==== 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 04-JAN-96 9ICL . 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) . 17907.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 221 67.6 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 . 29 8.9 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 . 19 5.8 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 . 1 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 . 1 1 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 0 219 0, 0.0 38,-0.1 0, 0.0 39,-0.1 0.000 360.0 360.0 360.0 -9.8 67.2 58.1 56.9 2 10 A T + 0 0 123 37,-0.1 4,-0.2 3,-0.0 37,-0.0 0.164 360.0 81.7-173.4 -7.6 67.1 59.0 60.6 3 11 A L S S+ 0 0 61 1,-0.2 42,-0.2 36,-0.1 4,-0.1 0.765 110.7 21.0 -83.9 -24.0 64.9 62.0 60.5 4 12 A N S > S+ 0 0 9 35,-0.1 4,-3.0 40,-0.1 5,-0.2 0.120 88.7 125.3-133.6 26.9 61.7 60.1 60.4 5 13 A G H > + 0 0 22 2,-0.2 4,-3.3 1,-0.2 5,-0.2 0.878 69.9 49.0 -47.4 -64.6 63.0 56.8 61.8 6 14 A G H > S+ 0 0 37 1,-0.3 4,-4.2 2,-0.2 5,-0.4 0.944 115.9 47.3 -46.4 -55.8 60.6 56.2 64.7 7 15 A I H > S+ 0 0 7 1,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.900 114.8 43.6 -54.7 -49.0 57.8 56.9 62.4 8 16 A T H X S+ 0 0 22 -4,-3.0 4,-1.5 1,-0.2 -1,-0.3 0.800 116.9 49.9 -69.8 -25.6 59.1 54.7 59.7 9 17 A D H X S+ 0 0 101 -4,-3.3 4,-2.6 -5,-0.2 -2,-0.2 0.944 110.7 44.5 -76.2 -46.9 59.9 52.1 62.3 10 18 A M H X S+ 0 0 6 -4,-4.2 4,-2.8 2,-0.2 5,-0.2 0.923 111.6 56.2 -60.9 -41.0 56.6 52.0 64.1 11 19 A L H X S+ 0 0 0 -4,-2.1 4,-3.1 -5,-0.4 -1,-0.2 0.898 107.6 48.8 -54.8 -44.9 54.9 52.0 60.7 12 20 A T H X S+ 0 0 59 -4,-1.5 4,-3.1 2,-0.2 5,-0.3 0.908 108.5 52.7 -64.7 -42.2 57.0 48.9 59.8 13 21 A E H X S+ 0 0 76 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.951 115.3 43.0 -55.2 -48.2 56.0 47.2 63.2 14 22 A L H X S+ 0 0 2 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.938 112.9 50.4 -60.3 -53.2 52.3 47.8 62.4 15 23 A A H X S+ 0 0 3 -4,-3.1 4,-1.5 1,-0.2 3,-0.4 0.949 110.8 51.2 -52.8 -52.5 52.6 46.8 58.8 16 24 A N H X S+ 0 0 87 -4,-3.1 4,-2.4 1,-0.2 5,-0.3 0.889 107.9 51.1 -53.2 -47.1 54.3 43.6 59.8 17 25 A F H X>S+ 0 0 38 -4,-2.3 4,-2.8 -5,-0.3 5,-1.5 0.916 103.3 57.3 -63.0 -37.7 51.8 42.7 62.2 18 26 A E H <5S+ 0 0 7 -4,-2.1 6,-0.3 -3,-0.4 -1,-0.2 0.937 114.1 40.3 -55.2 -45.0 48.8 43.1 59.9 19 27 A K H <5S+ 0 0 82 -4,-1.5 -1,-0.2 5,-0.2 -2,-0.2 0.872 122.6 37.7 -69.7 -46.4 50.3 40.7 57.6 20 28 A N H <5S+ 0 0 24 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.764 130.3 21.9 -81.0 -34.0 51.6 38.1 60.1 21 29 A V T <5S+ 0 0 32 -4,-2.8 -3,-0.2 -5,-0.3 -2,-0.1 0.817 130.6 28.7-101.2 -55.1 48.9 38.0 62.8 22 30 A S S + 0 0 26 -6,-0.3 4,-4.8 1,-0.2 5,-0.2 -0.063 10.7 160.4 -41.6 58.8 45.3 42.4 56.6 25 33 A I H > S+ 0 0 93 -2,-2.6 4,-3.1 1,-0.2 -1,-0.2 0.828 76.9 53.5 -53.9 -34.4 47.5 42.3 53.5 26 34 A H H > S+ 0 0 152 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.976 115.1 37.1 -66.7 -49.8 45.8 45.5 52.5 27 35 A K H > S+ 0 0 111 2,-0.3 4,-2.6 1,-0.2 5,-0.3 0.842 116.6 54.7 -64.1 -41.5 46.5 47.3 55.7 28 36 A Y H X S+ 0 0 32 -4,-4.8 4,-1.5 1,-0.3 -2,-0.2 0.979 108.6 45.5 -56.6 -56.8 49.7 45.6 55.8 29 37 A N H X S+ 0 0 80 -4,-3.1 4,-1.6 -5,-0.2 -1,-0.3 0.800 108.8 63.2 -53.8 -31.6 50.4 46.9 52.4 30 38 A A H >X S+ 0 0 32 -4,-1.3 4,-1.9 1,-0.2 3,-0.6 0.987 101.1 45.3 -60.9 -61.8 49.1 50.2 53.7 31 39 A Y H 3X S+ 0 0 12 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.787 109.4 64.4 -53.1 -28.3 51.8 50.9 56.4 32 40 A R H 3X S+ 0 0 145 -4,-1.5 4,-2.2 -5,-0.3 -1,-0.2 0.909 102.8 38.7 -66.6 -46.9 54.3 49.9 53.8 33 41 A K H X S+ 0 0 30 -4,-3.1 4,-2.1 -3,-0.4 3,-0.8 0.950 117.0 49.0 -73.2 -47.9 57.2 57.7 51.4 38 46 A I H 3< S+ 0 0 1 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.786 107.3 61.9 -58.8 -27.2 57.9 59.2 54.9 39 47 A A H 3< S+ 0 0 48 -4,-2.2 -1,-0.3 -5,-0.4 -2,-0.2 0.861 107.1 41.0 -63.3 -42.9 61.2 57.5 54.4 40 48 A K H << S+ 0 0 176 -4,-1.0 -2,-0.2 -3,-0.8 -1,-0.2 0.864 89.5 121.0 -74.3 -37.5 62.0 59.6 51.4 41 49 A Y < - 0 0 41 -4,-2.1 4,-0.1 1,-0.1 -38,-0.1 -0.057 57.2-145.5 -45.3 120.7 60.6 62.7 53.0 42 50 A P + 0 0 83 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.266 68.5 56.0 -64.0 -11.3 63.0 65.5 53.2 43 51 A H S S- 0 0 117 -39,-0.0 2,-0.9 -40,-0.0 -40,-0.0 -0.699 89.8 -89.6-128.1-176.7 61.9 67.2 56.5 44 52 A K - 0 0 124 -2,-0.2 2,-0.5 -40,-0.0 -40,-0.1 -0.831 43.5-132.1 -92.3 109.6 61.3 66.5 60.1 45 53 A I + 0 0 6 -2,-0.9 -38,-0.1 -42,-0.2 3,-0.1 -0.439 28.3 179.5 -62.7 112.3 57.7 65.4 60.3 46 54 A K + 0 0 155 -2,-0.5 2,-0.3 1,-0.1 -1,-0.2 0.536 57.6 3.8 -94.9 -4.8 56.4 67.5 63.1 47 55 A S > - 0 0 40 1,-0.2 4,-1.7 22,-0.0 5,-0.2 -0.998 68.9-102.4-166.9 171.3 52.8 66.3 63.1 48 56 A G H >> S+ 0 0 0 -2,-0.3 4,-3.4 1,-0.2 3,-0.6 0.983 114.9 54.5 -65.7 -55.6 50.2 64.1 61.7 49 57 A A H 3> S+ 0 0 67 1,-0.3 4,-0.8 2,-0.2 -1,-0.2 0.774 106.9 54.7 -50.0 -29.4 48.5 66.6 59.6 50 58 A E H 34 S+ 0 0 44 2,-0.2 -1,-0.3 1,-0.2 -2,-0.2 0.890 111.7 41.9 -70.9 -44.4 51.8 67.3 57.9 51 59 A A H X< S+ 0 0 0 -4,-1.7 3,-4.9 -3,-0.6 6,-0.2 0.903 103.6 66.4 -66.8 -43.9 52.3 63.7 57.1 52 60 A K H 3< S+ 0 0 90 -4,-3.4 -1,-0.2 1,-0.3 -2,-0.2 0.810 87.7 71.8 -43.3 -38.2 48.8 63.3 56.0 53 61 A K T 3< S+ 0 0 172 -4,-0.8 -1,-0.3 -5,-0.3 -2,-0.2 0.721 85.9 87.4 -54.3 -27.2 49.7 65.7 53.3 54 62 A L S X S- 0 0 33 -3,-4.9 3,-0.7 -4,-0.1 2,-0.2 -0.369 88.9-104.8 -79.9 161.2 51.7 62.9 51.9 55 63 A P T 3 S+ 0 0 98 0, 0.0 -18,-0.1 0, 0.0 3,-0.1 -0.504 110.8 30.7 -75.6 144.4 50.4 60.2 49.5 56 64 A G T 3 S+ 0 0 29 1,-0.2 2,-0.8 -2,-0.2 -22,-0.2 0.083 100.7 109.9 89.8 -27.8 49.9 56.9 51.2 57 65 A V < + 0 0 11 -3,-0.7 -1,-0.2 -6,-0.2 2,-0.1 -0.717 43.5 163.7 -94.2 115.0 49.1 58.9 54.2 58 66 A G > - 0 0 27 -2,-0.8 4,-1.9 -3,-0.1 5,-0.1 -0.327 52.0 -79.7-107.6-169.5 45.7 58.8 55.3 59 67 A T H > S+ 0 0 86 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.830 120.3 50.8 -66.1 -42.0 43.7 59.7 58.3 60 68 A K H > S+ 0 0 127 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.883 113.4 45.0 -70.0 -36.9 44.4 56.6 60.4 61 69 A I H > S+ 0 0 13 2,-0.2 4,-3.4 1,-0.2 5,-0.3 0.939 109.5 55.7 -69.1 -44.5 48.1 56.7 60.0 62 70 A A H X S+ 0 0 7 -4,-1.9 4,-2.2 1,-0.3 -2,-0.2 0.922 106.6 52.6 -49.6 -46.5 48.1 60.4 60.6 63 71 A E H X S+ 0 0 126 -4,-2.0 4,-2.0 1,-0.2 -1,-0.3 0.914 109.6 47.1 -54.5 -51.6 46.4 59.6 63.9 64 72 A K H X S+ 0 0 38 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.915 