.6 65.0 136 144 A G H >> S+ 0 0 40 -4,-0.3 3,-2.5 1,-0.2 4,-0.7 0.985 115.7 44.4 -56.6 -70.4 69.8 26.6 66.7 137 145 A D H >4 S+ 0 0 32 1,-0.3 3,-0.9 2,-0.2 -1,-0.2 0.798 106.6 67.3 -45.9 -35.4 72.4 25.9 64.0 138 146 A F H 3< S+ 0 0 41 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.776 101.5 44.3 -58.6 -29.1 70.0 27.6 61.7 139 147 A E H << S+ 0 0 98 -3,-2.5 -1,-0.3 -4,-0.8 2,-0.3 0.524 88.3 101.0 -91.7 -14.0 70.4 30.9 63.3 140 148 A K S << S- 0 0 106 -3,-0.9 2,-0.0 -4,-0.7 0, 0.0 -0.579 73.4-126.4 -74.1 135.2 74.2 30.9 63.6 141 149 A R - 0 0 148 -2,-0.3 40,-0.2 1,-0.1 -1,-0.1 -0.316 25.2-105.8 -76.2 167.2 75.8 33.0 60.9 142 150 A I E -A 180 0A 1 38,-5.3 38,-1.9 40,-0.1 2,-0.2 -0.836 27.8-135.5 -99.5 109.2 78.6 31.4 58.7 143 151 A P E >> -A 179 0A 40 0, 0.0 3,-4.0 0, 0.0 4,-1.2 -0.475 19.4-124.5 -64.1 125.7 82.1 32.6 59.6 144 152 A R H 3> S+ 0 0 67 34,-4.4 4,-1.6 1,-0.3 35,-0.1 0.682 109.6 63.9 -39.4 -33.5 84.0 33.4 56.4 145 153 A E H 3> S+ 0 0 123 33,-0.3 4,-0.6 2,-0.2 -1,-0.3 0.663 104.9 46.8 -67.1 -20.5 86.7 31.1 57.4 146 154 A E H <> S+ 0 0 25 -3,-4.0 4,-3.0 2,-0.2 3,-0.4 0.849 103.3 60.2 -84.5 -44.4 84.2 28.2 57.2 147 155 A M H X S+ 0 0 1 -4,-1.2 4,-4.5 1,-0.3 5,-0.5 0.886 100.7 57.2 -47.9 -48.1 82.8 29.2 54.0 148 156 A L H X S+ 0 0 73 -4,-1.6 4,-1.7 2,-0.2 -1,-0.3 0.863 108.6 45.7 -55.7 -42.8 86.3 28.8 52.5 149 157 A Q H X S+ 0 0 64 -4,-0.6 4,-1.3 -3,-0.4 -2,-0.2 0.962 116.2 45.9 -66.7 -47.1 86.4 25.2 53.7 150 158 A M H >X S+ 0 0 3 -4,-3.0 4,-2.4 2,-0.3 3,-1.0 0.945 115.3 44.9 -53.5 -56.6 82.9 24.6 52.4 151 159 A Q H 3X S+ 0 0 59 -4,-4.5 4,-1.8 1,-0.3 -1,-0.2 0.865 108.6 60.5 -55.7 -37.5 83.6 26.3 49.0 152 160 A D H 3< S+ 0 0 84 -4,-1.7 4,-0.5 -5,-0.5 -1,-0.3 0.849 109.4 43.3 -60.7 -31.1 86.7 24.4 49.1 153 161 A I H XX S+ 0 0 36 -4,-1.3 4,-2.1 -3,-1.0 3,-1.6 0.985 110.1 46.5 -80.5 -56.9 84.6 21.3 49.2 154 162 A V H 3X S+ 0 0 1 -4,-2.4 4,-3.0 1,-0.3 5,-0.2 0.903 110.3 57.6 -47.9 -48.7 81.9 21.7 46.8 155 163 A L H 3X S+ 0 0 56 -4,-1.8 4,-0.8 -5,-0.2 -1,-0.3 0.671 107.2 47.0 -58.2 -26.9 84.3 23.0 44.2 156 164 A N H <> S+ 0 0 87 -3,-1.6 4,-2.8 -4,-0.5 -1,-0.2 0.879 115.2 41.9 -86.6 -43.3 86.5 19.8 44.3 157 165 A E H X S+ 0 0 22 -4,-2.1 4,-2.1 2,-0.2 5,-0.2 0.902 111.1 56.4 -69.8 -36.1 83.8 17.3 44.1 158 166 A V H X S+ 0 0 5 -4,-3.0 4,-1.9 -5,-0.3 7,-0.2 0.931 110.7 48.1 -57.0 -41.7 82.0 19.3 41.4 159 167 A K H < S+ 0 0 133 -4,-0.8 -2,-0.2 -5,-0.2 -1,-0.2 0.937 