==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE, LYASE/DNA 07-MAY-13 4KLG . COMPND 2 MOLECULE: 5'-D(*CP*CP*GP*AP*CP*GP*GP*CP*GP*CP*AP*TP*CP*AP*G . SOURCE 2 SYNTHETIC: YES; . AUTHOR B.D.FREUDENTHAL,W.A.BEARD,D.D.SHOCK,S.H.WILSON . 326 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17581.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 227 69.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 32 9.8 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 . 3 0.9 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 . 35 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 124 38.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.1 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 1 1 1 2 2 1 1 0 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 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 PARALLEL BRIDGES PER LADDER . 2 1 1 0 2 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 10 A T > 0 0 173 0, 0.0 3,-0.7 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 72.8 9.3 -15.2 11.4 2 11 A L T 3 + 0 0 99 36,-0.2 3,-0.2 38,-0.2 36,-0.1 0.746 360.0 33.8 -71.8 -25.1 11.3 -17.8 9.4 3 12 A N T 3> S+ 0 0 13 35,-0.1 4,-2.4 1,-0.1 3,-0.3 -0.071 73.7 134.2-126.3 32.7 14.4 -15.6 9.9 4 13 A G H <> S+ 0 0 20 -3,-0.7 4,-2.5 1,-0.2 5,-0.2 0.813 71.0 57.6 -53.3 -39.2 13.9 -14.1 13.3 5 14 A G H > S+ 0 0 36 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.947 111.1 42.1 -58.3 -49.1 17.4 -14.8 14.4 6 15 A I H > S+ 0 0 5 -3,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.925 114.4 49.3 -64.0 -46.1 18.9 -12.9 11.5 7 16 A T H X S+ 0 0 21 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.889 109.9 52.4 -68.0 -33.0 16.5 -10.0 11.7 8 17 A D H X S+ 0 0 113 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.919 109.3 50.0 -63.8 -43.1 17.1 -9.6 15.4 9 18 A M H X S+ 0 0 7 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.923 111.4 47.9 -59.6 -46.6 20.9 -9.5 14.8 10 19 A L H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.873 110.0 52.3 -67.1 -34.7 20.5 -6.8 12.2 11 20 A T H X S+ 0 0 56 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.899 109.0 49.8 -66.7 -39.7 18.2 -4.7 14.4 12 21 A E H X S+ 0 0 66 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.905 111.5 49.3 -66.0 -40.0 20.7 -4.8 17.2 13 22 A L H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.929 110.2 51.6 -60.0 -46.7 23.4 -3.7 14.8 14 23 A A H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.921 109.4 49.3 -55.3 -48.4 21.1 -0.9 13.6 15 24 A N H X S+ 0 0 64 -4,-2.5 4,-2.9 1,-0.2 5,-0.4 0.872 109.6 51.6 -62.4 -37.3 20.5 0.3 17.1 16 25 A F H X>S+ 0 0 24 -4,-1.9 4,-2.3 2,-0.2 5,-2.0 0.939 110.6 48.7 -64.4 -45.7 24.2 0.3 17.9 17 26 A E H <>S+ 0 0 10 -4,-2.5 6,-3.0 3,-0.2 5,-0.7 0.910 118.3 39.7 -61.0 -42.0 24.9 2.4 14.7 18 27 A K H <5S+ 0 0 80 -4,-2.5 -2,-0.2 4,-0.2 -1,-0.2 0.960 125.9 32.2 -70.2 -50.3 22.2 4.9 15.6 19 28 A N H <5S+ 0 0 12 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.845 