108.3 54.7 -61.6 -45.2 49.0 57.1 64.8 65 73 A I H X S+ 0 0 0 -4,-3.4 4,-2.4 1,-0.2 -1,-0.2 0.863 107.4 53.3 -59.3 -34.1 51.9 59.4 63.9 66 74 A D H X S+ 0 0 71 -4,-2.2 4,-4.4 -5,-0.3 -2,-0.2 0.981 107.8 46.8 -64.3 -53.7 50.4 62.0 66.2 67 75 A E H X S+ 0 0 71 -4,-2.0 4,-2.9 1,-0.2 6,-0.5 0.865 114.4 50.9 -53.8 -39.3 50.1 59.8 69.3 68 76 A F H < S+ 0 0 53 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.940 114.5 39.6 -69.0 -44.4 53.6 58.7 68.6 69 77 A L H < S+ 0 0 62 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.981 116.3 54.2 -66.4 -48.4 55.0 62.2 68.3 70 78 A A H < S+ 0 0 84 -4,-4.4 2,-0.3 -5,-0.2 -2,-0.2 0.885 126.4 9.8 -46.1 -53.6 52.8 63.2 71.2 71 79 A T S < S- 0 0 67 -4,-2.9 -1,-0.1 2,-0.4 0, 0.0 -0.920 84.2-106.4-129.1 153.1 54.1 60.5 73.5 72 80 A G S S+ 0 0 72 -2,-0.3 2,-0.3 2,-0.0 -4,-0.1 0.330 98.2 53.7 -64.5 14.7 57.1 58.1 73.1 73 81 A K - 0 0 83 -6,-0.5 -2,-0.4 -5,-0.1 2,-0.3 -0.908 66.4-139.7-147.2 176.7 54.7 55.4 72.5 74 82 A L > - 0 0 2 -2,-0.3 4,-2.1 1,-0.1 5,-0.1 -0.991 19.4-143.5-132.9 125.8 51.7 54.1 70.7 75 83 A R H > S+ 0 0 173 -2,-0.3 4,-3.4 1,-0.2 -1,-0.1 0.977 100.9 49.3 -58.6 -55.1 49.0 52.1 72.6 76 84 A K H > S+ 0 0 78 1,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.838 110.2 50.5 -50.0 -41.2 48.4 49.6 69.9 77 85 A L H > S+ 0 0 2 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.921 113.4 47.1 -67.3 -39.7 52.0 48.9 69.5 78 86 A E H X S+ 0 0 75 -4,-2.1 4,-0.7 2,-0.2 -2,-0.2 0.935 110.0 51.6 -67.7 -41.1 52.2 48.4 73.2 79 87 A K H >X S+ 0 0 138 -4,-3.4 4,-1.5 1,-0.2 3,-1.1 0.963 112.5 46.0 -56.7 -53.7 49.1 46.2 73.2 80 88 A I H 3< S+ 0 0 20 -4,-2.5 -1,-0.2 1,-0.2 7,-0.2 0.823 104.9 61.1 -55.2 -43.6 50.6 43.9 70.4 81 89 A R H 3< S+ 0 0 135 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.663 112.4 39.6 -61.7 -19.5 54.2 43.6 72.1 82 90 A Q H << S+ 0 0 140 -3,-1.1 -2,-0.2 -4,-0.7 -1,-0.1 0.927 87.8 101.7 -87.7 -72.1 52.5 42.0 75.1 83 91 A D X - 0 0 67 -4,-1.5 4,-1.9 1,-0.1 5,-0.1 0.291 62.9-145.8 -19.9 114.5 49.9 39.7 73.6 84 92 A D H > S+ 0 0 101 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.884 92.5 57.4 -61.4 -40.3 51.0 36.3 73.6 85 93 A T H > S+ 0 0 48 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.950 107.3 47.8 -54.9 -50.3 49.3 35.2 70.5 86 94 A S H > S+ 0 0 4 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.917 113.2 51.2 -54.4 -44.5 51.0 37.8 68.4 87 95 A S H X S+ 0 0 45 -4,-1.9 4,-1.3 1,-0.2 -1,-0.2 0.886 104.4 55.6 -61.5 -42.9 54.3 36.8 70.0 88 96 A S H X S+ 0 0 14 -4,-2.8 4,-2.8 1,-0.2 5,-0.3 0.871 105.9 50.5 -59.4 -39.1 53.9 33.2 69.3 89 97 A I H X S+ 0 0 4 -4,-1.8 4,-1.2 1,-0.2 -1,-0.2 0.807 107.2 53.2 -69.2 -36.6 53.4 33.7 65.7 90 98 A N H < S+ 0 0 70 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.808 115.8 43.2 -70.0 -23.5 56.5 35.8 65.4 91 99 A F H >< S+ 0 0 59 -4,-1.3 3,-2.1 2,-0.2 4,-0.3 0.908 109.3 49.5 -82.0 -54.9 58.4 33.0 67.1 92 100 A L H >< S+ 0 0 1 -4,-2.8 3,-2.9 1,-0.3 6,-0.2 0.894 102.2 67.8 -53.5 -41.5 57.2 29.9 65.4 93 101 A T T 3< S+ 0 0 41 -4,-1.2 -1,-0.3 1,-0.3 5,-0.3 0.719 82.7 74.0 -52.2 -25.8 57.8 31.6 62.2 94 102 A R T < S+ 0 0 118 -3,-2.1 2,-0.3 2,-0.1 -1,-0.3 0.724 76.3 