107.0 53.8 -62.0 -52.9 85.2 19.1 39.5 160 168 A K H < S+ 0 0 128 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.871 109.3 48.7 -52.9 -41.4 85.7 15.4 40.0 161 169 A V H < S+ 0 0 48 -4,-2.1 2,-0.4 1,-0.3 -1,-0.2 0.877 131.7 0.6 -69.1 -39.4 82.2 14.6 38.7 162 170 A D >< - 0 0 54 -4,-1.9 3,-0.8 -5,-0.2 -1,-0.3 -0.973 51.9-152.6-153.3 136.1 82.6 16.7 35.6 163 171 A S T 3 S+ 0 0 83 -2,-0.4 -1,-0.1 1,-0.2 -3,-0.1 0.722 99.4 58.7 -77.2 -20.9 85.5 18.8 34.4 164 172 A E T 3 S+ 0 0 112 -3,-0.1 -1,-0.2 -5,-0.1 27,-0.1 0.350 77.3 112.5 -88.0 1.5 83.0 21.0 32.6 165 173 A Y < - 0 0 18 -3,-0.8 2,-0.4 -7,-0.2 24,-0.2 -0.420 50.9-157.9 -72.5 159.4 81.0 22.0 35.6 166 174 A I E -B 188 0B 48 22,-1.5 22,-1.6 2,-0.0 2,-0.4 -0.904 13.8-179.6-143.0 106.5 81.3 25.7 36.6 167 175 A A E -B 187 0B 20 -2,-0.4 2,-0.4 20,-0.2 20,-0.2 -0.846 5.8-176.9-112.4 146.9 80.4 26.5 40.0 168 176 A T E -B 186 0B 35 18,-1.3 18,-3.2 -2,-0.4 2,-1.0 -0.994 21.5-141.5-144.1 131.8 80.3 29.8 41.7 169 177 A V E +B 185 0B 9 -2,-0.4 16,-0.2 16,-0.2 -2,-0.0 -0.794 32.5 176.1 -96.2 104.4 79.6 30.7 45.3 170 178 A C + 0 0 1 14,-1.5 3,-0.4 -2,-1.0 4,-0.4 0.147 31.5 73.9 -84.6-149.9 77.7 33.8 45.1 171 179 A G S > S- 0 0 14 1,-0.2 3,-0.8 2,-0.2 4,-0.5 -0.206 107.3 -39.6 76.9-169.7 76.2 35.8 47.9 172 180 A S T 3 S+ 0 0 22 1,-0.3 -1,-0.2 2,-0.2 4,-0.2 0.619 133.5 67.3 -66.4 -18.3 78.0 37.9 50.5 173 181 A F T > S+ 0 0 13 -3,-0.4 3,-0.7 1,-0.2 -1,-0.3 0.905 103.8 43.1 -64.3 -41.9 80.7 35.3 50.6 174 182 A R T < S+ 0 0 52 -3,-0.8 -2,-0.2 -4,-0.4 -1,-0.2 0.539 110.1 61.8 -72.5 -25.4 81.5 36.4 47.1 175 183 A R T 3 S- 0 0 58 -4,-0.5 2,-0.7 -5,-0.1 -1,-0.2 0.283 120.0 -99.2 -93.9 9.3 81.1 40.0 48.2 176 184 A G < + 0 0 31 -3,-0.7 147,-0.1 1,-0.3 -4,-0.1 -0.717 67.7 157.7 110.5 -72.3 83.8 40.1 50.8 177 185 A A - 0 0 36 -2,-0.7 -1,-0.3 146,-0.1 3,-0.1 0.735 43.6-137.8 13.5 126.8 81.5 39.6 53.8 178 186 A E S S+ 0 0 146 1,-0.2 -34,-4.4 -35,-0.1 2,-0.3 0.738 87.6 7.7 -73.8 -24.7 83.1 38.2 57.0 179 187 A S E -A 143 0A 37 -36,-0.3 2,-0.3 -35,-0.1 -1,-0.2 -0.972 68.4-167.0-151.3 157.1 80.2 35.9 57.7 180 188 A S E -A 142 0A 0 -38,-1.9 -38,-5.3 -2,-0.3 3,-0.1 -0.805 22.2-131.9-138.4 176.5 77.2 35.0 55.7 181 189 A G S S+ 0 0 30 1,-0.3 65,-0.4 -2,-0.3 2,-0.3 0.739 82.7 12.5-105.4 -27.3 74.0 33.2 56.5 182 190 A D S S- 0 0 78 63,-0.1 2,-0.5 -40,-0.1 -1,-0.3 -0.931 70.5-120.1-142.9 159.6 73.6 30.5 53.8 183 191 A M E - c 0 247B 3 63,-1.6 65,-2.4 -2,-0.3 2,-0.6 -0.940 27.8-168.3-104.8 118.0 75.9 29.1 51.0 184 192 A D E - c 0 248B 20 -2,-0.5 -14,-1.5 -14,-0.3 2,-0.5 -0.923 1.8-164.1-110.1 122.8 74.5 29.6 47.4 185 193 A V E -Bc 169 249B 1 63,-3.1 65,-2.1 -2,-0.6 2,-0.5 -0.828 7.3-149.7-105.5 137.1 76.1 27.8 44.7 186 194 A L E -Bc 168 250B 0 -18,-3.2 -18,-1.3 -2,-0.5 2,-0.5 -0.824 20.6-168.7 -97.0 131.3 75.6 28.8 41.0 187 195 A L E +Bc 167 251B 2 63,-2.9 65,-4.1 -2,-0.5 2,-0.3 -0.955 17.0 149.3-133.3 136.8 75.8 25.9 38.6 188 196 A T E -Bc 166 252B 0 -22,-1.6 -22,-1.5 -2,-0.5 5,-0.1 -0.882 19.5-160.8-144.7 174.3 76.0 25.6 34.9 189 197 A H E > - c 0 253B 13 63,-0.5 3,-0.8 3,-0.4 65,-0.6 -0.924 32.5-118.4-160.4 139.9 77.5 23.3 32.3 190 198 A P T 3 S+ 0 0 62 0, 0.0 -25,-0.1 0, 0.0 65,-0.0 0.658 113.8 63.6 -53.3 -23.6 78.2 23.9 28.6 191 199 A S T 3 S+ 0 0 63 -27,-0.1 2,-0.3 1,-0.1 11,-0.1 -0.175 93.4 69.8 -98.3 39.1 75.8 21.3 27.9 192 200 A F < + 0 0 11 -3,-0.8 62,-5.1 60,-0.1 63,-0.4 -0.838 63.2 142.1-159.4 114.0 72.8 23.1 29.4 193 201 A T - 0 0 37 60,-0.3 5,-0.2 -2,-0.3 -5,-0.0 -0.998 59.1 -70.9-162.6 164.7 71.1 26.1 28.0 194 202 A S S S+ 0 0 71 -2,-0.3 -1,-0.1 1,-0.2 0, 0.0 0.482 128.6 14.8 -4.5 -65.2 68.2 28.4 27.0 195 203 A E S S+ 0 0 160 2,-0.1 -1,-0.2 3,-0.0 3,-0.2 0.948 98.3 104.5 -83.3 -68.2 67.0 26.1 24.3 196 204 A S S S- 0 0 42 1,-0.2 2,-1.4 3,-0.0 -3,-0.1 0.301 81.0-112.1 -20.0 127.5 68.8 22.7 25.0 197 205 A T - 0 0 131 1,-0.1 -1,-0.2 -5,-0.1 -3,-0.1 -0.592 51.1 -81.5 -88.3 101.5 66.3 20.5 26.4 198 206 A K - 0 0 97 -2,-1.4 -1,-0.1 -5,-0.2 -5,-0.0 0.535 27.8-160.7 39.2 175.1 67.1 19.8 30.0 199 207 A Q > + 0 0 78 25,-0.2 4,-0.6 -3,-0.1 3,-0.5 -0.309 9.1 178.5 168.4 85.8 69.4 17.4 31.7 200 208 A P H > S+ 0 0 47 0, 0.0 4,-2.9 0, 0.0 3,-0.5 0.784 78.6 70.9 -68.9 -31.1 68.3 17.1 35.3 201 209 A K H > S+ 0 0 114 1,-0.3 4,-4.1 2,-0.2 5,-0.4 0.872 86.2 69.9 -52.5 -40.3 71.1 14.6 35.9 202 210 A L H > S+ 0 0 4 -3,-0.5 4,-0.8 1,-0.2 -1,-0.3 0.908 109.8 31.0 -44.5 -56.6 73.3 17.7 35.6 203 211 A L H X S+ 0 0 0 -4,-0.6 4,-1.7 -3,-0.5 3,-0.3 0.937 120.8 52.3 -72.3 -42.8 71.9 18.9 38.9 204 212 A H H X S+ 0 0 38 -4,-2.9 4,-2.1 1,-0.2 5,-0.2 0.920 100.0 59.0 -60.6 -47.4 71.3 15.5 40.5 205 213 A Q H X S+ 0 0 70 -4,-4.1 4,-1.7 1,-0.2 -1,-0.2 0.857 108.2 45.6 -52.7 -40.4 74.7 13.9 40.0 206 214 A V H X S+ 0 0 1 -4,-0.8 4,-2.9 -5,-0.4 5,-0.3 0.939 108.4 55.7 -68.8 -45.0 76.5 16.6 41.9 207 215 A V H X S+ 0 0 0 -4,-1.7 4,-1.9 1,-0.3 