133.9 19.0 -82.2 -36.7 22.7 5.1 19.4 20 29 A V T <5S+ 0 0 13 -4,-2.3 -3,-0.2 -5,-0.4 -4,-0.1 0.875 131.7 34.5-103.5 -54.2 26.4 4.6 19.8 21 30 A S T - 0 0 25 -6,-3.0 4,-2.5 1,-0.1 3,-0.4 -0.818 24.6-178.9-116.8 90.1 25.8 6.7 11.9 24 33 A I H > S+ 0 0 85 -2,-0.6 4,-2.0 1,-0.3 -1,-0.1 0.738 79.3 52.2 -69.0 -25.3 22.3 7.3 10.6 25 34 A H H > S+ 0 0 151 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.838 110.6 48.0 -80.3 -31.6 22.9 5.9 7.1 26 35 A K H > S+ 0 0 119 -3,-0.4 4,-2.8 2,-0.2 5,-0.2 0.912 110.2 53.2 -69.5 -43.5 24.2 2.7 8.6 27 36 A Y H X S+ 0 0 25 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.952 112.2 44.6 -51.3 -51.2 21.2 2.6 10.9 28 37 A N H X S+ 0 0 36 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.885 111.2 53.7 -66.2 -37.5 18.9 2.9 7.9 29 38 A A H X S+ 0 0 48 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.924 110.3 46.6 -61.3 -46.7 20.9 0.3 5.9 30 39 A Y H X S+ 0 0 25 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.918 113.4 48.5 -62.7 -42.3 20.6 -2.3 8.7 31 40 A R H X S+ 0 0 55 -4,-2.2 4,-1.9 -5,-0.2 -1,-0.2 0.832 110.1 52.0 -68.5 -33.0 16.9 -1.6 9.1 32 41 A K H X S+ 0 0 99 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.916 111.5 47.0 -68.0 -44.1 16.3 -1.8 5.4 33 42 A A H X S+ 0 0 0 -4,-2.2 4,-2.3 22,-0.3 5,-0.2 0.911 111.6 50.3 -62.4 -43.5 18.1 -5.2 5.2 34 43 A A H X S+ 0 0 8 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.909 111.1 50.3 -61.9 -40.0 16.2 -6.5 8.3 35 44 A S H X S+ 0 0 10 -4,-1.9 4,-1.1 2,-0.2 -2,-0.2 0.911 111.0 46.6 -66.9 -43.9 12.9 -5.5 6.7 36 45 A V H X S+ 0 0 15 -4,-2.2 4,-0.8 1,-0.2 3,-0.2 0.884 114.8 47.7 -67.7 -36.4 13.6 -7.1 3.3 37 46 A I H >< S+ 0 0 0 -4,-2.3 3,-0.5 1,-0.2 -2,-0.2 0.884 105.1 60.6 -69.6 -37.5 14.7 -10.3 5.1 38 47 A A H 3< S+ 0 0 66 -4,-2.4 -36,-0.2 1,-0.2 -1,-0.2 0.807 109.0 41.5 -62.3 -29.7 11.7 -10.3 7.3 39 48 A K H 3< S+ 0 0 133 -4,-1.1 -1,-0.2 -3,-0.2 -2,-0.2 0.630 85.1 113.4 -94.1 -12.9 9.3 -10.6 4.4 40 49 A Y << - 0 0 50 -4,-0.8 -38,-0.2 -3,-0.5 -37,-0.1 -0.414 63.9-143.9 -59.9 124.9 11.4 -13.1 2.5 41 50 A P S S+ 0 0 95 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.247 70.9 74.2 -86.8 13.6 9.2 -16.3 2.4 42 51 A H S S- 0 0 108 -39,-0.0 2,-0.6 0, 0.0 -40,-0.1 -0.925 86.8-109.3-121.6 151.2 12.1 -18.8 2.8 43 52 A K - 0 0 148 -2,-0.3 2,-0.2 1,-0.1 -40,-0.1 -0.697 47.1-118.1 -72.8 118.6 14.3 -19.8 5.7 44 53 A I - 0 0 2 -2,-0.6 3,-0.1 1,-0.1 -1,-0.1 -0.446 32.6-177.8 -70.1 127.4 17.6 -18.4 4.7 45 54 A K + 0 0 167 -2,-0.2 2,-0.3 1,-0.2 -1,-0.1 0.596 62.6 4.6 -98.6 -18.2 20.4 -21.0 4.3 46 55 A S > - 0 0 40 1,-0.1 4,-1.8 22,-0.0 -1,-0.2 -0.993 67.1-107.2-160.6 164.2 23.3 -18.7 3.4 47 56 A G H > S+ 0 0 0 -2,-0.3 4,-2.8 2,-0.2 5,-0.2 0.900 117.4 56.3 -60.0 -43.6 24.7 -15.2 3.1 48 57 A A H > S+ 0 0 64 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.910 105.3 51.6 -58.0 -43.5 24.8 -15.6 -0.7 49 58 A E H >4 S+ 0 0 37 1,-0.2 3,-0.8 2,-0.2 4,-0.2 0.926 113.4 44.8 -58.5 -45.6 21.1 -16.4 -0.7 50 59 A A H >< S+ 0 0 0 -4,-1.8 3,-2.3 1,-0.2 -2,-0.2 0.870 101.7 67.0 -65.7 -36.2 20.4 -13.3 1.4 51 60 A K H 3< S+ 0 0 101 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.691 88.0 68.0 -63.0 -17.1 22.7 -11.1 -0.8 52 61 A K T << S+ 0 0 178 -3,-0.8 -1,-0.3 -4,-0.7 -2,-0.2 0.689 83.8 91.0 -72.9 -17.2 20.3 -11.5 -3.7 53 62 A L S X S- 0 0 23 -3,-2.3 3,-1.8 -4,-0.2 2,-0.3 -0.605 92.4-105.8 -81.0 139.4 17.8 -9.4 -1.8 54 63 A P T 3 S+ 0 0 100 0, 0.0 3,-0.1 0, 0.0 -18,-0.1 -0.486 107.2 26.7 -68.7 124.9 17.9 -5.7 -2.4 55 64 A G T 3 S+ 0 0 40 -2,-0.3 2,-0.6 1,-0.3 -22,-0.3 0.163 96.2 103.9 105.7 -15.1 19.5 -3.9 0.6 56 65 A V < + 0 0 8 -3,-1.8 -1,-0.3 -6,-0.2 2,-0.1 -0.900 51.4 171.5 -98.8 117.9 21.6 -6.9 1.6 57 66 A G > - 0 0 33 -2,-0.6 4,-2.3 -3,-0.1 5,-0.2 -0.270 47.5 -70.4-112.3-160.6 25.2 -6.4 0.6 58 67 A T H > S+ 0 0 86 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.906 125.6 46.7 -62.3 -46.8 28.6 -8.1 1.0 59 68 A K H > S+ 0 0 133 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.909 114.5 46.1 -68.2 -43.3 29.1 -7.2 4.7 60 69 A I H > S+ 0 0 15 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.914 109.9 54.7 -66.1 -40.0 25.6 -8.2 5.8 61 70 A A H X S+ 0 0 7 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.892 108.3 50.2 -58.3 -39.3 25.9 -11.5 3.8 62 71 A E H X S+ 0 0 111 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.899 110.0 49.2 -64.5 -40.8 29.2 -12.2 5.7 63 72 A K H X S+ 0 0 28 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.873 109.1 53.5 -67.3 -36.0 27.5 -11.5 9.1 64 73 A I H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.892 107.0 51.2 -65.2 -40.4 24.7 -13.8 8.1 65 74 A D H X S+ 0 0 77 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.927 111.1 48.3 -61.7 -46.0 27.2 -16.6 7.3 66 75 A E H X S+ 0 0 40 -4,-2.2 4,-2.5 1,-0.2 6,-0.5 0.920 113.6 47.6 -57.9 -43.3 28.8 -16.1 10.7 67 76 A F H X S+ 0 0 43 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.871 110.7 49.5 -70.0 -37.3 25.4 -16.2 12.4 68 77 A L H < S+ 0 0 72 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.893 115.3 45.7 -67.7 -37.8 24.1 -19.3 10.6 69 78 A A H < S+ 0 0 83 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.940 132.7 13.0 -68.0 -50.1 27.3 -21.1 11.5 70 79 A T H < S- 0 0 75 -4,-2.5 -3,-0.2 2,-0.3 -2,-0.2 0.615 91.3-122.1-109.8 -18.8 27.6 -20.2 15.1 71 80 A G S < S+ 0 0 48 -4,-1.9 2,-0.3 -5,-0.5 -4,-0.2 0.576 86.2 64.4 82.8 10.2 24.3 -18.7 16.2 72 81 A K S S- 0 0 88 -6,-0.5 2,-0.5 -63,-0.0 -2,-0.3 -0.949 74.6-124.7-154.0 171.1 26.0 -15.5 17.2 73 82 A L >> - 0 0 3 -2,-0.3 4,-2.5 1,-0.1 3,-0.7 -0.976 10.0-151.7-127.6 114.4 28.0 -12.5 16.0 74 83 A R H 3> S+ 0 0 170 -2,-0.5 4,-2.3 1,-0.3 5,-0.2 0.882 98.3 60.4 -50.4 -41.4 31.4 -11.8 17.6 75 84 A K H 3> S+ 0 0 85 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.904 110.2 40.6 -53.4 -45.0 30.9 -8.1 16.8 76 85 A L H <> S+ 0 0 2 -3,-0.7 4,-2.8 2,-0.2 5,-0.2 0.885 108.5 59.6 -73.8 -39.0 27.7 -8.0 18.9 77 86 A E H X S+ 0 0 69 -4,-2.5 4,-1.0 1,-0.2 -2,-0.2 0.899 109.7 45.5 -56.6 -38.4 29.2 -10.2 21.7 78 87 A K H >X S+ 0 0 155 -4,-2.3 4,-1.0 -5,-0.2 3,-0.6 0.937 110.5 51.9 -68.5 -47.4 31.8 -7.5 22.1 79 88 A I H >< S+ 0 0 15 -4,-1.9 3,-0.7 1,-0.3 7,-0.2 0.891 107.6 53.3 -56.9 -41.1 29.4 -4.6 21.9 80 89 A R H 3< S+ 0 0 118 -4,-2.8 -1,-0.3 1,-0.2 -2,-0.2 0.817 108.0 50.8 -63.2 -31.5 27.3 -6.2 24.6 81 90 A Q H << S+ 0 0 156 -4,-1.0 2,-0.6 -3,-0.6 -1,-0.2 0.639 88.1 99.6 -82.0 -15.7 30.3 -6.5 26.9 82 91 A D S+ 0 0 121 -2,-0.6 4,-2.8 1,-0.2 5,-0.2 0.913 90.2 48.0 -61.1 -49.1 30.1 -0.8 29.4 84 93 A T H > S+ 0 0 61 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.918 115.7 44.5 -61.5 -43.7 30.0 2.6 27.6 85 94 A S H > S+ 0 0 8 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.915 113.5 51.0 -66.4 -42.1 28.0 1.2 24.7 86 95 A S H X S+ 0 0 45 -4,-2.6 4,-2.1 -7,-0.2 -2,-0.2 0.924 111.6 47.5 -60.6 -46.7 25.7 -0.7 27.0 87 96 A S H X S+ 0 0 15 -4,-2.8 4,-2.6 2,-0.2 -1,-0.2 0.929 112.6 48.1 -60.1 -49.5 24.9 2.4 29.0 88 97 A I H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.926 110.4 51.7 -60.5 -46.1 24.3 4.6 26.0 89 98 A N H < S+ 0 0 42 -4,-2.6 4,-0.4 1,-0.2 -1,-0.2 0.903 111.8 48.4 -58.0 -41.1 22.0 2.0 24.5 90 99 A F H >< S+ 0 0 49 -4,-2.1 3,-1.9 -5,-0.2 4,-0.2 0.953 108.6 51.0 -64.5 -51.4 20.0 1.8 27.7 91 100 A L H >< S+ 0 0 0 -4,-2.6 3,-1.9 1,-0.3 6,-0.2 0.834 100.8 62.6 -58.3 -35.8 19.6 5.5 28.2 92 101 A T T 3< S+ 0 0 26 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.635 86.4 75.5 -67.5 -10.8 18.3 6.1 24.7 93 102 A R T < S+ 0 0 121 -3,-1.9 2,-0.5 -4,-0.4 -1,-0.3 0.618 78.4 89.7 -73.8 -11.4 15.3 3.8 25.6 94 103 A V S X S- 0 0 2 -3,-1.9 3,-2.1 -4,-0.2 2,-0.2 -0.745 92.8-112.3 -84.1 129.5 14.0 6.8 27.5 95 104 A S T 3 S+ 0 0 36 -2,-0.5 35,-0.4 1,-0.3 36,-0.2 -0.456 104.8 24.8 -63.5 126.7 11.7 9.0 25.4 96 105 A G T 3 S+ 0 0 33 1,-0.2 2,-0.7 -2,-0.2 -1,-0.3 0.162 97.3 102.8 103.2 -18.3 13.5 12.3 25.0 97 106 A I < + 0 0 7 -3,-2.1 -1,-0.2 -6,-0.2 -3,-0.1 -0.905 50.1 176.5 -99.2 114.4 17.0 10.9 25.5 98 107 A G > - 0 0 27 -2,-0.7 4,-2.7 -3,-0.1 5,-0.2 -0.348 49.8 -79.3-101.4-174.9 18.8 10.6 22.1 99 108 A P H > S+ 0 0 31 0, 0.0 4,-1.8 0, 0.0 5,-0.2 0.870 129.1 48.5 -53.8 -41.1 22.3 9.5 21.2 100 109 A S H > S+ 0 0 88 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.963 114.6 42.2 -67.9 -52.3 23.8 12.9 22.1 101 110 A A H > S+ 0 0 24 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.882 113.1 54.6 -61.7 -38.5 22.1 13.3 25.5 102 111 A A H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.922 109.0 46.8 -64.4 -42.6 22.8 9.7 26.4 103 112 A R H X S+ 0 0 87 -4,-1.8 4,-1.7 -5,-0.2 -1,-0.2 0.912 112.6 50.5 -66.5 -38.9 26.5 10.1 25.7 104 113 A K H X S+ 0 0 128 -4,-2.2 4,-1.4 2,-0.2 -2,-0.2 0.891 110.9 49.0 -64.3 -39.7 26.6 13.3 27.7 105 114 A F H X>S+ 0 0 11 -4,-2.6 5,-2.4 1,-0.2 4,-0.8 0.933 108.0 52.8 -66.0 -44.8 24.8 11.6 30.6 106 115 A V H <5S+ 0 0 10 -4,-2.5 3,-0.4 1,-0.2 -1,-0.2 0.842 106.3 55.2 -60.6 -33.3 27.2 8.7 30.6 107 116 A D H <5S+ 0 0 130 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.869 106.1 50.4 -63.6 -39.4 30.1 11.2 30.8 108 117 A E H <5S- 0 0 82 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.603 124.8-106.9 -74.6 -11.9 28.6 12.8 33.9 109 118 A G T <5S+ 0 0 40 -4,-0.8 2,-0.9 -3,-0.4 -3,-0.2 0.483 79.1 133.4 97.2 5.1 28.3 9.3 35.4 110 119 A I < + 0 0 8 -5,-2.4 -1,-0.3 -6,-0.2 -2,-0.2 -0.787 17.8 134.2 -89.1 104.6 24.6 9.0 35.0 111 120 A K + 0 0 76 -2,-0.9 2,-0.3 -3,-0.1 -1,-0.2 0.340 48.1 59.8-140.8 8.3 24.1 5.5 33.4 112 121 A T S > S- 0 0 60 -3,-0.1 4,-2.4 1,-0.1 5,-0.2 -0.894 82.5-108.4-133.0 168.0 21.4 3.6 35.2 113 122 A L H > S+ 0 0 43 -2,-0.3 4,-2.3 1,-0.2 5,-0.1 0.886 122.4 53.0 -59.2 -39.9 17.7 4.0 35.9 114 123 A E H > S+ 0 0 138 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.902 107.6 51.0 -61.3 -42.2 18.6 4.7 39.5 115 124 A D H > S+ 0 0 36 1,-0.2 4,-0.6 2,-0.2 -2,-0.2 0.901 110.4 49.3 -62.8 -43.6 21.0 7.4 38.4 116 125 A L H >< S+ 0 0 2 -4,-2.4 3,-1.3 1,-0.2 -1,-0.2 0.925 107.0 55.0 -59.8 -45.5 18.3 9.0 36.3 117 126 A R H >< S+ 0 0 150 -4,-2.3 3,-0.5 1,-0.3 -1,-0.2 0.807 109.9 45.9 -63.4 -28.9 15.7 8.9 39.1 118 127 A K H 3< S+ 0 0 131 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.501 112.8 51.6 -93.0 -4.2 18.0 10.8 41.5 119 128 A N T X< + 0 0 31 -3,-1.3 3,-2.1 -4,-0.6 -1,-0.2 -0.145 61.0 133.9-123.3 37.7 19.0 13.4 38.9 120 129 A E G X + 0 0 92 -3,-0.5 3,-2.0 1,-0.3 -1,-0.1 0.799 67.0 69.0 -54.7 -33.0 15.6 14.6 37.6 121 130 A D G 3 S+ 0 0 118 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.726 95.1 56.5 -60.4 -21.0 16.8 18.1 37.9 122 131 A K G < S+ 0 0 89 -3,-2.1 2,-0.3 -6,-0.2 -1,-0.3 0.481 94.1 86.5 -89.7 -3.3 19.1 17.4 35.0 123 132 A L S < S- 0 0 10 -3,-2.0 2,-0.0 -4,-0.2 -26,-0.0 -0.748 73.1-129.1-101.2 144.8 16.3 16.3 32.7 124 133 A N > - 0 0 85 -2,-0.3 4,-2.4 -28,-0.1 5,-0.2 -0.239 41.3 -90.3 -77.1 177.0 14.1 18.4 30.4 125 134 A H H > S+ 0 0 110 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.912 126.3 47.3 -58.5 -49.7 10.3 18.2 30.5 126 135 A H H > S+ 0 0 39 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.936 113.8 48.1 -56.4 -49.8 10.1 15.5 27.8 127 136 A Q H > S+ 0 0 16 -31,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.857 106.9 56.9 -60.8 -37.9 12.8 13.4 29.4 128 137 A R H X S+ 0 0 89 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.922 111.2 43.1 -58.9 -45.2 11.2 13.7 32.9 129 138 A I H X S+ 0 0 12 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.881 110.3 55.8 -70.7 -40.4 8.0 12.2 31.5 130 139 A G H < S+ 0 0 1 -4,-2.4 -35,-0.2 -35,-0.4 -1,-0.2 0.880 111.3 45.2 -56.7 -38.4 9.9 9.5 29.5 131 140 A L H >< S+ 0 0 8 -4,-2.1 3,-1.8 2,-0.2 4,-0.3 0.938 107.7 56.9 -71.8 -45.6 11.5 8.4 32.8 132 141 A K H 3< S+ 0 0 121 -4,-2.2 3,-0.2 1,-0.3 -2,-0.2 0.881 120.6 29.6 -52.9 -41.8 8.3 8.5 34.8 133 142 A Y T 3X S+ 0 0 26 -4,-2.0 4,-2.7 1,-0.2 -1,-0.3 0.038 79.8 128.7-110.7 26.1 