94.5 -66.6 -19.5 61.5 31.4 63.0 95 103 A V S X S- 0 0 2 -3,-2.9 3,-2.4 -4,-0.3 2,-0.3 -0.609 90.4-112.0 -76.9 134.0 61.5 27.8 62.2 96 104 A S T 3 S+ 0 0 39 -2,-0.3 35,-0.4 1,-0.3 36,-0.2 -0.518 105.8 28.4 -64.9 121.7 62.5 27.1 58.7 97 105 A G T 3 S+ 0 0 33 -2,-0.3 2,-0.7 1,-0.2 -1,-0.3 0.254 96.3 101.5 108.9 -9.6 59.4 25.9 57.0 98 106 A I < + 0 0 7 -3,-2.4 -1,-0.2 -5,-0.3 -3,-0.1 -0.943 45.3 177.1-114.8 117.3 56.9 27.6 59.1 99 107 A G > - 0 0 32 -2,-0.7 4,-2.6 -3,-0.1 5,-0.1 -0.290 50.8 -87.2 -97.7-171.8 55.4 30.7 57.6 100 108 A P H > S+ 0 0 41 0, 0.0 4,-3.2 0, 0.0 5,-0.2 0.875 124.8 61.7 -64.8 -40.5 52.7 32.7 59.2 101 109 A S H > S+ 0 0 91 1,-0.2 4,-1.5 2,-0.2 3,-0.2 0.958 111.8 36.4 -51.5 -59.2 50.0 30.6 57.8 102 110 A A H > S+ 0 0 15 1,-0.2 4,-2.4 2,-0.2 5,-0.3 0.874 110.6 62.5 -61.9 -42.2 51.2 27.6 59.6 103 111 A A H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 5,-0.3 0.899 103.5 51.7 -53.4 -40.4 52.2 29.6 62.7 104 112 A R H X S+ 0 0 46 -4,-3.2 4,-2.5 -3,-0.2 5,-0.2 0.979 107.7 49.4 -60.3 -55.7 48.5 30.5 63.0 105 113 A K H < S+ 0 0 98 -4,-1.5 4,-0.5 1,-0.2 -2,-0.2 0.917 112.7 48.6 -48.0 -49.0 47.2 26.9 62.8 106 114 A F H >X>S+ 0 0 0 -4,-2.4 5,-3.6 1,-0.2 3,-1.0 0.909 110.3 49.2 -59.9 -45.3 49.7 25.8 65.5 107 115 A V H 3<5S+ 0 0 6 -4,-2.0 3,-0.5 1,-0.3 -1,-0.2 0.847 108.5 54.4 -65.6 -33.8 49.0 28.5 67.9 108 116 A D T 3<5S+ 0 0 123 -4,-2.5 -1,-0.3 -5,-0.3 -2,-0.2 0.638 107.7 48.9 -77.2 -8.3 45.5 27.8 67.5 109 117 A E T <45S- 0 0 115 -3,-1.0 -1,-0.3 -4,-0.5 -2,-0.2 0.484 127.2-101.7-102.4 -3.9 46.1 24.3 68.4 110 118 A G T <5S+ 0 0 35 -4,-0.6 2,-0.7 -3,-0.5 -3,-0.3 0.420 79.1 133.4 103.4 -0.8 48.1 25.4 71.3 111 119 A I < + 0 0 5 -5,-3.6 -1,-0.3 -6,-0.2 -2,-0.2 -0.767 14.7 143.3 -85.0 116.5 51.6 24.9 70.0 112 120 A K + 0 0 70 -2,-0.7 2,-0.3 -3,-0.1 -1,-0.2 0.374 52.0 47.9-131.6 -4.9 53.4 28.0 70.8 113 121 A T S > S- 0 0 57 -3,-0.1 4,-2.5 1,-0.1 5,-0.1 -0.814 84.3-100.2-135.9 176.9 56.8 26.9 71.7 114 122 A L H > S+ 0 0 38 -2,-0.3 4,-2.3 2,-0.2 5,-0.1 0.882 123.4 47.9 -61.2 -40.8 59.8 24.9 70.8 115 123 A E H > S+ 0 0 127 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.948 107.2 55.8 -66.2 -46.2 58.7 22.2 73.2 116 124 A D H > S+ 0 0 46 1,-0.3 4,-1.0 2,-0.2 -2,-0.2 0.911 108.2 50.4 -49.4 -46.7 55.3 22.3 71.9 117 125 A L H >< S+ 0 0 1 -4,-2.5 3,-1.2 1,-0.2 -1,-0.3 0.946 107.1 50.2 -61.2 -50.8 56.7 21.6 68.6 118 126 A R H >< S+ 0 0 130 -4,-2.3 3,-1.5 1,-0.3 -1,-0.2 0.885 108.3 55.0 -54.0 -43.8 58.8 18.7 69.6 119 127 A K H 3< S+ 0 0 156 -4,-2.8 -1,-0.3 1,-0.3 3,-0.2 0.707 114.6 41.1 -62.4 -22.4 55.8 17.1 71.3 120 128 A N T X< + 0 0 44 -3,-1.2 3,-1.0 -4,-1.0 -1,-0.3 -0.179 65.5 138.3-122.3 46.2 54.0 17.4 68.1 121 129 A E G X + 0 0 93 -3,-1.5 3,-1.3 1,-0.3 -1,-0.2 0.759 67.4 71.5 -59.2 -20.1 56.5 16.4 65.7 122 130 A D G 3 S+ 0 0 114 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.932 91.6 54.4 -61.1 -46.5 53.8 14.5 64.0 123 131 A K G < S+ 0 0 94 -3,-1.0 2,-0.3 -6,-0.1 -1,-0.3 0.425 95.3 85.8 -68.8 1.6 52.0 17.7 62.8 124 132 A L S < S- 0 0 5 -3,-1.3 2,-0.1 -4,-0.3 0, 0.0 -0.830 71.6-133.5-107.3 150.1 55.1 18.9 61.0 125 133 A N > - 0 0 79 -2,-0.3 4,-2.2 -28,-0.1 5,-0.2 -0.364 39.6 -88.6 -87.6 173.7 