5,-0.2 0.895 108.9 49.5 -50.9 -42.1 74.0 16.5 44.7 208 216 A E H X S+ 0 0 119 -4,-2.1 4,-2.1 2,-0.2 -1,-0.3 0.949 107.2 53.3 -62.1 -50.3 74.6 13.0 45.1 209 217 A Q H X S+ 0 0 31 -4,-1.7 4,-2.6 1,-0.2 -2,-0.2 0.934 106.8 53.6 -51.8 -49.0 78.4 13.5 45.1 210 218 A L H <>S+ 0 0 0 -4,-2.9 5,-3.1 1,-0.3 6,-1.1 0.881 113.4 40.3 -57.7 -41.7 78.0 15.9 47.9 211 219 A Q H ><5S+ 0 0 72 -4,-1.9 3,-0.6 -5,-0.3 -1,-0.3 0.728 106.9 69.2 -80.4 -16.1 76.1 13.6 50.0 212 220 A K H 3<5S+ 0 0 143 -4,-2.1 -2,-0.2 1,-0.3 -3,-0.2 0.996 108.4 33.6 -62.5 -57.3 78.4 10.9 48.8 213 221 A V T 3<5S- 0 0 56 -4,-2.6 -1,-0.3 -5,-0.1 -2,-0.2 0.347 122.0-109.5 -80.3 11.9 81.2 12.3 50.7 214 222 A H T < 5S+ 0 0 147 -3,-0.6 -3,-0.2 -5,-0.2 18,-0.2 0.764 82.8 120.8 71.5 32.4 78.9 13.5 53.5 215 223 A F < + 0 0 5 -5,-3.1 17,-2.1 -6,-0.2 2,-0.6 0.804 68.6 58.3 -94.0 -28.2 78.9 17.1 53.0 216 224 A I E +D 231 0B 4 -6,-1.1 15,-0.3 15,-0.2 -1,-0.2 -0.884 60.6 174.7-102.8 127.8 75.2 17.3 52.5 217 225 A T E + 0 0 49 13,-3.1 2,-0.3 -2,-0.6 14,-0.2 0.777 58.1 13.2-101.9 -34.0 73.2 15.9 55.2 218 226 A D E -D 230 0B 26 12,-0.9 12,-1.5 -88,-0.0 2,-0.4 -0.860 61.8-129.8-138.3 171.2 69.5 16.6 54.5 219 227 A T E +D 229 0B 35 -2,-0.3 10,-0.3 10,-0.2 3,-0.2 -0.996 19.7 175.2-127.1 120.3 67.4 17.6 51.6 220 228 A L E S- 0 0 17 8,-3.6 2,-0.3 -2,-0.4 9,-0.2 0.880 78.4 -11.2 -87.7 -50.8 64.9 20.4 52.1 221 229 A S E -D 228 0B 53 7,-2.4 7,-3.8 -94,-0.1 2,-0.4 -0.973 60.0-168.9-153.3 136.4 63.9 20.4 48.6 222 230 A K E +D 227 0B 90 -2,-0.3 5,-0.2 5,-0.2 2,-0.1 -0.915 19.2 155.8-130.4 109.3 65.1 18.8 45.4 223 231 A G - 0 0 33 3,-2.8 -2,-0.0 -2,-0.4 0, 0.0 -0.371 58.4 -84.9-113.9-166.9 63.9 19.8 42.0 224 232 A E S S+ 0 0 98 1,-0.1 -21,-0.3 -2,-0.1 -25,-0.2 0.617 123.5 10.0 -80.7 -5.1 65.3 19.6 38.6 225 233 A T S S+ 0 0 50 1,-0.3 26,-2.9 -22,-0.1 2,-0.5 0.574 122.2 57.5-140.8 -21.7 67.1 22.7 38.9 226 234 A K E - E 0 250B 94 24,-0.2 -3,-2.8 2,-0.0 2,-0.4 -0.971 53.9-175.7-124.9 130.8 67.0 23.9 42.4 227 235 A F E -DE 222 249B 0 22,-2.8 22,-2.7 -2,-0.5 2,-0.5 -0.980 5.4-169.2-123.5 136.3 68.1 22.1 45.4 228 236 A M E +DE 221 248B 35 -7,-3.8 -8,-3.6 -2,-0.4 -7,-2.4 -0.969 29.2 143.2-123.5 109.4 67.7 23.2 49.0 229 237 A G E -DE 219 247B 0 18,-3.2 18,-1.9 -2,-0.5 2,-0.3 -0.515 44.8-107.3-130.7-160.3 69.7 21.2 51.6 230 238 A V E -DE 218 246B 0 -12,-1.5 -13,-3.1 16,-0.2 -12,-0.9 -0.979 35.2-178.5-132.1 140.3 71.7 21.1 54.8 231 239 A C E -DE 216 