6.7 6.1 32.4 134 143 A F H <> S+ 0 0 26 -3,-1.8 4,-0.7 1,-0.2 -1,-0.2 0.909 79.1 41.9 -47.3 -53.1 9.8 4.2 31.2 135 144 A G H >4 S+ 0 0 45 -4,-0.3 3,-1.1 -3,-0.2 4,-0.4 0.950 114.7 49.8 -61.1 -51.1 8.2 0.8 32.0 136 145 A D H >4 S+ 0 0 34 1,-0.2 3,-1.5 2,-0.2 -1,-0.2 0.871 104.3 58.9 -56.6 -40.6 4.7 1.6 30.6 137 146 A F H 3< S+ 0 0 42 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.703 99.9 57.0 -70.7 -16.8 6.1 3.0 27.3 138 147 A E T << S+ 0 0 95 -3,-1.1 -1,-0.3 -4,-0.7 2,-0.3 0.559 88.8 94.1 -91.0 -4.0 7.8 -0.3 26.4 139 148 A K S < S- 0 0 106 -3,-1.5 2,-0.1 -4,-0.4 -3,-0.0 -0.616 74.9-125.9 -82.9 145.1 4.6 -2.3 26.6 140 149 A R - 0 0 140 -2,-0.3 40,-0.2 104,-0.0 -2,-0.1 -0.482 18.5-122.4 -84.0 160.9 2.5 -2.9 23.5 141 150 A I E -A 179 0A 0 38,-3.1 38,-2.6 -2,-0.1 40,-0.1 -0.917 22.4-128.9-106.6 120.2 -1.2 -2.0 23.2 142 151 A P E >> -A 178 0A 54 0, 0.0 4,-2.0 0, 0.0 3,-0.8 -0.362 21.4-119.8 -63.9 146.0 -3.6 -4.8 22.4 143 152 A R H 3> S+ 0 0 57 34,-2.3 4,-2.3 1,-0.3 5,-0.2 0.857 114.3 61.8 -57.6 -34.4 -5.9 -4.0 19.5 144 153 A E H 3> S+ 0 0 150 33,-0.3 4,-1.3 1,-0.2 -1,-0.3 0.910 106.9 44.5 -56.8 -41.8 -8.8 -4.5 21.8 145 154 A E H <> S+ 0 0 30 -3,-0.8 4,-2.1 2,-0.2 -1,-0.2 0.853 108.4 57.4 -69.8 -36.1 -7.5 -1.6 23.9 146 155 A M H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.881 104.1 53.8 -60.8 -36.6 -6.8 0.4 20.8 147 156 A L H X S+ 0 0 74 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.893 107.8 49.2 -65.4 -39.3 -10.5 0.1 19.9 148 157 A Q H X S+ 0 0 60 -4,-1.3 4,-2.0 2,-0.2 -1,-0.2 0.882 112.0 49.0 -65.9 -38.4 -11.5 1.5 23.3 149 158 A M H X S+ 0 0 1 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.904 108.7 53.2 -67.4 -41.5 -9.1 4.4 22.8 150 159 A Q H X S+ 0 0 46 -4,-2.5 4,-3.0 1,-0.2 5,-0.3 0.935 107.3 52.7 -57.1 -49.2 -10.5 5.0 19.3 151 160 A D H X S+ 0 0 97 -4,-2.3 4,-2.5 1,-0.2 5,-0.3 0.936 111.1 45.9 -51.2 -53.1 -14.0 5.2 20.8 152 161 A I H X S+ 0 0 38 -4,-2.0 4,-2.4 1,-0.2 5,-0.2 0.929 115.8 44.5 -59.8 -50.0 -13.0 7.8 23.4 153 162 A V H X S+ 0 0 1 -4,-2.7 4,-2.6 2,-0.2 5,-0.2 0.939 115.5 46.4 -62.1 -47.3 -11.1 10.0 21.0 154 163 A L H X S+ 0 0 62 -4,-3.0 4,-1.8 -5,-0.2 -2,-0.2 0.914 116.1 45.1 -65.6 -40.4 -13.7 9.9 18.2 155 164 A N H X S+ 0 0 72 -4,-2.5 4,-1.2 -5,-0.3 -1,-0.2 0.887 114.5 47.9 -70.7 -36.9 -16.6 10.6 20.5 156 165 A E H X S+ 0 0 24 -4,-2.4 4,-1.0 -5,-0.3 -2,-0.2 0.896 110.4 51.2 -70.9 -40.0 -14.8 13.3 22.4 157 166 A V H >X S+ 0 0 5 -4,-2.6 4,-2.2 -5,-0.2 3,-0.8 0.915 106.8 55.0 -61.2 -41.6 -13.7 15.1 19.2 158 167 A K H 3< S+ 0 0 129 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.841 103.9 55.7 -61.0 -33.5 -17.3 15.0 18.0 159 168 A K H 3< S+ 0 0 138 -4,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.745 107.1 49.7 -71.7 -24.9 -18.4 16.7 21.2 160 169 A V H << S- 0 0 43 -4,-1.0 2,-0.3 -3,-0.8 -2,-0.2 0.939 138.0 -19.8 -75.6 -49.8 -15.9 19.6 20.4 161 170 A D >< - 0 0 36 -4,-2.2 3,-1.7 3,-0.0 -1,-0.3 -0.874 51.5-142.5-161.9 123.1 -17.1 20.1 