56.3 18.1 57.5 126 134 A H H > S+ 0 0 107 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.893 126.4 48.7 -48.0 -53.4 59.9 17.1 56.6 127 135 A H H > S+ 0 0 40 1,-0.3 4,-3.3 2,-0.2 -1,-0.2 0.969 114.8 46.1 -51.5 -56.5 61.1 20.7 55.9 128 136 A Q H > S+ 0 0 12 1,-0.3 4,-2.1 -31,-0.2 -1,-0.3 0.777 109.7 55.6 -56.2 -32.5 59.6 21.8 59.2 129 137 A R H X S+ 0 0 97 -4,-2.2 4,-2.8 2,-0.2 -1,-0.3 0.948 110.1 43.3 -69.7 -44.8 61.0 18.9 60.9 130 138 A I H X S+ 0 0 6 -4,-2.5 4,-3.0 1,-0.2 -2,-0.2 0.951 109.6 57.5 -61.9 -45.8 64.4 19.7 59.8 131 139 A G H < S+ 0 0 1 -4,-3.3 -1,-0.2 -35,-0.4 -35,-0.2 0.871 111.1 44.9 -49.8 -43.2 63.8 23.3 60.6 132 140 A L H >< S+ 0 0 10 -4,-2.1 3,-1.2 1,-0.2 4,-0.2 0.916 109.8 53.1 -68.7 -45.9 63.1 22.2 64.1 133 141 A K H 3< S+ 0 0 130 -4,-2.8 3,-0.2 1,-0.3 -2,-0.2 0.897 119.0 34.9 -57.7 -42.8 65.9 19.9 64.4 134 142 A Y T 3X S+ 0 0 17 -4,-3.0 4,-3.7 1,-0.2 5,-0.3 0.080 76.9 128.2-102.6 25.2 68.4 22.6 63.4 135 143 A F H <> S+ 0 0 23 -3,-1.2 4,-0.9 1,-0.2 -1,-0.2 0.891 80.3 39.5 -43.1 -54.7 66.8 25.6 65.0 136 144 A G H >> S+ 0 0 38 -4,-0.2 3,-2.2 -3,-0.2 4,-1.0 0.988 115.9 48.1 -62.4 -65.4 69.9 26.6 66.7 137 145 A D H >4 S+ 0 0 35 1,-0.3 3,-0.9 -4,-0.2 -2,-0.2 0.838 110.0 56.9 -43.3 -45.5 72.4 25.8 64.0 138 146 A F H 3< S+ 0 0 40 -4,-3.7 -1,-0.3 1,-0.2 -2,-0.2 0.686 103.6 50.7 -62.0 -24.7 70.2 27.7 61.5 139 147 A E H << S+ 0 0 98 -3,-2.2 -1,-0.2 -4,-0.9 2,-0.2 0.705 90.6 98.1 -87.2 -18.3 70.2 30.9 63.3 140 148 A K S << S- 0 0 102 -4,-1.0 -4,-0.0 -3,-0.9 -3,-0.0 -0.480 77.0-120.6 -71.6 130.4 74.0 31.0 63.6 141 149 A R - 0 0 152 -2,-0.2 40,-0.2 1,-0.1 -1,-0.1 -0.159 23.6-115.4 -65.7 168.2 75.8 33.1 61.2 142 150 A I E -A 180 0A 0 38,-4.0 38,-2.8 40,-0.1 2,-0.3 -0.899 23.5-140.6-109.1 109.1 78.4 31.5 58.9 143 151 A P E >> -A 179 0A 36 0, 0.0 3,-3.4 0, 0.0 4,-1.8 -0.509 15.7-127.8 -70.7 132.0 81.9 32.7 59.4 144 152 A R H 3> S+ 0 0 62 34,-2.9 4,-2.3 1,-0.3 5,-0.2 0.776 108.5 67.0 -47.0 -31.8 83.9 33.2 56.2 145 153 A E H 3> S+ 0 0 118 33,-0.4 4,-0.7 1,-0.2 -1,-0.3 0.801 107.9 38.9 -61.1 -28.0 86.6 31.1 57.6 146 154 A E H <> S+ 0 0 31 -3,-3.4 4,-2.9 2,-0.2 -2,-0.2 0.848 109.5 62.3 -84.3 -40.7 84.2 28.1 57.4 147 155 A M H X S+ 0 0 2 -4,-1.8 4,-4.2 1,-0.2 5,-0.3 0.876 101.2 51.4 -45.6 -52.0 82.8 29.3 54.1 148 156 A L H X S+ 0 0 74 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.882 110.3 48.9 -58.2 -45.1 86.2 28.9 52.4 149 157 A Q H X S+ 0 0 66 -4,-0.7 4,-1.7 -5,-0.2 -1,-0.2 0.943 114.9 45.9 -61.2 -45.3 86.4 25.3 53.7 150 158 A M H X S+ 0 0 2 -4,-2.9 4,-2.3 2,-0.2 3,-0.5 0.962 113.1 47.8 -58.8 -55.4 82.9 24.7 52.4 151 159 A Q H X S+ 0 0 59 -4,-4.2 4,-2.3 1,-0.3 5,-0.3 0.907 107.6 59.6 -55.2 -37.9 83.5 26.3 49.1 152 160 A D H X S+ 0 0 85 -4,-2.3 4,-1.3 -5,-0.3 -1,-0.3 0.891 108.6 43.0 -59.2 -39.8 86.7 24.3 49.0 153 161 A I H X S+ 0 0 39 -4,-1.7 4,-2.3 -3,-0.5 3,-0.3 0.987 111.8 48.5 -73.0 -54.9 84.8 21.1 49.2 154 162 A V H X S+ 0 0 2 -4,-2.3 4,-2.5 1,-0.3 5,-0.3 0.876 111.5 52.3 -50.4 -46.3 81.9 21.7 46.9 155 163 A L H X S+ 0 0 57 -4,-2.3 4,-1.6 -5,-0.3 -1,-0.3 0.878 108.8 48.9 -62.2 -40.6 84.2 23.0 44.2 156 164 A N H X S+ 0 0 82 -4,-1.3 4,-2.0 -3,-0.3 -1,-0.2 0.907 113.5 45.8 -66.1 -43.2 