==== 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 24-OCT-96 7ICV . 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) . 17865.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 219 67.0 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 . 27 8.3 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 . 1 0.3 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 . 17 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 123 37.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.2 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 3 2 0 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 1 1 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 0 220 0, 0.0 38,-0.1 0, 0.0 39,-0.1 0.000 360.0 360.0 360.0 -5.0 67.2 58.1 57.0 2 10 A T + 0 0 116 37,-0.1 4,-0.2 0, 0.0 37,-0.0 0.112 360.0 80.4-179.5 -1.4 67.0 59.1 60.7 3 11 A L S S+ 0 0 59 36,-0.1 42,-0.3 1,-0.1 4,-0.1 0.696 112.8 17.5 -94.7 -16.0 64.8 62.0 60.5 4 12 A N S > S+ 0 0 8 35,-0.1 4,-2.6 40,-0.1 5,-0.2 0.156 91.1 123.4-138.6 20.0 61.6 60.1 60.3 5 13 A G H > S+ 0 0 21 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.826 70.5 49.1 -49.3 -52.0 63.0 56.8 61.6 6 14 A G H > S+ 0 0 37 1,-0.2 4,-3.4 2,-0.2 5,-0.2 0.952 113.2 50.1 -60.4 -44.2 60.7 56.1 64.6 7 15 A I H > S+ 0 0 8 1,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.914 112.3 46.0 -58.3 -45.5 57.8 56.8 62.4 8 16 A T H X S+ 0 0 20 -4,-2.6 4,-1.7 1,-0.2 -1,-0.3 0.833 113.7 49.7 -68.4 -32.6 59.0 54.5 59.8 9 17 A D H X S+ 0 0 101 -4,-2.6 4,-2.5 -5,-0.2 -2,-0.2 0.927 109.5 48.7 -72.8 -41.9 59.8 51.9 62.3 10 18 A M H X S+ 0 0 5 -4,-3.4 4,-2.9 1,-0.2 5,-0.2 0.968 111.1 52.1 -58.7 -51.6 56.5 52.0 64.1 11 19 A L H X S+ 0 0 1 -4,-2.3 4,-3.4 1,-0.3 -1,-0.2 0.832 109.0 50.4 -50.6 -42.6 54.7 51.7 60.7 12 20 A T H X S+ 0 0 62 -4,-1.7 4,-3.0 2,-0.2 5,-0.4 0.920 109.3 50.6 -65.5 -42.4 56.9 48.7 59.8 13 21 A E H X S+ 0 0 72 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.970 114.8 45.2 -55.9 -51.6 55.9 47.1 63.2 14 22 A L H X S+ 0 0 0 -4,-2.9 4,-2.2 2,-0.2 -2,-0.2 0.945 113.1 50.0 -55.9 -51.8 52.3 47.8 62.4 15 23 A A H X S+ 0 0 3 -4,-3.4 4,-1.6 1,-0.2 3,-0.4 0.965 110.7 47.5 -53.9 -58.9 52.7 46.5 58.9 16 24 A N H X S+ 0 0 85 -4,-3.0 4,-2.6 1,-0.3 5,-0.4 0.858 109.9 54.5 -50.4 -41.7 54.3 43.3 59.8 17 25 A F H X>S+ 0 0 38 -4,-2.3 4,-2.5 -5,-0.4 5,-1.4 0.948 103.4 54.0 -62.2 -44.1 51.8 42.7 62.3 18 26 A E H <5S+ 0 0 7 -4,-2.2 6,-0.7 -3,-0.4 7,-0.2 0.929 115.3 40.6 -51.2 -51.1 48.8 43.1 60.0 19 27 A K H <5S+ 0 0 85 -4,-1.6 -2,-0.2 5,-0.3 -1,-0.2 0.924 121.4 37.1 -64.3 -58.1 50.2 40.6 57.7 20 28 A N H <5S+ 0 0 25 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.843 130.9 23.7 -70.4 -40.0 51.6 37.8 60.1 21 29 A V T <5S+ 0 0 30 -4,-2.5 -3,-0.2 -5,-0.4 -2,-0.1 0.893 129.9 30.9 -93.8 -59.9 48.9 37.9 62.8 22 30 A S S + 0 0 24 -6,-0.7 4,-5.5 1,-0.2 5,-0.3 -0.125 8.5 157.5 -46.4 48.5 45.4 42.2 56.8 25 33 A I H > S+ 0 0 95 -2,-2.8 4,-2.9 1,-0.2 -1,-0.2 0.795 76.5 50.1 -46.1 -36.7 47.4 42.2 53.5 26 34 A H H > S+ 0 0 152 2,-0.2 4,-1.8 3,-0.2 -1,-0.2 0.982 117.9 37.0 -67.7 -52.8 45.7 45.4 52.5 27 35 A K H > S+ 0 0 112 2,-0.3 4,-2.5 1,-0.2 -2,-0.2 0.853 117.3 53.4 -62.2 -44.1 46.3 47.2 55.7 28 36 A Y H X S+ 0 0 30 -4,-5.5 4,-1.5 1,-0.2 3,-0.2 0.978 109.7 45.5 -59.0 -53.6 49.5 45.6 55.8 29 37 A N H X S+ 0 0 80 -4,-2.9 4,-1.4 -5,-0.3 -2,-0.3 0.835 108.5 62.8 -57.0 -32.3 50.3 46.8 52.4 30 38 A A H >X S+ 0 0 32 -4,-1.8 4,-1.6 1,-0.2 3,-0.5 0.964 99.0 49.6 -61.9 -51.6 49.0 50.1 53.6 31 39 A Y H 3X S+ 0 0 15 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.838 107.1 62.9 -56.1 -31.4 51.6 50.6 56.3 32 40 A R H 3X S+ 0 0 150 -4,-1.5 4,-2.4 2,-0.2 -1,-0.2 0.843 