245B 0 14,-2.8 14,-3.7 -2,-0.3 2,-0.3 -0.952 11.5-162.1-143.9 168.6 75.4 20.5 55.0 232 240 A Q - 0 0 23 -17,-2.1 12,-0.1 -2,-0.3 3,-0.1 -0.945 22.9-124.0-159.7 134.3 78.2 20.2 57.3 233 241 A L - 0 0 5 10,-0.4 9,-0.8 -2,-0.3 3,-0.1 -0.622 50.7 -99.3 -76.9 121.5 81.9 20.4 57.4 234 242 A P - 0 0 77 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.003 36.6-113.2 -41.3 130.2 83.3 17.2 58.7 235 243 A S - 0 0 28 1,-0.1 3,-0.2 7,-0.1 6,-0.2 -0.672 30.9-140.8 -77.0 132.9 84.1 17.4 62.2 236 244 A K S S- 0 0 101 4,-0.4 2,-0.7 -2,-0.4 -1,-0.1 0.976 71.2 -13.8 -57.1-105.2 87.9 17.1 62.5 237 245 A N S S- 0 0 145 3,-0.1 -1,-0.2 4,-0.0 3,-0.1 -0.819 102.2 -88.6-114.9 88.1 89.3 15.1 65.4 238 246 A D S S+ 0 0 110 -2,-0.7 -3,-0.0 -3,-0.2 -1,-0.0 0.508 104.3 76.9 -2.5 103.0 86.2 14.8 67.6 239 247 A E S S+ 0 0 168 0, 0.0 -1,-0.2 0, 0.0 2,-0.2 -0.030 97.5 39.6 177.3 -35.8 85.7 17.6 70.1 240 248 A K + 0 0 139 -3,-0.1 -4,-0.4 2,-0.0 -3,-0.1 -0.568 65.5 177.1-138.7 77.4 84.3 20.3 67.9 241 249 A E - 0 0 110 -2,-0.2 -6,-0.0 -6,-0.2 -4,-0.0 -0.300 34.9-108.6 -68.1 153.6 81.8 19.2 65.2 242 250 A Y - 0 0 38 -9,-0.8 -1,-0.1 1,-0.1 -7,-0.1 -0.537 28.1 -99.1 -93.3 161.8 80.3 22.1 63.1 243 251 A P - 0 0 21 0, 0.0 2,-0.4 0, 0.0 -10,-0.4 -0.233 46.1 -98.2 -64.6 161.5 76.9 23.5 63.1 244 252 A H - 0 0 24 -12,-0.1 2,-0.4 -110,-0.1 -12,-0.2 -0.711 45.1-151.2 -84.1 132.0 74.5 22.4 60.4 245 253 A R E - E 0 231B 15 -14,-3.7 -14,-2.8 -2,-0.4 2,-0.1 -0.897 11.7-122.3-119.0 141.8 74.4 24.8 57.5 246 254 A R E + E 0 230B 38 -2,-0.4 -63,-1.6 -65,-0.4 2,-0.4 -0.393 35.5 179.7 -67.5 139.8 71.8 25.8 54.9 247 255 A I E -cE 183 229B 0 -18,-1.9 -18,-3.2 -65,-0.2 2,-0.4 -0.975 15.6-165.9-152.7 138.0 72.8 25.4 51.4 248 256 A D E -cE 184 228B 24 -65,-2.4 -63,-3.1 -2,-0.4 2,-0.4 -0.947 3.3-168.7-124.5 142.0 71.2 26.0 48.0 249 257 A I E -cE 185 227B 3 -22,-2.7 -22,-2.8 -2,-0.4 2,-0.4 -0.999 6.6-167.3-132.9 127.3 72.4 24.8 44.7 250 258 A R E -cE 186 226B 36 -65,-2.1 -63,-2.9 -2,-0.4 2,-0.4 -0.965 14.9-144.0-128.4 130.7 71.1 25.9 41.4 251 259 A L E -c 187 0B 6 -26,-2.9 -63,-0.2 -2,-0.4 -48,-0.0 -0.696 25.5-176.7 -84.1 129.4 71.4 24.7 37.8 252 260 A I E -c 188 0B 26 -65,-4.1 -63,-0.5 -2,-0.4 5,-0.1 -0.991 33.1-105.0-133.9 141.6 71.6 27.4 35.2 253 261 A P E > -c 189 0B 20 0, 0.0 3,-1.9 0, 0.0 -60,-0.3 -0.291 35.1-122.1 -54.0 137.2 71.8 27.3 31.4 254 262 A K G > S+ 0 0 67 -62,-5.1 3,-1.0 -65,-0.6 4,-0.3 0.801 107.6 68.3 -57.5 -25.3 75.2 28.1 30.5 255 263 A D G 3 S+ 0 0 65 -63,-0.4 -1,-0.3 1,-0.2 50,-0.3 0.399 109.3 32.4 -75.2 4.7 73.9 31.1 28.4 256 264 A Q G <> S+ 0 0 24 -3,-1.9 4,-1.7 2,-0.1 -1,-0.2 0.246 80.9 113.1-150.9 26.8 72.8 32.9 31.4 257 265 A Y H <> S+ 0 0 1 -3,-1.0 4,-4.9 2,-0.2 5,-0.4 0.997 79.0 45.9 -60.8 -74.0 75.2 32.1 34.1 258 266 A Y H > S+ 0 0 43 -4,-0.3 4,-4.3 2,-0.3 5,-0.3 0.762 111.0 51.0 -44.1 -42.3 76.9 35.5 34.5 259 267 A C H > S+ 0 0 3 29,-0.3 4,-3.4 2,-0.2 -1,-0.3 0.966 120.7 37.2 -60.3 -49.3 73.7 37.5 34.6 260 268 A G H X S+ 0 0 7 -4,-1.7 4,-3.3 -3,-0.3 5,-0.3 0.978 119.6 48.6 -60.7 -54.4 72.5 35.1 37.2 261 269 A V H X S+ 0 0 3 -4,-4.9 4,-1.4 1,-0.2 -2,-0.2 0.883 115.8 43.7 -53.2 -43.6 75.9 34.8 38.7 262 270 A L H < S+ 0 0 6 -4,-4.3 4,-0.5 -5,-0.4 3,-0.3 0.980 113.4 52.4 -66.7 -50.6 76.3 38.5 38.7 263 271 A Y H >< S+ 0 0 63 -4,-3.4 3,-1.3 -5,-0.3 -2,-0.2 0.818 106.7 48.8 -52.8 -44.7 72.9 39.0 40.0 264 272 A F H 3< S+ 0 0 67 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.881 98.8 69.6 -67.9 -32.0 73.0 36.7 43.0 265 273 A T T 3< S+ 0 0 0 -4,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.692 90.0 139.3 -55.2 -19.8 76.3 38.3 44.0 266 274 A G < - 0 0 4 -3,-1.3 2,-0.2 -4,-0.5 -1,-0.1 -0.047 58.2-163.2 47.5-151.5 74.0 41.4 44.7 267 275 A S > - 0 0 8 59,-0.2 4,-2.5 -3,-0.1 -1,-0.1 0.693 36.6-129.6 -73.0 172.8 73.9 43.5 46.9 268 276 A D H > S+ 0 0 112 1,-0.3 4,-2.4 2,-0.2 -2,-0.1 0.906 113.5 49.6 -51.3 -43.1 70.3 44.6 46.1 269 277 A I H > S+ 0 0 81 57,-0.3 4,-1.4 1,-0.2 5,-0.3 0.900 107.5 50.6 -63.2 -46.1 71.8 48.0 46.0 270 278 A F H > S+ 0 0 0 56,-0.5 4,-1.0 55,-0.2 -1,-0.2 0.859 110.8 55.5 -62.1 -31.4 74.6 47.1 43.7 271 279 A N H >X S+ 0 0 17 -4,-2.5 4,-2.9 2,-0.2 3,-0.8 0.997 104.1 46.5 -60.4 -69.4 72.0 45.6 41.5 272 280 A K H 3X S+ 0 0 122 -4,-2.4 4,-4.8 1,-0.3 5,-0.2 0.859 109.8 50.2 -42.7 -61.1 69.7 48.4 41.0 273 281 A N H 3X S+ 0 0 96 -4,-1.4 4,-3.3 1,-0.3 -1,-0.3 0.847 114.2 49.4 -52.0 -32.7 72.3 51.2 40.2 274 282 A M H X S+ 0 0 52 -4,-4.8 4,-1.4 1,-0.2 3,-0.8 0.945 113.9 45.5 -53.7 -54.9 69.5 51.8 36.4 277 285 A H H 3X S+ 0 0 38 -4,-3.3 4,-3.2 1,-0.3 -1,-0.2 0.838 109.1 56.8 -55.2 -39.3 72.8 52.6 34.6 278 286 A A H 3<>S+ 0 0 0 -4,-2.5 5,-1.4 1,-0.3 -1,-0.3 0.792 104.1 55.0 -57.2 -38.5 72.2 49.7 32.1 279 287 A L H X<5S+ 0 0 69 -4,-1.6 3,-0.7 -3,-0.8 -1,-0.3 0.791 110.5 44.4 -65.7 -40.0 68.9 51.5 31.4 280 288 A E H 3<5S+ 0 0 131 -4,-1.4 2,-0.2 1,-0.2 -2,-0.2 0.997 105.6 57.9 -68.2 -63.7 70.8 54.7 30.6 281 289 A K T 3<5S- 0 0 82 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.343 134.2 -89.4 -47.2 3.3 73.5 53.0 28.5 282 290 A G T < 5S+ 0 0 32 -3,-0.7 11,-1.4 -2,-0.2 2,-0.2 0.811 87.6 106.0 85.2 46.1 70.5 51.7 26.4 283 291 A F < - 0 0 27 -5,-1.4 2,-0.3 9,-0.2 -1,-0.2 -0.758 55.0-130.9-142.9-173.1 69.6 48.4 28.2 284 292 A T - 0 0 29 -2,-0.2 7,-2.6 7,-0.2 2,-0.4 -0.999 19.1-176.3-143.4 138.7 67.9 46.0 30.2 285 293 A I B +F 290 0C 22 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.993 12.5 145.9-147.1 143.2 68.8 43.6 32.9 286 294 A N - 0 0 46 3,-1.8 -23,-0.2 -2,-0.4 -2,-0.0 -0.571 66.4 -58.5-143.0-157.4 67.4 40.9 35.0 287 295 A E S S+ 0 0 71 -2,-0.2 -24,-0.3 1,-0.2 -23,-0.2 0.905 128.2 20.2 -62.0 -43.7 68.3 37.6 36.6 288 296 A Y S S+ 0 0 119 -29,-0.2 2,-0.3 -28,-0.1 -29,-0.3 0.533 119.5 17.9-103.2 -19.7 69.3 35.8 33.2 289 297 A T - 0 0 20 -30,-0.1 -3,-1.8 -31,-0.1 2,-0.4 -0.963 51.3-133.3-152.8 175.1 70.0 38.3 30.5 290 298 A I B -F 285 0C 0 13,-0.4 13,-2.3 -2,-0.3 -5,-0.2 -0.974 29.9-158.1-128.3 139.5 70.8 41.8 29.4 291 299 A R - 0 0 81 -7,-2.6 2,-0.5 -2,-0.4 -7,-0.2 -0.930 23.5-123.3-142.2 132.3 68.9 43.5 26.5 292 300 A P - 0 0 44 0, 0.0 2,-0.5 0, 0.0 -9,-0.2 -0.401 38.0-135.0 -59.5 108.1 69.3 46.2 24.0 293 301 A L - 0 0 52 -11,-1.4 7,-0.1 -2,-0.5 5,-0.1 -0.527 16.1-145.3 -71.8 118.3 66.4 48.5 24.7 294 302 A G - 0 0 31 -2,-0.5 3,-0.1 5,-0.1 5,-0.1 -0.185 14.0-124.0 -72.8 179.5 64.7 49.5 21.5 295 303 A V S S+ 0 0 148 1,-0.1 -1,-0.1 3,-0.0 4,-0.1 0.707 91.4 88.2 -98.8 -27.3 63.1 53.0 21.2 296 304 A T S S- 0 0 136 2,-0.2 2,-0.1 1,-0.1 -1,-0.1 0.542 127.3 -73.4 -48.5 -9.0 59.5 52.1 20.2 297 305 A G S S- 0 0 54 1,-0.2 2,-0.2 -3,-0.1 -1,-0.1 -0.687 105.0 -9.4 147.8 -74.9 59.0 52.0 23.9 298 306 A V + 0 0 111 -2,-0.1 -2,-0.2 -5,-0.1 2,-0.2 -0.531 63.1 173.2-129.8-168.4 60.7 48.8 24.9 299 307 A A - 0 0 40 -2,-0.2 -5,-0.1 -5,-0.1 2,-0.1 -0.662 14.8-135.9 158.6 150.1 62.3 45.8 23.2 300 308 A G + 0 0 37 -2,-0.2 -9,-0.0 -7,-0.1 -6,-0.0 -0.054 29.2 142.9-103.0-158.5 64.3 42.5 23.7 301 309 A E - 0 0 145 -10,-0.1 2,-0.4 2,-0.1 -11,-0.0 0.665 52.6-109.8 111.0 90.4 67.2 40.4 22.3 302 310 A P - 0 0 70 0, 0.0 -11,-0.2 0, 0.0 -2,-0.0 -0.147 30.3-138.6 -45.6 94.3 69.6 38.5 24.6 303 311 A L - 0 0 46 -13,-2.3 2,-0.7 -2,-0.4 -13,-0.4 -0.288 25.8-108.8 -58.9 138.4 72.9 40.2 24.5 304 312 A P - 0 0 97 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.705 