86.5 20.0 44.3 157 165 A E H X S+ 0 0 26 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.854 108.8 53.5 -69.6 -38.7 83.7 17.5 44.1 158 166 A V H X S+ 0 0 6 -4,-2.5 4,-1.6 -5,-0.3 7,-0.2 0.929 108.9 52.8 -62.1 -39.2 81.8 19.2 41.4 159 167 A K H >< S+ 0 0 134 -4,-1.6 3,-0.5 -5,-0.3 -2,-0.2 0.949 105.3 53.4 -59.6 -49.2 85.1 19.1 39.5 160 168 A K H 3< S+ 0 0 128 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.904 106.0 53.2 -50.8 -48.8 85.4 15.4 40.0 161 169 A V H 3< S- 0 0 49 -4,-2.0 2,-0.3 1,-0.2 -1,-0.2 0.793 132.7 -13.0 -58.0 -36.7 82.0 14.6 38.6 162 170 A D X< - 0 0 55 -4,-1.6 3,-1.3 -3,-0.5 -1,-0.2 -0.847 53.4-141.3-169.1 130.4 82.6 16.5 35.4 163 171 A S T 3 S+ 0 0 80 -2,-0.3 -3,-0.1 1,-0.3 -1,-0.1 0.700 99.0 66.9 -68.8 -20.8 85.3 18.9 34.4 164 172 A E T 3 S+ 0 0 109 -5,-0.1 -1,-0.3 -3,-0.1 2,-0.2 0.328 74.1 112.6 -81.3 2.4 82.9 20.9 32.5 165 173 A Y < - 0 0 19 -3,-1.3 2,-0.5 -7,-0.2 24,-0.2 -0.509 50.1-158.5 -77.4 151.9 80.9 22.1 35.5 166 174 A I E +B 188 0B 47 22,-2.0 22,-1.7 -2,-0.2 2,-0.4 -0.951 15.4 176.1-133.2 111.6 81.1 25.6 36.5 167 175 A A E +B 187 0B 25 -2,-0.5 2,-0.3 20,-0.2 20,-0.2 -0.884 7.0 179.1-121.2 152.2 80.2 26.6 40.0 168 176 A T E -B 186 0B 29 18,-1.7 18,-3.4 -2,-0.4 2,-1.0 -0.991 24.5-138.8-149.3 136.1 80.2 29.8 41.9 169 177 A V E +B 185 0B 9 -2,-0.3 16,-0.2 16,-0.2 -2,-0.0 -0.829 32.3 178.3-100.0 106.0 79.4 30.8 45.3 170 178 A C + 0 0 2 14,-1.7 3,-0.4 -2,-1.0 14,-0.4 0.094 32.6 80.0 -85.6-157.5 77.6 34.0 45.1 171 179 A G S >> S- 0 0 20 93,-0.3 3,-1.4 1,-0.2 4,-0.8 -0.261 106.1 -45.8 84.9-176.6 76.1 36.0 48.0 172 180 A S T 34 S+ 0 0 27 1,-0.3 -1,-0.2 2,-0.2 93,-0.1 0.723 131.0 72.8 -61.0 -24.1 78.0 38.3 50.3 173 181 A F T >4 S+ 0 0 11 -3,-0.4 3,-0.7 1,-0.3 -1,-0.3 0.861 101.0 45.5 -52.6 -40.7 80.6 35.6 50.6 174 182 A R T <4 S+ 0 0 53 -3,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.693 107.2 56.0 -71.6 -36.1 81.4 36.7 47.2 175 183 A R T 3< S- 0 0 66 -4,-0.8 2,-0.7 90,-0.1 -1,-0.2 0.097 125.9 -93.0 -88.7 19.5 81.3 40.5 47.9 176 184 A G < + 0 0 33 -3,-0.7 147,-0.1 1,-0.2 -3,-0.1 -0.613 67.0 162.8 107.7 -71.8 83.9 40.1 50.7 177 185 A A - 0 0 36 -2,-0.7 -1,-0.2 1,-0.1 3,-0.1 0.705 40.1-136.9 11.5 124.3 81.6 39.6 53.8 178 186 A E S S+ 0 0 141 1,-0.1 -34,-2.9 -35,-0.1 -33,-0.4 0.628 84.4 6.0 -71.6 -17.3 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,-0.1 -0.976 66.4-159.3-160.1 159.2 80.2 36.0 57.7 180 188 A S E -A 142 0A 4 -38,-2.8 -38,-4.0 -2,-0.3 3,-0.1 -0.936 25.8-128.9-143.8 165.9 77.0 34.9 56.0 181 189 A G S S- 0 0 33 -2,-0.3 65,-0.4 -40,-0.2 2,-0.3 0.843 86.5 -7.6 -79.1 -40.1 73.6 33.3 56.7 182 190 A D S S- 0 0 77 63,-0.1 2,-0.6 -40,-0.1 -1,-0.2 -0.940 70.4 -97.0-152.6 171.2 73.8 30.5 54.1 183 191 A M E - c 0 247B 1 63,-2.2 65,-2.6 -2,-0.3 2,-0.7 -0.863 30.3-170.4-101.8 119.1 75.7 29.0 51.1 184 192 A D E - c 0 248B 25 -2,-0.6 -14,-1.7 -14,-0.4 2,-0.5 -0.832 4.1-172.5-109.5 95.9 74.4 29.9 47.6 185 193 A V E -Bc 169 249B 2 63,-2.9 65,-2.1 -2,-0.7 2,-0.4 -0.758 8.0-156.5 -94.9 127.2 76.0 27.9 44.8 186 194 A L E -Bc 168 250B 2 -18,-3.4 -18,-1.7 -2,-0.5 2,-0.4 -0.814 19.3-170.2 -95.8 132.1 75.3 28.9 41.1 187 195 A L E +Bc 167 251B 1 63,-3.0 65,-2.9 -2,-0.4 