100.7 42.2 -64.2 -43.9 54.2 49.8 53.8 33 41 A K H X S+ 0 0 29 -4,-3.3 4,-2.3 2,-0.2 3,-1.1 0.957 115.2 46.9 -74.6 -50.1 57.1 57.6 51.5 38 46 A I H 3< S+ 0 0 0 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.844 109.5 62.4 -57.6 -29.7 57.7 59.2 54.8 39 47 A A H 3< S+ 0 0 46 -4,-2.0 -1,-0.3 -5,-0.5 -2,-0.2 0.813 106.6 40.9 -60.2 -38.6 61.0 57.4 54.5 40 48 A K H << S+ 0 0 178 -3,-1.1 -2,-0.2 -4,-0.8 -1,-0.2 0.889 91.2 115.1 -76.8 -41.9 61.8 59.4 51.4 41 49 A Y < - 0 0 38 -4,-2.3 4,-0.1 1,-0.1 -38,-0.1 -0.070 60.2-143.5 -46.5 120.3 60.5 62.6 52.8 42 50 A P + 0 0 84 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.114 67.0 57.5 -63.8 -2.2 63.0 65.3 53.4 43 51 A H S S- 0 0 114 -39,-0.0 2,-0.8 0, 0.0 -40,-0.0 -0.702 88.7 -84.4-132.7-171.7 61.8 67.0 56.5 44 52 A K - 0 0 121 -2,-0.2 2,-0.7 -40,-0.0 -40,-0.1 -0.817 41.1-132.7 -96.6 109.8 61.0 66.4 60.1 45 53 A I + 0 0 8 -2,-0.8 3,-0.1 -42,-0.3 -38,-0.1 -0.378 30.8 175.6 -60.3 107.3 57.5 65.2 60.4 46 54 A K + 0 0 153 -2,-0.7 2,-0.3 1,-0.2 -1,-0.2 0.549 56.9 4.4 -95.5 -1.4 56.3 67.4 63.2 47 55 A S > - 0 0 38 1,-0.2 4,-1.4 -3,-0.0 -1,-0.2 -1.000 69.9-100.3-169.5 169.9 52.7 66.3 63.1 48 56 A G H >> S+ 0 0 0 -2,-0.3 4,-2.7 1,-0.2 3,-1.8 0.996 116.1 49.0 -58.8 -67.7 50.0 64.1 61.8 49 57 A A H 3> S+ 0 0 67 1,-0.3 4,-1.2 2,-0.2 -1,-0.2 0.771 106.5 58.2 -44.1 -35.4 48.5 66.5 59.4 50 58 A E H 34 S+ 0 0 42 1,-0.2 -1,-0.3 2,-0.2 -2,-0.2 0.880 112.0 40.7 -65.7 -38.6 51.8 67.3 58.0 51 59 A A H X< S+ 0 0 0 -3,-1.8 3,-5.5 -4,-1.4 -2,-0.2 0.933 104.2 65.0 -72.8 -44.4 52.2 63.7 57.2 52 60 A K H 3< S+ 0 0 95 -4,-2.7 5,-0.2 1,-0.4 -1,-0.2 0.786 88.3 74.2 -42.7 -35.7 48.7 63.2 56.0 53 61 A K T 3< S+ 0 0 170 -4,-1.2 -1,-0.4 -5,-0.3 -2,-0.2 0.687 85.5 81.6 -53.3 -27.5 49.7 65.6 53.4 54 62 A L S < S- 0 0 36 -3,-5.5 3,-0.3 1,-0.1 2,-0.3 -0.323 90.1 -99.9 -82.4 173.5 51.6 62.8 51.8 55 63 A P S S+ 0 0 93 0, 0.0 -18,-0.1 0, 0.0 3,-0.1 -0.629 109.3 26.7 -86.6 143.3 50.3 60.0 49.6 56 64 A G S S+ 0 0 28 -2,-0.3 2,-0.8 1,-0.2 -22,-0.3 0.198 100.9 110.9 84.7 -17.7 49.6 56.7 51.1 57 65 A V + 0 0 9 -3,-0.3 -1,-0.2 -5,-0.2 2,-0.1 -0.791 44.9 164.0 -98.2 115.2 49.1 58.7 54.2 58 66 A G > - 0 0 27 -2,-0.8 4,-2.0 -3,-0.1 5,-0.1 -0.347 51.7 -74.0-111.3-167.3 45.6 58.8 55.4 59 67 A T H > S+ 0 0 91 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.864 121.9 46.4 -58.1 -46.9 43.6 59.6 58.3 60 68 A K H > S+ 0 0 125 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.869 113.0 46.6 -68.4 -43.3 44.4 56.5 60.4 61 69 A I H > S+ 0 0 14 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.877 110.9 54.3 -67.4 -38.0 48.0 56.5 60.0 62 70 A A H X S+ 0 0 6 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.974 104.6 55.3 -56.4 -52.6 48.1 60.2 60.7 63 71 A E H X S+ 0 0 124 -4,-2.2 4,-1.8 1,-0.3 -1,-0.2 0.834 109.6 46.6 -44.5 -45.4 46.3 59.5 63.9 64 72 A K H X S+ 0 0 34 -4,-1.7 4,-2.7 2,-0.2 -1,-0.3 0.888 107.6 54.6 -70.1 -41.6 49.0 57.1 64.9 65 73 A I H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 5,-0.3 0.880 106.6 55.8 -62.0 -31.3 51.8 59.4 63.9 66 74 A D H X S+ 0 0 71 -4,-2.7 4,-4.0 -5,-0.2 -2,-0.2 0.990 108.5 43.3 -62.0 -58.5 50.1 61.9 66.2 67 75 A E H X S+ 0 0 69 -4,-1.8 4,-2.5 1,-0.3 6,-0.4 0.819 115.1 51.3 -54.0 -40.6 50.1 59.6 69.3 68 76 A F H < S+ 0 0 55 -4,-2.7 -1,-0.3 2,-0.2 -2,-0.2 0.963 115.1 39.3 -68.1 -45.5 53.6 58.6 68.6 69 77 A L H < S+ 0 0 60 -4,-2.5 -2,-0.2 -5,-0.3 -1,-0.2 0.955 115.6 54.6 -65.4 -45.4 54.9 62.1 68.2 70 78 A A H < S+ 0 0 81 -4,-4.0 2,-0.3 -5,-0.3 -2,-0.2 0.862 126.7 8.1 -54.7 -41.0 52.7 63.2 71.1 71 79 A T S < S- 0 0 67 -4,-2.5 -1,-0.1 2,-0.3 0, 0.0 -0.971 85.0-102.2-141.6 151.4 54.1 60.4 73.5 72 80 A G S S+ 0 0 69 -2,-0.3 2,-0.3 -3,-0.1 -4,-0.1 0.483 96.8 48.8 -55.6 1.8 57.1 58.0 73.1 73 81 A K - 0 0 89 -6,-0.4 2,-0.4 -5,-0.1 -2,-0.3 -0.913 67.6-129.9-146.0 175.6 54.7 55.3 72.4 74 82 A L > - 0 0 1 -2,-0.3 4,-2.8 1,-0.1 5,-0.2 -0.977 16.3-147.8-117.6 125.0 51.8 53.7 70.7 75 83 A R H > S+ 0 0 178 -2,-0.4 4,-3.2 1,-0.2 -1,-0.1 0.973 102.5 45.6 -56.6 -53.8 49.0 52.0 72.6 76 84 A K H > S+ 0 0 76 2,-0.3 4,-2.5 1,-0.3 5,-0.2 0.878 112.3 50.3 -54.5 -44.4 48.3 49.5 69.8 77 85 A L H > S+ 0 0 2 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.940 113.5 48.4 -61.6 -42.2 52.0 48.8 69.4 78 86 A E H X S+ 0 0 76 -4,-2.8 4,-0.5 2,-0.2 -2,-0.3 0.901 109.8 49.6 -64.2 -41.9 52.1 48.3 73.1 79 87 A K H >X S+ 0 0 137 -4,-3.2 4,-1.7 1,-0.2 3,-1.5 0.983 113.6 45.6 -61.6 -55.5 49.1 46.0 73.2 80 88 A I H 3< S+ 0 0 19 -4,-2.5 7,-0.3 1,-0.3 -2,-0.2 0.850 104.8 62.5 -52.9 -42.5 50.5 43.7 70.3 81 89 A R H 3< S+ 0 0 127 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.634 113.8 36.7 -59.3 -19.5 54.1 43.6 72.0 82 90 A Q H << S+ 0 0 145 -3,-1.5 -2,-0.2 -4,-0.5 -1,-0.1 0.910 87.5 102.3 -92.9 -70.7 52.5 41.9 74.9 83 91 A D X - 0 0 71 -4,-1.7 4,-2.1 1,-0.1 5,-0.2 0.246 61.7-146.2 -22.4 115.9 49.8 39.6 73.6 84 92 A D H > S+ 0 0 95 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.936 92.2 60.1 -59.8 -48.6 50.9 36.1 73.6 85 93 A T H > S+ 0 0 50 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.892 109.1 45.4 -46.8 -44.0 49.1 35.0 70.5 86 94 A S H >> S+ 0 0 3 1,-0.2 4,-2.0 2,-0.2 3,-0.8 0.987 110.0 52.5 -66.3 -51.8 50.9 37.5 68.5 87 95 A S H 3X S+ 0 0 47 -4,-2.1 4,-1.1 -7,-0.3 -1,-0.2 0.806 105.1 58.8 -53.0 -31.9 54.3 36.8 70.1 88 96 A S H 3X S+ 0 0 13 -4,-2.5 4,-3.6 1,-0.2 5,-0.3 0.895 102.7 49.9 -66.6 -38.5 53.9 33.1 69.2 89 97 A I H < S+ 0 0 62 -4,-1.1 3,-2.1 -5,-0.2 4,-0.3 0.908 109.7 49.0 -86.1 -55.8 58.3 32.9 67.1 92 100 A L H >< S+ 0 0 1 -4,-3.6 3,-3.1 1,-0.3 6,-0.2 0.918 104.1 66.1 -53.0 -40.9 57.1 29.7 65.4 93 101 A T T 3< S+ 0 0 41 -4,-1.5 -1,-0.3 1,-0.3 5,-0.2 0.711 82.9 74.7 -51.8 -26.2 57.8 31.5 62.2 94 102 A R T < S+ 0 0 114 -3,-2.1 2,-0.4 -5,-0.1 -1,-0.3 0.714 78.3 94.3 -64.8 -20.8 61.5 31.4 63.1 95 103 A V S X S- 0 0 3 -3,-3.1 3,-2.6 -4,-0.3 2,-0.4 -0.599 88.9-115.7 -79.1 132.2 61.4 27.8 62.2 96 104 A S T 3 S+ 0 0 39 -2,-0.4 35,-0.3 1,-0.3 36,-0.1 -0.540 105.9 30.3 -66.1 119.4 62.3 27.0 58.8 97 105 A G T 3 S+ 0 0 29 -2,-0.4 2,-0.6 1,-0.3 -1,-0.3 0.107 97.3 99.6 116.9 -19.0 59.3 25.6 57.2 98 106 A I < + 0 0 9 -3,-2.6 -1,-0.3 -6,-0.2 26,-0.0 -0.929 44.0 172.1-107.4 122.0 56.8 27.6 59.3 99 107 A G > - 0 0 32 -2,-0.6 4,-2.0 -3,-0.1 -4,-0.1 -0.311 52.9 -85.6-107.6-168.8 55.3 30.6 57.7 100 108 A P H > S+ 0 0 39 0, 0.0 4,-3.7 0, 0.0 5,-0.2 0.869 124.5 61.1 -69.8 -43.3 52.5 32.6 59.2 101 109 A S H > S+ 0 0 93 1,-0.2 4,-1.7 2,-0.2 -3,-0.1 0.928 112.6 38.0 -49.0 -53.5 49.8 30.5 57.8 102 110 A A H > S+ 0 0 17 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.904 110.6 60.5 -66.3 -44.5 51.2 27.5 59.7 103 111 A A H X S+ 0 0 0 -4,-2.0 4,-1.7 1,-0.2 5,-0.3 0.897 104.6 51.5 -52.6 -41.7 52.1 29.6 62.7 104 112 A R H X S+ 0 0 52 -4,-3.7 4,-2.3 2,-0.2 3,-0.3 0.979 108.6 48.7 -61.9 -51.8 48.4 30.5 63.0 105 113 A K H < S+ 0 0 99 -4,-1.7 4,-0.4 1,-0.2 -2,-0.2 0.927 111.9 50.1 -50.0 -50.2 47.2 26.8 62.9 106 114 A F H X>S+ 0 0 0 -4,-2.5 5,-3.7 1,-0.3 4,-0.6 0.844 111.1 48.0 -56.5 -40.7 49.7 25.7 65.5 107 115 A V H <5S+ 0 0 6 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.833 107.6 53.3 -73.4 -33.5 48.9 28.4 67.9 108 116 A D T <5S+ 0 0 124 -4,-2.3 -1,-0.3 -5,-0.3 -2,-0.2 0.617 110.9 49.2 -78.5 -3.8 45.3 27.8 67.6 109 117 A E T 45S- 0 0 109 -4,-0.4 -2,-0.3 -3,-0.3 -1,-0.2 0.512 124.3-106.4-104.7 -9.6 46.2 24.3 68.4 110 118 