39.5-175.6 -81.3 108.8 75.7 37.6 24.4 305 313 A V + 0 0 22 -2,-0.7 -47,-0.2 -50,-0.3 -48,-0.1 -0.887 24.0 169.5-108.4 129.8 77.7 37.4 27.7 306 314 A D S S+ 0 0 119 -2,-0.4 2,-0.3 1,-0.3 -1,-0.1 0.254 76.1 2.3-118.2 8.7 80.8 35.3 28.4 307 315 A S S > S- 0 0 41 1,-0.0 4,-0.9 -50,-0.0 -1,-0.3 -0.928 79.1 -94.8-179.5 169.2 81.7 37.0 31.7 308 316 A E H > S+ 0 0 4 -2,-0.3 4,-1.8 1,-0.2 5,-0.1 0.597 124.8 65.2 -67.6 -19.1 80.6 39.6 34.2 309 317 A K H > S+ 0 0 89 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.976 93.3 53.0 -65.1 -65.5 83.0 41.6 32.1 310 318 A D H > S+ 0 0 48 1,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.777 110.3 54.4 -45.6 -33.1 80.9 41.4 29.0 311 319 A I H X S+ 0 0 0 -4,-0.9 4,-1.5 2,-0.2 3,-0.5 0.993 108.9 40.2 -66.8 -64.3 78.0 42.8 31.2 312 320 A F H <>S+ 0 0 0 -4,-1.8 5,-1.6 1,-0.3 3,-0.5 0.919 112.3 59.6 -46.7 -55.2 79.6 46.0 32.6 313 321 A D H ><5S+ 0 0 73 -4,-2.4 3,-1.8 1,-0.3 -1,-0.3 0.834 101.6 55.8 -39.2 -51.1 81.1 46.6 29.2 314 322 A Y H 3<5S+ 0 0 60 -4,-1.5 -1,-0.3 -3,-0.5 -2,-0.2 0.932 111.0 40.1 -48.1 -58.6 77.6 46.7 27.8 315 323 A I T 3<5S- 0 0 0 -4,-1.5 -1,-0.3 -3,-0.5 -2,-0.2 0.409 117.6-121.5 -75.3 5.0 76.6 49.3 30.1 316 324 A Q T < 5 + 0 0 139 -3,-1.8 -3,-0.3 -4,-0.3 2,-0.2 0.889 63.7 143.6 53.5 46.7 80.0 50.8 29.4 317 325 A W < - 0 0 60 -5,-1.6 2,-0.5 -6,-0.1 -1,-0.2 -0.480 58.7 -87.8-107.2 176.1 80.9 50.7 33.1 318 326 A K - 0 0 132 -2,-0.2 2,-0.6 -6,-0.1 -1,-0.0 -0.714 50.0-111.0 -84.9 124.9 83.9 50.0 35.3 319 327 A Y - 0 0 92 -2,-0.5 2,-0.4 1,-0.1 -10,-0.1 -0.480 34.9-140.1 -67.5 117.5 84.3 46.4 36.1 320 328 A R - 0 0 32 -2,-0.6 5,-0.1 2,-0.1 -1,-0.1 -0.664 6.4-131.5 -76.0 117.9 83.5 46.1 39.8 321 329 A E - 0 0 132 -2,-0.4 3,-0.3 1,-0.1 -1,-0.0 -0.333 35.6-108.1 -63.5 154.6 85.6 43.7 41.8 322 330 A P S > S+ 0 0 25 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 0.910 118.6 55.2 -54.5 -42.6 83.1 41.7 43.8 323 331 A K G > S+ 0 0 125 1,-0.3 3,-1.0 2,-0.1 -146,-0.1 0.904 104.1 56.1 -51.6 -47.1 83.9 43.4 47.1 324 332 A D G 3 S+ 0 0 58 -3,-0.3 3,-0.3 1,-0.3 -1,-0.3 0.201 82.3 88.2 -72.7 12.3 83.2 46.8 45.6 325 333 A R G < + 0 0 0 -3,-1.8 -1,-0.3 1,-0.2 -55,-0.2 0.340 52.6 115.0 -92.3 4.6 79.8 45.7 44.6 326 334 A S < 0 0 65 -3,-1.0 -56,-0.5 1,-0.2 -57,-0.3 0.835 360.0 360.0 -40.2 -53.5 78.6 46.8 48.0 327 335 A E 0 0 157 -3,-0.3 -54,-0.2 -58,-0.2 -1,-0.2 0.279 360.0 360.0-150.4 360.0 76.3 49.6 46.7