2,-0.3 -0.976 17.5 152.6-137.6 145.1 75.8 26.2 38.7 188 196 A T E -Bc 166 252B 0 -22,-1.7 -22,-2.0 -2,-0.4 5,-0.1 -0.861 18.7-156.4-147.3 178.2 75.9 25.6 35.0 189 197 A H E > - c 0 253B 13 63,-0.6 3,-1.8 3,-0.4 65,-0.7 -0.935 31.0-117.7-161.0 140.9 77.3 23.3 32.4 190 198 A P T 3 S+ 0 0 58 0, 0.0 65,-0.1 0, 0.0 64,-0.1 0.849 113.7 60.1 -48.0 -44.2 78.1 23.9 28.7 191 199 A S T 3 S+ 0 0 61 1,-0.1 2,-0.4 -27,-0.1 11,-0.1 0.166 96.7 74.9 -74.3 16.1 75.7 21.2 27.8 192 200 A F < + 0 0 15 -3,-1.8 62,-4.0 60,-0.1 -3,-0.4 -0.935 63.0 131.2-137.8 114.9 72.8 23.1 29.5 193 201 A T - 0 0 35 -2,-0.4 3,-0.1 60,-0.3 5,-0.1 -0.995 63.6 -65.8-162.7 167.4 71.2 26.1 28.0 194 202 A S S S+ 0 0 70 -2,-0.3 -1,-0.0 1,-0.3 62,-0.0 0.554 128.7 18.9 -12.9 -59.9 68.3 28.3 27.0 195 203 A E S S+ 0 0 165 2,-0.1 -1,-0.3 3,-0.0 3,-0.0 0.839 96.7 108.3 -89.6 -43.3 67.0 26.0 24.2 196 204 A S S S- 0 0 39 1,-0.2 2,-1.3 -3,-0.1 3,-0.1 -0.030 77.8-120.0 -39.2 123.5 68.7 22.7 25.2 197 205 A T - 0 0 129 1,-0.1 -1,-0.2 -5,-0.1 -2,-0.1 -0.646 52.8 -71.3 -84.0 104.5 66.0 20.5 26.5 198 206 A K - 0 0 89 -2,-1.3 -1,-0.1 1,-0.1 -5,-0.1 0.598 32.2-162.2 37.0 171.3 66.8 19.7 30.0 199 207 A Q + 0 0 76 25,-0.2 4,-0.5 -3,-0.1 3,-0.3 -0.308 11.0 175.3 172.4 85.2 69.3 17.6 31.8 200 208 A P S >> S+ 0 0 46 0, 0.0 4,-2.5 0, 0.0 3,-1.0 0.819 79.7 65.0 -68.0 -38.8 68.2 16.9 35.3 201 209 A K H 3> S+ 0 0 111 1,-0.3 4,-3.5 2,-0.2 5,-0.4 0.830 87.4 73.6 -54.9 -33.2 71.1 14.7 36.0 202 210 A L H 3> S+ 0 0 3 -3,-0.3 4,-0.6 1,-0.2 -1,-0.3 0.902 111.0 25.9 -47.6 -52.3 73.1 17.8 35.5 203 211 A L H <> S+ 0 0 0 -3,-1.0 4,-1.4 -4,-0.5 -1,-0.2 0.831 121.8 55.2 -82.1 -36.6 72.0 18.9 39.0 204 212 A H H X S+ 0 0 38 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.784 99.5 61.0 -69.6 -29.3 71.2 15.5 40.5 205 213 A Q H X S+ 0 0 72 -4,-3.5 4,-1.8 -5,-0.2 -1,-0.2 0.928 107.1 43.6 -66.7 -42.0 74.6 14.1 39.9 206 214 A V H X S+ 0 0 2 -4,-0.6 4,-2.6 -5,-0.4 5,-0.2 0.881 109.6 55.3 -70.2 -36.3 76.4 16.7 42.0 207 215 A V H X S+ 0 0 0 -4,-1.4 4,-1.9 1,-0.2 9,-0.2 0.956 108.4 49.9 -57.3 -47.2 74.0 16.5 44.8 208 216 A E H X S+ 0 0 111 -4,-1.6 4,-2.5 1,-0.2 -1,-0.2 0.888 107.6 52.3 -56.9 -46.7 74.5 13.0 45.1 209 217 A Q H X S+ 0 0 28 -4,-1.8 4,-2.4 1,-0.2 5,-0.2 0.962 107.2 53.5 -60.8 -43.4 78.2 13.3 45.1 210 218 A L H <>S+ 0 0 0 -4,-2.6 5,-3.2 1,-0.3 6,-1.1 0.870 111.3 45.6 -59.2 -35.2 78.0 15.8 47.9 211 219 A Q H ><5S+ 0 0 70 -4,-1.9 3,-0.9 3,-0.2 -1,-0.3 0.854 105.2 63.9 -74.9 -33.7 76.0 13.4 49.9 212 220 A K H 3<5S+ 0 0 137 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.2 0.980 109.6 36.6 -52.3 -62.7 78.4 10.7 49.0 213 221 A V T 3<5S- 0 0 55 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.474 119.8-111.3 -71.6 -0.7 81.1 12.3 50.8 214 222 A H T < 5S+ 0 0 142 -3,-0.9 -3,-0.2 -5,-0.2 18,-0.1 0.831 82.1 120.6 77.4 33.0 78.8 13.5 53.5 215 223 A F < + 0 0 5 -5,-3.2 17,-2.4 1,-0.2 2,-0.5 0.851 68.4 54.9 -92.1 -44.3 78.8 17.1 52.9 216 224 A I E +D 231 0B 6 -6,-1.1 15,-0.3 15,-0.3 -1,-0.2 -0.824 65.2 179.8 -90.6 128.1 75.1 17.4 52.3 217 225 A T E + 0 0 50 13,-4.0 2,-0.3 -2,-0.5 14,-0.2 0.730 57.5 7.1 -99.9 -34.0 73.2 16.0 55.2 218 226 A D E -D 230 0B 26 12,-0.9 12,-1.4 -88,-0.0 