A G T <5S+ 0 0 36 -4,-0.6 2,-0.9 1,-0.3 -3,-0.3 0.495 76.5 132.5 102.8 -0.5 48.3 25.4 71.3 111 119 A I < + 0 0 6 -5,-3.7 -1,-0.3 1,-0.2 -2,-0.2 -0.802 15.9 146.1 -86.9 114.4 51.7 24.8 70.0 112 120 A K + 0 0 69 -2,-0.9 2,-0.3 -3,-0.1 -1,-0.2 0.286 53.9 43.4-130.3 1.7 53.4 28.0 70.9 113 121 A T S > S- 0 0 59 -3,-0.1 4,-2.8 1,-0.1 5,-0.1 -0.900 84.5 -97.8-145.1 176.1 56.8 26.8 71.7 114 122 A L H > S+ 0 0 36 -2,-0.3 4,-2.4 2,-0.2 -1,-0.1 0.894 122.1 47.6 -58.7 -47.5 59.8 24.7 70.8 115 123 A E H > S+ 0 0 129 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.941 109.1 54.3 -61.5 -44.6 58.8 22.0 73.2 116 124 A D H > S+ 0 0 43 1,-0.3 4,-1.2 2,-0.2 -2,-0.2 0.922 108.8 50.6 -50.1 -49.9 55.3 22.1 71.9 117 125 A L H >< S+ 0 0 1 -4,-2.8 3,-0.8 1,-0.2 -1,-0.3 0.932 108.6 49.4 -57.2 -49.2 56.7 21.6 68.6 118 126 A R H >< S+ 0 0 122 -4,-2.4 3,-1.9 1,-0.3 -2,-0.2 0.915 108.4 53.7 -56.2 -48.2 58.8 18.6 69.6 119 127 A K H 3< S+ 0 0 158 -4,-3.1 -1,-0.3 1,-0.3 3,-0.2 0.694 115.9 42.9 -59.0 -21.4 55.8 17.0 71.3 120 128 A N T X< + 0 0 40 -4,-1.2 3,-2.5 -3,-0.8 4,-0.4 -0.010 64.8 136.5-120.8 39.0 54.0 17.3 68.2 121 129 A E G X + 0 0 96 -3,-1.9 3,-0.7 1,-0.3 -1,-0.2 0.699 67.6 72.6 -54.6 -17.1 56.6 16.4 65.7 122 130 A D G 3 S+ 0 0 117 -3,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.825 92.6 52.0 -68.8 -31.5 53.8 14.5 64.1 123 131 A K G < S+ 0 0 92 -3,-2.5 2,-0.3 -6,-0.2 -1,-0.2 0.541 95.3 84.4 -84.6 -2.5 52.1 17.6 62.8 124 132 A L S < S- 0 0 4 -3,-0.7 2,-0.1 -4,-0.4 -26,-0.0 -0.761 73.6-133.0 -97.3 149.2 55.1 19.0 61.2 125 133 A N > - 0 0 85 -2,-0.3 4,-2.5 -28,-0.1 5,-0.2 -0.401 37.9 -84.9 -92.4 172.7 56.1 18.0 57.6 126 134 A H H > S+ 0 0 107 2,-0.2 4,-2.4 1,-0.2 3,-0.4 0.873 126.9 45.5 -40.7 -61.7 59.7 17.0 56.5 127 135 A H H > S+ 0 0 44 1,-0.3 4,-2.8 2,-0.2 3,-0.3 0.955 115.4 47.6 -49.6 -60.6 61.0 20.6 55.9 128 136 A Q H > S+ 0 0 11 1,-0.3 4,-1.7 -31,-0.3 -1,-0.3 0.793 108.8 55.9 -52.8 -31.7 59.6 21.8 59.2 129 137 A R H X S+ 0 0 97 -4,-2.5 4,-2.7 -3,-0.4 -1,-0.3 0.966 108.6 43.9 -70.1 -45.0 61.0 18.9 60.9 130 138 A I H X S+ 0 0 6 -4,-2.4 4,-2.5 -3,-0.3 -2,-0.2 0.928 110.6 57.5 -60.3 -42.2 64.5 19.5 59.9 131 139 A G H < S+ 0 0 1 -4,-2.8 -35,-0.3 -35,-0.3 -1,-0.2 0.855 109.8 45.1 -54.8 -37.5 63.9 23.2 60.6 132 140 A L H >< S+ 0 0 10 -4,-1.7 3,-1.4 -5,-0.3 4,-0.2 0.927 109.6 54.0 -75.6 -41.0 63.0 22.2 64.1 133 141 A K H 3< S+ 0 0 131 -4,-2.7 -2,-0.2 1,-0.3 3,-0.2 0.830 118.7 35.3 -62.2 -31.8 65.9 19.8 64.5 134 142 A Y T 3X S+ 0 0 15 -4,-2.5 4,-3.2 -5,-0.2 -1,-0.3 0.150 74.8 128.4-111.9 26.4 68.3 22.5 63.5 135 143 A F H <> S+ 0 0 22 -3,-1.4 4,-1.1 1,-0.2 -1,-0.2 0.858 81.3 42.3 -43.1 -47.5 66.7 25.6 65.1 136 144 A G H >> S+ 0 0 40 -4,-0.2 3,-1.9 -3,-0.2 4,-0.8 0.996 114.3 46.4 -65.2 -68.5 69.9 26.5 66.7 137 145 A D H >4 S+ 0 0 30 1,-0.3 3,-0.8 -4,-0.2 -2,-0.2 0.810 110.2 59.6 -44.5 -39.1 72.4 25.8 63.9 138 146 A F H 3< S+ 0 0 42 -4,-3.2 -1,-0.3 1,-0.2 -2,-0.2 0.788 102.3 48.7 -63.5 -33.8 70.0 27.6 61.6 139 147 A E H << S+ 0 0 98 -3,-1.9 2,-0.3 -4,-1.1 -1,-0.2 0.647 91.3 99.8 -84.0 -10.4 70.1 30.8 63.4 140 148 A K S << S- 0 0 100 -4,-0.8 -4,-0.0 -3,-0.8 0, 0.0 -0.600 74.1-123.7 -77.7 126.1 74.0 30.9 63.6 141 149 A R - 0 0 149 -2,-0.3 40,-0.2 1,-0.1 -1,-0.1 -0.143 22.3-116.3 -63.3 164.5 75.8 33.0 61.2 142 150 A I E -A 180 0A 0 38,-4.1 38,-3.6 40,-0.1 2,-0.1 -0.914 22.7-140.2-109.7 108.7 78.4 31.4 58.9 143 151 A P E >> -A 179 0A 40 0, 0.0 3,-2.8 0, 0.0 4,-1.7 -0.437 18.4-125.3 -64.2 135.0 81.9 32.7 59.5 144 152 A R H 3> S+ 0 0 65 34,-2.9 4,-2.4 1,-0.3 5,-0.2 0.802 109.6 68.4 -52.4 -32.7 83.8 33.2 56.2 145 153 A E H 34 S+ 0 0 122 33,-0.3 4,-0.3 1,-0.2 -1,-0.3 0.669 107.0 40.4 -58.0 -21.8 86.5 31.0 