16.8 162 171 A S T 3 S+ 0 0 100 -2,-0.3 -4,-0.1 1,-0.3 -3,-0.1 0.590 99.3 68.3 -66.8 -7.1 -19.1 17.6 14.6 163 172 A E T 3 S+ 0 0 105 -5,-0.1 -1,-0.3 2,-0.0 2,-0.1 0.657 77.4 97.8 -87.6 -17.2 -17.0 18.9 11.7 164 173 A Y < - 0 0 12 -3,-1.7 2,-0.4 -7,-0.2 24,-0.2 -0.430 57.9-160.7 -62.6 143.2 -13.7 17.3 13.0 165 174 A I E -B 187 0B 88 22,-2.1 22,-2.2 -2,-0.1 2,-0.5 -0.991 5.8-167.7-124.3 125.0 -12.8 14.0 11.5 166 175 A A E -B 186 0B 13 -2,-0.4 2,-0.4 20,-0.2 20,-0.2 -0.940 2.4-171.3-112.3 132.9 -10.3 11.9 13.5 167 176 A T E -B 185 0B 31 18,-3.1 18,-3.3 -2,-0.5 2,-0.5 -0.983 20.1-135.8-125.8 124.8 -8.6 8.9 12.0 168 177 A V E +B 184 0B 6 -2,-0.4 16,-0.2 16,-0.2 2,-0.1 -0.679 37.8 168.3 -78.9 123.7 -6.4 6.4 13.9 169 178 A C E > +B 183 0B 1 14,-3.0 3,-0.8 -2,-0.5 14,-0.6 -0.196 28.7 67.0-118.3-154.9 -3.4 5.7 11.8 170 179 A G G >> S- 0 0 5 93,-1.5 4,-1.4 1,-0.2 3,-0.6 -0.340 115.6 -19.5 70.2-155.0 -0.0 4.0 12.3 171 180 A S G 34>S+ 0 0 14 1,-0.2 5,-2.5 2,-0.2 -1,-0.2 0.814 134.7 64.6 -58.4 -30.0 0.1 0.2 12.9 172 181 A F G X45S+ 0 0 13 -3,-0.8 3,-1.8 1,-0.2 -1,-0.2 0.945 103.3 45.0 -58.4 -48.6 -3.6 0.3 13.9 173 182 A R T <45S+ 0 0 65 -3,-0.6 -1,-0.2 -4,-0.3 -2,-0.2 0.793 106.9 61.1 -69.5 -24.8 -4.7 1.3 10.5 174 183 A R T 3<5S- 0 0 42 -4,-1.4 -1,-0.3 90,-0.2 -2,-0.2 0.387 121.0-111.2 -78.4 4.6 -2.3 -1.3 9.1 175 184 A G T < 5 + 0 0 41 -3,-1.8 -3,-0.2 1,-0.2 -2,-0.1 0.648 55.0 170.2 79.4 15.8 -4.4 -3.9 11.0 176 185 A A < - 0 0 25 -5,-2.5 -1,-0.2 1,-0.1 3,-0.1 -0.264 38.3-136.8 -61.0 145.3 -1.8 -4.8 13.6 177 186 A E S S+ 0 0 148 1,-0.2 -34,-2.3 -35,-0.1 2,-0.3 0.624 92.4 21.7 -79.7 -13.4 -3.0 -7.0 16.5 178 187 A S E S-A 142 0A 40 -36,-0.2 2,-0.3 -35,-0.1 -1,-0.2 -0.982 73.7-153.1-149.0 152.5 -1.0 -4.8 18.8 179 188 A S E -A 141 0A 0 -38,-2.6 -38,-3.1 -2,-0.3 3,-0.1 -0.893 19.8-140.1-125.8 150.0 0.4 -1.2 18.6 180 189 A G S S- 0 0 35 -2,-0.3 65,-0.4 -40,-0.2 2,-0.3 0.818 85.1 -24.2 -74.0 -31.9 3.3 0.6 20.1 181 190 A D S S- 0 0 37 63,-0.1 2,-0.5 -40,-0.1 -9,-0.2 -0.907 75.3 -82.5-162.0-176.3 1.2 3.8 20.6 182 191 A M E - c 0 246B 0 63,-2.3 65,-2.5 -2,-0.3 2,-0.5 -0.934 33.6-168.0-111.0 122.3 -1.8 5.7 19.3 183 192 A D E -Bc 169 247B 19 -14,-0.6 -14,-3.0 -2,-0.5 2,-0.5 -0.936 6.1-171.0-110.6 121.2 -1.5 7.8 16.2 184 193 A V E -Bc 168 248B 2 63,-2.9 65,-2.7 -2,-0.5 2,-0.5 -0.951 10.7-160.0-120.8 117.5 -4.4 10.2 15.4 185 194 A L E -Bc 167 249B 0 -18,-3.3 -18,-3.1 -2,-0.5 2,-0.4 -0.807 18.2-165.6 -88.8 131.7 -4.8 12.2 12.2 186 195 A L E +Bc 166 250B 1 63,-3.2 65,-2.3 -2,-0.5 2,-0.3 -0.963 10.6 178.4-123.3 136.5 -7.2 15.1 12.6 187 196 A T E -B 165 0B 6 -22,-2.2 -22,-2.1 -2,-0.4 5,-0.1 -0.952 6.4-179.8-131.0 157.5 -8.9 17.3 10.1 188 197 A H > - 0 0 0 3,-0.4 3,-2.4 63,-0.4 65,-0.5 -0.964 35.2-125.2-151.8 137.1 -11.3 20.2 10.2 189 198 A P T 3 S+ 0 0 40 0, 0.0 65,-0.1 0, 0.0 8,-0.1 0.719 107.2 66.8 -60.9 -17.8 -12.8 22.2 7.3 190 199 A S T 3 S+ 0 0 14 1,-0.2 7,-3.1 6,-0.1 2,-0.6 0.578 94.7 63.7 -76.6 -9.5 -11.5 25.5 