2,-0.5 -0.951 62.7-122.7-147.4 165.7 69.5 16.5 54.4 219 227 A T E +D 229 0B 32 -2,-0.3 10,-0.2 10,-0.2 3,-0.1 -0.945 21.3 173.2-116.0 130.8 67.2 17.5 51.7 220 228 A L E S- 0 0 16 8,-2.9 2,-0.3 -2,-0.5 9,-0.2 0.804 80.1 -11.4 -98.4 -48.9 64.7 20.4 52.1 221 229 A S E -D 228 0B 54 7,-2.0 7,-3.5 -94,-0.1 2,-0.5 -0.913 58.7-167.5-158.9 127.8 63.7 20.3 48.6 222 230 A K E +D 227 0B 95 -2,-0.3 5,-0.2 5,-0.2 2,-0.1 -0.878 21.7 153.4-120.0 106.7 65.0 18.7 45.4 223 231 A G - 0 0 34 3,-2.7 -2,-0.0 -2,-0.5 -20,-0.0 -0.319 58.7 -84.9-112.2-161.3 63.8 19.8 42.0 224 232 A E S S+ 0 0 96 1,-0.1 -21,-0.3 -2,-0.1 -25,-0.2 0.557 121.5 11.3 -88.5 1.4 65.2 19.7 38.6 225 233 A T S S+ 0 0 49 1,-0.4 26,-3.2 -22,-0.1 2,-0.4 0.522 122.5 54.9-145.2 -13.3 67.0 22.9 38.8 226 234 A K E - E 0 250B 104 24,-0.2 -3,-2.7 2,-0.0 2,-0.4 -0.998 54.5-173.0-133.1 131.8 67.0 24.0 42.4 227 235 A F E -DE 222 249B 0 22,-2.3 22,-2.2 -2,-0.4 2,-0.5 -0.993 5.2-165.3-125.9 130.6 68.0 22.1 45.3 228 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-0.233 31.8 135.7-112.7-159.3 64.5 42.7 23.2 301 309 A E - 0 0 146 -2,-0.1 2,-0.1 -10,-0.1 0, 0.0 0.605 56.3-102.0 110.1 99.0 67.1 40.3 22.0 302 310 A P - 0 0 74 0, 0.0 -11,-0.2 0, 0.0 -2,-0.0 -0.102 28.0-138.8 -46.1 108.9 69.7 38.7 24.4 303 311 A L B -G 290 0C 40 -13,-3.2 2,-0.6 1,-0.1 -13,-0.5 -0.482 30.4-107.9 -69.9 143.3 73.0 40.2 24.2 304 312 A P - 0 0 97 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.784 37.6-173.0 -90.6 116.1 75.7 37.5 24.4 305 313 A V + 0 0 26 -2,-0.6 -48,-0.2 -50,-0.1 -47,-0.2 -0.849 23.5 169.6-107.3 131.9 77.7 37.3 27.6 306 314 A D S S+ 0 0 115 -2,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.343 76.3 0.2-118.2 -6.1 80.8 35.0 28.4 307 315 A S S > S- 0 0 43 1,-0.0 4,-1.0 -50,-0.0 -1,-0.3 -0.959 81.7 -89.8-171.5 172.7 81.7 36.7 31.8 308 316 A E H > S+ 0 0 5 -2,-0.3 4,-1.5 1,-0.2 12,-0.1 0.681 123.7 63.3 -65.2 -21.8 80.7 39.4 34.2 309 317 A K H > S+ 0 0 89 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.970 92.8 58.1 -66.1 -59.3 83.0 41.5 32.1 310 318 A D H > S+ 0 0 46 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.784 105.8 53.3 -41.5 -41.6 80.9 41.3 29.0 311 319 A I H X S+ 0 0 0 -4,-1.0 4,-1.5 2,-0.2 3,-0.4 0.986 109.2 42.5 -60.7 -67.5 78.0 42.8 30.9 312 320 A F H < S+ 0 0 0 -4,-1.5 3,-0.5 1,-0.2 4,-0.4 0.887 111.8 57.7 -43.1 -54.8 79.7 46.0 32.3 313 321 A D H >< S+ 0 0 73 -4,-2.2 3,-2.0 1,-0.3 -1,-0.2 0.883 102.9 55.1 -41.4 -55.5 81.3 46.5 28.9 314 322 A Y H 3< S+ 0 0 71 -4,-1.7 -1,-0.3 -3,-0.4 -2,-0.2 0.878 114.3 36.7 -46.7 -52.9 77.9 46.5 27.3 315 323 A I T 3< S- 0 0 0 -4,-1.5 -1,-0.3 -3,-0.5 -2,-0.2 0.390 118.8-121.1 -84.7 6.0 76.7 49.2 29.5 316 324 A Q < + 0 0 121 -3,-2.0 2,-0.3 -4,-0.4 -3,-0.3 0.958 60.3 137.9 52.4 90.4 80.1 50.6 29.2 317 325 A W - 0 0 67 3,-0.0 2,-0.4 0, 0.0 -1,-0.2 -0.977 59.7 -76.3-157.2 167.1 81.3 50.7 32.8 318 326 A K - 0 0 127 -2,-0.3 2,-0.2 1,-0.1 -6,-0.0 -0.540 52.7-114.2 -70.1 121.0 84.1 50.1 35.2 319 327 A Y - 0 0 96 -2,-0.4 2,-0.7 1,-0.1 -1,-0.1 -0.387 35.5-141.6 -61.0 124.7 84.6 46.4 35.8 320 328 A R - 0 0 38 -2,-0.2 -1,-0.1 -12,-0.1 5,-0.1 -0.817 3.9-138.1 -98.3 117.8 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