57.6 146 154 A E H <> S+ 0 0 27 -3,-2.8 4,-2.8 2,-0.2 3,-0.2 0.795 108.2 60.6 -90.5 -42.2 84.0 28.2 57.4 147 155 A M H X S+ 0 0 1 -4,-1.7 4,-3.7 1,-0.2 5,-0.2 0.884 103.1 52.0 -49.6 -49.7 82.6 29.3 54.1 148 156 A L H X S+ 0 0 77 -4,-2.4 4,-1.6 2,-0.2 -1,-0.2 0.784 109.6 50.0 -60.8 -35.5 86.1 28.9 52.4 149 157 A Q H > S+ 0 0 64 -4,-0.3 4,-1.8 -3,-0.2 -1,-0.2 0.948 114.1 43.9 -69.2 -46.1 86.2 25.4 53.8 150 158 A M H X S+ 0 0 3 -4,-2.8 4,-2.5 1,-0.2 5,-0.3 0.927 112.4 52.4 -58.3 -51.5 82.8 24.6 52.4 151 159 A Q H X S+ 0 0 55 -4,-3.7 4,-1.9 1,-0.2 5,-0.2 0.885 105.0 57.0 -56.0 -38.5 83.5 26.2 49.2 152 160 A D H X S+ 0 0 86 -4,-1.6 4,-1.7 -5,-0.2 -1,-0.2 0.946 109.9 44.1 -62.2 -43.2 86.6 24.2 48.9 153 161 A I H X S+ 0 0 37 -4,-1.8 4,-2.7 2,-0.2 5,-0.3 0.988 112.6 47.8 -65.5 -54.2 84.7 21.0 49.2 154 162 A V H X S+ 0 0 3 -4,-2.5 4,-2.6 1,-0.2 5,-0.3 0.949 112.1 51.1 -50.7 -55.0 81.8 21.8 46.9 155 163 A L H X S+ 0 0 58 -4,-1.9 4,-1.4 -5,-0.3 -1,-0.2 0.865 111.3 46.9 -53.0 -42.7 84.1 23.0 44.2 156 164 A N H X S+ 0 0 80 -4,-1.7 4,-2.8 -5,-0.2 -1,-0.2 0.905 112.2 48.5 -68.8 -43.3 86.3 19.9 44.3 157 165 A E H X S+ 0 0 23 -4,-2.7 4,-2.0 1,-0.2 5,-0.2 0.920 109.9 51.5 -65.6 -38.3 83.5 17.4 44.2 158 166 A V H X S+ 0 0 6 -4,-2.6 4,-1.8 -5,-0.3 7,-0.3 0.908 108.9 53.7 -62.3 -38.2 81.8 19.2 41.3 159 167 A K H < S+ 0 0 132 -4,-1.4 3,-0.3 -5,-0.3 -2,-0.2 0.967 106.6 50.1 -60.6 -51.2 85.1 19.0 39.6 160 168 A K H < S+ 0 0 128 -4,-2.8 3,-0.2 1,-0.2 -2,-0.2 0.939 109.0 50.6 -52.2 -54.4 85.5 15.3 40.0 161 169 A V H < S- 0 0 48 -4,-2.0 2,-0.3 1,-0.2 -1,-0.2 0.813 133.4 -5.0 -55.5 -35.6 82.0 14.5 38.8 162 170 A D >< - 0 0 48 -4,-1.8 3,-1.5 -3,-0.3 -1,-0.2 -0.810 52.1-150.5-166.4 122.9 82.5 16.6 35.6 163 171 A S T 3 S+ 0 0 83 -2,-0.3 -1,-0.1 1,-0.3 -3,-0.1 0.670 97.3 66.0 -63.7 -22.3 85.3 18.8 34.5 164 172 A E T 3 S+ 0 0 106 -5,-0.1 -1,-0.3 -6,-0.1 2,-0.1 0.430 75.4 110.2 -80.4 -6.2 82.8 20.8 32.6 165 173 A Y < - 0 0 20 -3,-1.5 2,-0.5 -7,-0.3 24,-0.2 -0.444 51.0-157.1 -75.2 149.4 80.9 22.1 35.5 166 174 A I E +B 188 0B 49 22,-2.2 22,-2.2 -2,-0.1 2,-0.4 -0.976 17.2 174.7-130.9 112.7 81.0 25.7 36.5 167 175 A A E +B 187 0B 20 -2,-0.5 2,-0.3 20,-0.2 20,-0.2 -0.910 5.0 179.4-122.7 148.6 80.1 26.5 40.0 168 176 A T E -B 186 0B 27 18,-1.5 18,-3.0 -2,-0.4 2,-1.0 -0.989 26.4-132.6-150.9 136.2 80.2 29.7 41.8 169 177 A V E -B 185 0B 8 -2,-0.3 16,-0.2 16,-0.2 -2,-0.0 -0.763 30.9-175.1 -95.7 107.1 79.4 30.8 45.2 170 178 A C + 0 0 2 14,-1.8 14,-0.3 -2,-1.0 3,-0.3 0.135 35.0 78.4 -79.8-155.3 77.3 33.8 45.1 171 179 A G S >> S- 0 0 20 93,-0.4 4,-0.9 1,-0.2 3,-0.8 -0.218 102.5 -53.2 88.5-179.1 76.2 35.9 48.0 172 180 A S T 34 S+ 0 0 28 1,-0.2 5,-0.2 2,-0.2 -1,-0.2 0.751 130.3 72.5 -68.3 -26.1 77.9 38.4 50.2 173 181 A F T >4 S+ 0 0 13 -3,-0.3 3,-0.7 1,-0.3 -1,-0.2 0.850 99.1 46.6 -53.2 -39.7 80.5 35.7 50.6 174 182 A R T <4 S+ 0 0 59 -3,-0.8 -1,-0.3 -4,-0.3 -2,-0.2 0.757 108.4 54.6 -68.3 -41.7 81.4 36.6 47.1 175 183 A R T 3< S- 0 0 67 -4,-0.9 2,-0.6 90,-0.2 -1,-0.2 0.056 127.9 -91.7 -84.8 19.0 81.3 40.4 47.8 176 184 A G < + 0 0 33 -3,-0.7 -3,-0.1 1,-0.2 147,-0.1 -0.533 66.2 165.8 108.1 -67.0 83.8 40.1 50.7 177 185 A A - 0 0 34 -2,-0.6 -1,-0.2 -5,-0.2 3,-0.0 0.695 38.6-136.1 10.2 119.6 81.5 39.6 53.7 178 186 A E S S+ 0 0 144 1,-0.1 -34,-2.9 -35,-0.1 -33,-0.3 0.643 85.1 2.7 -66.0 -15.3 83.1 38.3 57.0 179 187 A S E -A 143 0A 37 -36,-0.3 2,-0.3 -35,-0.1 -1,-0.1 -0.983 68.6-154.8-163.2 160.7 80.2 35.9 57.6 180 188 A S E -A 142 0A 3 -38,-3.6 -38,-4.1 -2,-0.3 3,-0.1 -0.949 24.0-128.2-145.1 166.2 77.1 34.8 55.9 181 189 A G S S- 0 0 35 -2,-0.3 65,-0.4 -40,-0.2 2,-0.3 0.805 85.1 -17.2 -78.3 -39.4 73.7 33.3 56.6 182 190 A D - 0 0 79 63,-0.1 2,-0.5 -40,-0.1 65,-0.2 -0.946 67.6 -98.9-158.6 174.8 73.8 30.4 54.1 183 191 A M E - c 0 247B 2 63,-2.1 65,-2.7 -2,-0.3 2,-0.5 -0.940 28.3-176.5-111.0 126.2 75.6 29.0 51.0 184 192 A D E - c 0 248B 24 -2,-0.5 -14,-1.8 -14,-0.3 2,-0.6 -0.969 5.3-167.7-122.9 119.6 74.2 29.4 47.3 185 193 A V E -Bc 169 249B 1 63,-3.1 65,-1.9 -2,-0.5 2,-0.3 -0.877 10.5-149.7-101.9 126.2 76.1 27.8 44.7 186 194 A L E -Bc 168 250B 2 -18,-3.0 -18,-1.5 -2,-0.6 2,-0.4 -0.741 24.7-163.7 -88.6 139.6 75.0 28.9 41.1 187 195 A L E +Bc 167 251B 1 63,-3.1 65,-2.7 -2,-0.3 2,-0.3 -0.983 19.4 158.5-137.8 144.5 75.6 26.1 38.7 188 196 A T E -Bc 166 252B 0 -22,-2.2 -22,-2.2 -2,-0.4 5,-0.1 -0.930 16.9-160.1-149.6 170.1 75.8 25.5 35.0 189 197 A H E > - c 0 253B 12 63,-0.6 3,-1.0 3,-0.4 65,-0.8 -0.949 30.3-121.2-155.5 139.2 77.2 23.2 32.5 190 198 A P T 3 S+ 0 0 62 0, 0.0 2,-0.2 0, 0.0 65,-0.1 0.797 111.7 62.9 -50.9 -39.1 77.9 23.7 28.7 191 199 A S T 3 S+ 0 0 57 1,-0.1 2,-0.3 -27,-0.1 11,-0.1 0.005 97.5 71.6 -79.9 30.9 75.6 21.0 27.8 192 200 A F < + 0 0 13 -3,-1.0 62,-5.0 -2,-0.2 -3,-0.4 -0.875 60.7 130.0-154.6 117.4 72.7 23.0 29.3 193 201 A T - 0 0 32 60,-0.4 5,-0.1 -2,-0.3 -5,-0.0 -0.995 64.4 -63.4-164.5 167.4 71.1 26.1 28.1 194 202 A S S S+ 0 0 68 -2,-0.3 -1,-0.0 1,-0.2 62,-0.0 0.564 129.7 20.0 -13.6 -60.8 68.1 28.2 27.1 195 203 A E S S+ 0 0 162 2,-0.1 -1,-0.2 3,-0.0 3,-0.1 0.944 95.5 107.3 -81.6 -56.4 67.0 25.9 24.3 196 204 A S S S- 0 0 38 1,-0.2 2,-1.0 3,-0.0 -3,-0.1 0.175 78.8-120.0 -26.1 115.4 68.7 22.6 25.2 197 205 A T - 0 0 128 1,-0.1 -1,-0.2 -5,-0.1 -2,-0.1 -0.650 53.2 -64.3 -82.4 113.8 66.0 20.5 26.4 198 206 A K - 0 0 90 -2,-1.0 -1,-0.1 -3,-0.1 -5,-0.0 0.725 34.6-167.2 31.4 163.8 66.6 19.6 30.0 199 207 A Q + 0 0 76 25,-0.2 4,-0.4 -3,-0.1 3,-0.4 -0.349 10.8 172.8-179.4 79.6 69.2 17.6 31.8 200 208 A P S >> S+ 0 0 48 0, 0.0 4,-2.6 0, 0.0 3,-0.9 0.770 79.2 64.8 -65.7 -32.8 68.1 16.9 35.4 201 209 A K H 3> S+ 0 0 117 1,-0.3 4,-3.9 2,-0.2 5,-0.4 0.878 86.9 73.8 -58.2 -37.6 71.0 14.6 35.9 202 210 A L H 3> S+ 0 0 2 -3,-0.4 4,-0.5 1,-0.2 -1,-0.3 0.835 110.6 26.6 -42.6 -46.6 73.0 17.7 35.5 203 211 A L H <> S+ 0 0 0 -3,-0.9 4,-1.7 -4,-0.4 -1,-0.2 0.859 120.7 55.0 -86.4 -39.5 71.8 18.8 39.0 204 212 A H H X S+ 0 0 39 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.833 100.3 60.5 -64.4 -36.2 71.1 15.3 40.6 205 213 A Q H X S+ 0 0 69 -4,-3.9 4,-1.9 -5,-0.2 -1,-0.2 0.949 108.0 42.2 -60.4 -47.2 74.6 14.0 39.9 206 214 A V H X S+ 0 0 3 -4,-0.5 4,-2.6 -5,-0.4 5,-0.2 0.904 110.1 56.4 -68.0 -39.1 76.3 16.6 41.9 207 215 A V H X S+ 0 0 0 -4,-1.7 4,-1.4 1,-0.2 -1,-0.2 0.897 107.9 50.6 -58.0 -38.1 73.8 16.5 44.8 208 216 A E H >X S+ 0 0 109 -4,-1.7 4,-2.4 2,-0.2 3,-0.6 0.965 106.5 51.6 -62.1 -54.4 74.5 12.9 45.1 209 217 A Q H 3X S+ 0 0 30 -4,-1.9 4,-2.9 1,-0.3 5,-0.3 0.917 106.0 57.5 -49.9 -46.9 78.2 13.2 45.2 210 218 A L H 3<>S+ 0 0 1 -4,-2.6 5,-3.0 1,-0.3 6,-1.2 0.890 111.2 40.9 -55.9 -39.6 77.9 15.8 47.9 211 219 A Q H <<5S+ 0 0 67 -4,-1.4 3,-0.3 -3,-0.6 -1,-0.3 0.792 106.2 66.2 -79.1 -26.8 76.0 13.3 50.0 212 220 A K H <5S+ 0 0 144 -4,-2.4 -2,-0.2 1,-0.3 -3,-0.2 0.986 110.0 35.8 -59.2 -53.0 78.3 10.6 49.0 213 221 A V T <5S- 0 0 57 -4,-2.9 -1,-0.3 -5,-0.1 -2,-0.2 0.566 119.8-114.6 -77.3 -1.6 81.1 12.3 50.8 214 222 A H T 5S+ 0 0 141 -4,-0.3 -3,-0.2 -3,-0.3 18,-0.1 0.710 80.3 122.0 81.1 23.1 78.7 13.5 53.5 215 223 A F S -c 189 0B 20 0, 0.0 3,-1.2 0, 0.0 -60,-0.4 -0.495 34.7-122.2 -62.3 135.4 71.5 27.2 31.4 254 262 A K G > S+ 0 0 67 -62,-5.0 3,-1.2 -65,-0.8 4,-0.3 0.821 107.9 69.4 -51.4 -31.5 75.1 28.1 30.5 255 263 A D G 3 S+ 0 0 69 -63,-0.4 -1,-0.3 1,-0.2 50,-0.1 0.113 108.2 33.0 -77.1 29.0 73.7 30.9 28.3 256 264 A Q G <> S+ 0 0 35 -3,-1.2 4,-0.7 -2,-0.3 -1,-0.2 0.179 82.3 113.2-169.2 28.1 72.5 33.0 31.4 257 265 A Y H <> S+ 0 0 2 -3,-1.2 4,-4.0 48,-0.2 5,-0.3 0.972 76.0 46.2 -69.5 -67.8 75.1 32.2 34.0 258 266 A Y H > S+ 0 0 39 -4,-0.3 4,-3.6 1,-0.3 5,-0.3 0.803 110.0 50.8 -53.1 -37.7 76.7 35.5 34.4 259 267 A C H > S+ 0 0 5 29,-0.2 4,-3.3 2,-0.2 -1,-0.3 0.908 117.1 44.8 -64.7 -38.6 73.7 37.6 34.6 260 268 A G H X S+ 0 0 8 -4,-0.7 4,-3.2 -3,-0.3 5,-0.3 0.980 115.5 45.1 -63.3 -55.6 72.6 35.2 37.1 261 269 A V H X S+ 0 0 2 -4,-4.0 4,-1.7 2,-0.2 -2,-0.2 0.889 116.6 46.5 -53.9 -46.4 75.9 35.2 38.9 262 270 A L H >X S+ 0 0 9 -4,-3.6 4,-1.0 -5,-0.3 3,-0.6 0.988 112.9 51.0 -58.4 -57.6 76.1 38.9 38.7 263 271 A Y H >< S+ 0 0 59 -4,-3.3 3,-1.4 -5,-0.3 -2,-0.2 0.898 110.3 44.9 -44.8 -63.4 72.7 39.2 39.9 264 272 A F H 3< S+ 0 0 75 -4,-3.2 -93,-0.4 1,-0.3 -1,-0.3 0.763 103.0 67.3 -56.6 -31.3 72.9 37.0 43.0 265 273 A T H << S+ 0 0 0 -4,-1.7 -1,-0.3 -3,-0.6 -2,-0.2 0.751 90.0 135.1 -62.3 -27.5 76.2 38.6 44.0 266 274 A G << - 0 0 3 -3,-1.4 2,-0.2 -4,-1.0 -1,-0.2 -0.170 65.5-150.3 61.9-158.0 74.4 41.8 44.7 267 275 A S >> - 0 0 10 59,-0.1 4,-2.7 -3,-0.1 3,-0.5 0.630 34.7-130.0 -77.5 172.3 74.2 44.0 46.6 268 276 A D H 3> S+ 0 0 112 1,-0.3 4,-2.3 2,-0.2 5,-0.1 0.886 112.8 46.6 -46.2 -47.9 70.6 44.9 46.0 269 277 A I H 3> S+ 0 0 79 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.738 107.9 54.8 -67.0 -31.7 71.8 48.5 45.7 270 278 A F H <> S+ 0 0 0 -3,-0.5 4,-2.2 56,-0.5 5,-0.3 0.903 109.8 49.6 -71.3 -35.8 74.6 47.5 43.4 271 279 A N H X S+ 0 0 13 -4,-2.7 4,-3.9 2,-0.2 -2,-0.2 0.969 108.0 50.1 -61.2 -58.3 72.1 45.9 41.2 272 280 A K H X S+ 0 0 132 -4,-2.3 4,-3.2 2,-0.2 5,-0.3 0.927 113.0 46.1 -46.6 -59.2 69.7 48.7 41.0 273 281 A N H X S+ 0 0 96 -4,-1.8 4,-3.3 1,-0.3 -1,-0.2 0.928 116.9 42.9 -54.3 -49.0 72.4 51.2 40.1 274 282 A M H X S+ 0 0 4 -4,-2.2 4,-2.4 1,-0.2 -1,-0.3 0.886 114.5 56.4 -63.0 -34.4 74.0 49.0 37.5 275 283 A R H X S+ 0 0 73 -4,-3.9 4,-1.1 -5,-0.3 -2,-0.3 0.914 110.3 40.5 -62.0 -44.8 70.4 48.4 36.6 276 284 A A H X S+ 0 0 56 -4,-3.2 4,-1.6 2,-0.2 -2,-0.2 0.879 112.8 54.5 -72.0 -40.2 69.6 52.0 36.1 277 285 A H H X S+ 0 0 35 -4,-3.3 4,-2.5 -5,-0.3 3,-0.5 0.923 102.3 58.4 -58.4 -43.8 72.9 52.7 34.3 278 286 A A H <>S+ 0 0 0 -4,-2.4 5,-1.2 1,-0.3 -1,-0.2 0.868 105.1 52.4 -43.9 -51.4 72.2 49.9 31.9 279 287 A L H ><5S+ 0 0 69 -4,-1.1 3,-0.9 3,-0.3 -1,-0.3 0.750 108.9 47.1 -55.4 -44.1 69.0 51.7 30.9 280 288 A E H 3<5S+ 0 0 135 -4,-1.6 2,-0.2 -3,-0.5 -2,-0.2 0.999 107.4 55.7 -63.2 -65.2 70.7 54.9 30.3 281 289 A K T 3<5S- 0 0 88 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.335 132.5 -94.7 -46.8 2.3 73.4 53.1 28.2 282 290 A G T < 5S+ 0 0 29 -3,-0.9 11,-2.1 1,-0.2 2,-0.4 0.850 85.2 125.5 78.8 44.3 70.4 51.8 26.1 283 291 A F E < -F 292 0C 34 -5,-1.2 2,-0.4 9,-0.2 -1,-0.2 -0.965 50.1-149.2-143.4 156.7 70.0 48.5 28.0 284 292 A T E -F 291 0C 30 7,-2.9 7,-2.0 -2,-0.4 2,-0.4 -0.893 19.7-178.2-116.9 140.0 67.9 46.1 29.9 285 293 A I E +F 290 0C 20 -2,-0.4 2,-0.3 5,-0.2 5,-0.2 -0.989 10.8 145.1-148.0 143.4 68.9 43.8 32.6 286 294 A N - 0 0 39 3,-1.7 3,-0.5 -2,-0.4 -23,-0.2 -0.830 64.9 -57.9-151.2-174.2 67.5 41.1 34.8 287 295 A E S S+ 0 0 72 -2,-0.3 -24,-0.2 1,-0.2 -23,-0.2 0.805 129.1 20.6 -41.3 -43.9 68.2 37.9 36.5 288 296 A Y S S+ 0 0 126 -29,-0.1 2,-0.3 1,-0.1 -29,-0.2 0.480 119.3 14.7-111.2 -7.6 69.0 36.0 33.2 289 297 A T - 0 0 20 -3,-0.5 -3,-1.7 -30,-0.1 2,-0.5 -0.990 50.3-129.6-161.2 173.0 69.9 38.4 30.4 290 298 A I E -F 285 0C 0 13,-0.4 13,-2.4 -2,-0.3 -5,-0.2 -0.958 32.4-163.3-132.0 115.7 70.9 41.9 29.1 291 299 A R E -F 284 0C 85 -7,-2.0 -7,-2.9 -2,-0.5 2,-0.5 -0.852 23.0-116.8-115.0 144.4 68.9 43.3 26.2 292 300 A P E -F 283 0C 44 0, 0.0 2,-0.6 0, 0.0 -9,-0.2 -0.525 36.8-129.1 -67.3 113.9 69.3 46.1 23.7 293 301 A L - 0 0 53 -11,-2.1 7,-0.1 -2,-0.5 5,-0.1 -0.550 18.8-154.8 -76.6 115.3 66.7 48.7 24.3 294 302 A G - 0 0 31 -2,-0.6 5,-0.1 5,-0.1 3,-0.1 -0.142 17.0-128.1 -72.5-179.9 64.8 49.7 21.2 295 303 A V S S+ 0 0 143 1,-0.1 -1,-0.1 3,-0.1 4,-0.1 0.683 88.0 89.1-106.3 -21.0 63.1 53.1 21.1 296 304 A T S S- 0 0 131 2,-0.2 -1,-0.1 1,-0.1 3,-0.1 0.603 127.1 -69.7 -50.9 -13.7 59.5 52.3 20.2 297 305 A G S S- 0 0 53 1,-0.1 2,-0.3 -3,-0.1 -1,-0.1 -0.456 106.0 -16.8 156.3 -64.5 59.0 52.0 23.8 298 306 A V + 0 0 108 -5,-0.1 2,-0.2 -6,-0.0 -2,-0.2 -0.720 63.5 174.8-147.1-173.9 60.9 48.9 24.7 299 307 A A - 0 0 46 -2,-0.3 2,-0.1 -5,-0.1 -5,-0.1 -0.821 10.8-146.4 168.3 159.1 62.3 46.0 22.8 300 308 A G + 0 0 38 -2,-0.2 -9,-0.0 -7,-0.1 -2,-0.0 -0.435 30.1 142.7-128.2-157.8 64.4 42.8 23.2 301 309 A E - 0 0 146 -2,-0.1 2,-0.2 2,-0.1 0, 0.0 0.536 55.6 -98.6 112.8 101.1 66.9 40.2 22.0 302 310 A P - 0 0 68 0, 0.0 -11,-0.2 0, 0.0 -2,-0.0 -0.138 28.6-139.6 -48.3 105.9 69.6 38.7 24.3 303 311 A L - 0 0 41 -13,-2.4 2,-0.6 -2,-0.2 -13,-0.4 -0.331 30.2-107.5 -62.9 148.4 72.9 40.1 24.1 304 312 A P - 0 0 99 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.820 38.2-171.7 -93.5 115.0 75.6 37.4 24.3 305 313 A V + 0 0 26 -2,-0.6 -47,-0.2 -50,-0.1 -48,-0.2 -0.871 23.2 168.7-107.1 131.6 77.6 37.2 27.6 306 314 A D S S+ 0 0 109 -2,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.366 75.5 0.6-116.5 -7.5 80.8 35.1 28.5 307 315 A S S > S- 0 0 42 1,-0.0 4,-0.9 -50,-0.0 -1,-0.3 -0.951 82.7 -90.5-167.8 174.8 81.6 36.8 31.8 308 316 A E H > S+ 0 0 5 -2,-0.3 4,-1.7 1,-0.2 12,-0.1 0.641 125.8 65.7 -69.2 -15.6 80.5 39.4 34.2 309 317 A K H > S+ 0 0 86 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.959 90.3 57.5 -69.1 -55.0 82.9 41.4 32.0 310 318 A D H > S+ 0 0 42 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.822 108.5 50.7 -47.3 -36.7 80.7 41.1 28.9 311 319 A I H >X S+ 0 0 0 -4,-0.9 4,-1.5 2,-0.2 3,-0.6 0.996 109.9 43.1 -65.9 -69.4 77.9 42.7 30.9 312 320 A F H 3< S+ 0 0 0 -4,-1.7 -2,-0.2 1,-0.3 3,-0.1 0.842 113.2 55.6 -38.7 -55.1 79.7 45.9 32.3 313 321 A D H >< S+ 0 0 78 -4,-2.3 3,-3.4 3,-0.3 -1,-0.3 0.884 102.9 57.2 -42.6 -57.2 81.3 46.4 28.9 314 322 A Y H << S+ 0 0 68 -4,-1.8 -1,-0.3 -3,-0.6 -2,-0.2 0.898 113.5 36.0 -43.3 -58.6 77.8 46.3 27.4 315 323 A I T 3< S- 0 0 0 -4,-1.5 -1,-0.3 -3,-0.1 -2,-0.2 0.303 118.4-119.7 -83.3 16.2 76.7 49.1 29.5 316 324 A Q < + 0 0 128 -3,-3.4 2,-0.3 -5,-0.3 -3,-0.3 0.959 61.1 144.9 46.7 84.4 80.2 50.5 29.1 317 325 A W - 0 0 63 -5,-0.0 2,-0.4 3,-0.0 -1,-0.2 -0.966 57.7 -81.5-149.0 166.1 81.2 50.6 32.7 318 326 A K - 0 0 124 -2,-0.3 2,-0.1 1,-0.1 -6,-0.0 -0.541 52.2-115.6 -69.5 117.5 84.0 50.1 35.2 319 327 A Y - 0 0 93 -2,-0.4 2,-0.6 1,-0.1 -1,-0.1 -0.370 33.2-142.9 -58.8 124.7 84.5 46.4 35.9 320 328 A R - 0 0 41 -12,-0.1 -1,-0.1 -2,-0.1 5,-0.1 -0.849 2.8-138.0-100.5 113.6 83.7 45.9 39.5 321 329 A E > - 0 0 128 -2,-0.6 3,-0.5 1,-0.1 4,-0.2 -0.253 35.8-109.9 -57.5 147.5 85.6 43.5 41.6 322 330 A P G > S+ 0 0 18 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 0.863 115.3 60.4 -56.4 -36.1 83.1 41.8 43.7 323 331 A K G > S+ 0 0 126 1,-0.3 3,-0.6 2,-0.1 -146,-0.1 0.913 105.1 49.8 -55.6 -44.8 84.1 43.4 46.9 324 332 A D G < S+ 0 0 60 -3,-0.5 -1,-0.3 1,-0.2 3,-0.2 0.310 81.1 94.9 -78.8 9.1 83.3 46.8 45.5 325 333 A R G < + 0 0 0 -3,-1.8 -1,-0.2 -4,-0.2 -55,-0.2 0.316 56.3 111.6 -80.3 7.9 79.9 45.7 44.3 326 334 A S < 0 0 64 -3,-0.6 -56,-0.5 1,-0.2 -57,-0.2 0.955 360.0 360.0 -48.3 -81.9 78.7 47.1 47.6 327 335 A E 0 0 157 -3,-0.2 -1,-0.2 -58,-0.1 -2,-0.1 0.155 360.0 360.0-123.3 360.0 76.6 50.1 46.6