8.8 191 200 A F B < +F 196 0C 29 -3,-2.4 62,-2.6 5,-0.2 -3,-0.4 -0.921 67.4 147.4-121.3 104.3 -7.9 24.4 8.2 192 201 A T - 0 0 34 3,-2.7 3,-0.1 -2,-0.6 -2,-0.0 -0.756 63.9 -96.6-125.1 175.8 -6.9 24.0 4.6 193 202 A S S S+ 0 0 57 -2,-0.2 3,-0.1 1,-0.2 -2,-0.0 0.653 125.4 46.1 -66.3 -14.6 -3.8 24.4 2.5 194 203 A E S S+ 0 0 169 1,-0.3 2,-0.3 0, 0.0 -1,-0.2 0.742 121.6 2.0 -99.7 -29.8 -5.2 27.8 1.6 195 204 A S - 0 0 41 -3,-0.1 -3,-2.7 0, 0.0 2,-0.6 -0.999 44.9-139.0-159.6 153.5 -6.4 29.2 4.9 196 205 A T B +F 191 0C 95 -2,-0.3 -5,-0.2 -5,-0.2 -6,-0.1 -0.929 26.9 172.5-113.7 102.5 -6.7 28.9 8.7 197 206 A K + 0 0 150 -7,-3.1 -6,-0.1 -2,-0.6 -1,-0.1 0.571 65.6 40.6 -91.6 -12.9 -10.2 30.2 9.4 198 207 A Q S S- 0 0 64 -8,-0.5 3,-0.4 0, 0.0 2,-0.1 -0.999 75.1-139.6-134.9 138.5 -10.3 29.1 13.1 199 208 A P S S+ 0 0 95 0, 0.0 -2,-0.0 0, 0.0 -9,-0.0 -0.479 80.5 26.5 -86.0 164.0 -7.5 29.4 15.7 200 209 A K > + 0 0 143 -2,-0.1 4,-2.9 1,-0.1 5,-0.3 0.698 68.1 149.8 62.0 25.3 -6.7 26.7 18.3 201 210 A L H > S+ 0 0 6 -3,-0.4 4,-0.8 1,-0.2 -1,-0.1 0.892 78.4 35.8 -57.5 -43.5 -8.1 23.8 16.3 202 211 A L H > S+ 0 0 3 21,-0.3 4,-2.5 2,-0.2 3,-0.3 0.909 114.8 57.3 -75.3 -42.9 -5.7 21.3 17.8 203 212 A H H > S+ 0 0 58 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.915 101.9 54.8 -52.5 -50.3 -5.7 23.0 21.3 204 213 A Q H X S+ 0 0 69 -4,-2.9 4,-1.8 1,-0.2 -1,-0.2 0.872 111.0 46.0 -53.3 -41.9 -9.5 22.6 21.6 205 214 A V H X S+ 0 0 3 -4,-0.8 4,-2.1 -3,-0.3 -1,-0.2 0.921 112.9 48.0 -69.5 -45.3 -9.2 18.9 21.0 206 215 A V H X S+ 0 0 1 -4,-2.5 4,-1.9 1,-0.2 9,-0.2 0.938 111.4 52.0 -60.3 -47.5 -6.3 18.4 23.4 207 216 A E H X S+ 0 0 100 -4,-3.2 4,-2.5 1,-0.2 -1,-0.2 0.898 108.9 49.4 -52.9 -48.1 -8.1 20.4 26.1 208 217 A Q H X S+ 0 0 46 -4,-1.8 4,-1.4 -5,-0.2 -1,-0.2 0.889 110.5 50.0 -61.8 -40.5 -11.2 18.3 25.7 209 218 A L H <>S+ 0 0 1 -4,-2.1 5,-2.2 1,-0.2 6,-1.9 0.781 112.5 48.2 -70.3 -27.2 -9.2 15.0 26.0 210 219 A Q H ><5S+ 0 0 76 -4,-1.9 3,-1.9 4,-0.2 -2,-0.2 0.867 105.1 59.4 -74.5 -39.9 -7.5 16.4 29.1 211 220 A K H 3<5S+ 0 0 157 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.842 107.2 45.5 -58.8 -35.9 -10.8 17.4 30.6 212 221 A V T 3<5S- 0 0 52 -4,-1.4 -1,-0.3 -5,-0.1 -2,-0.2 0.260 117.6-115.0 -92.5 11.9 -12.1 13.8 30.5 213 222 A H T < 5S+ 0 0 153 -3,-1.9 -3,-0.2 2,-0.2 -2,-0.1 0.713 85.0 117.9 64.3 24.0 -8.8 12.7 31.9 214 223 A F < + 0 0 2 -5,-2.2 17,-1.9 -6,-0.2 2,-0.5 0.922 69.0 54.4 -80.9 -52.7 -7.8 10.7 28.8 215 224 A I E +D 230 0B 6 -6,-1.9 15,-0.3 15,-0.2 -2,-0.2 -0.744 65.2 172.5 -81.9 126.9 -4.7 12.8 28.1 216 225 A T E + 0 0 51 13,-2.3 2,-0.3 -2,-0.5 14,-0.2 0.650 57.8 11.9-110.6 -26.0 -2.5 12.8 31.2 217 226 A D E -D 229 0B 23 12,-1.2 12,-2.3 -88,-0.0 2,-0.4 -0.986 60.7-133.5-150.7 161.3 0.7 14.5 30.2 218 227 A T E +D 228 0B 36 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.972 16.1 176.4-122.4 128.4 2.2 16.6 27.3 219 228 A L E S- 0 0 11 8,-3.1 2,-0.3 -2,-0.4 9,-0.2 0.820 76.6 -17.5 -93.4 -39.6 5.7 16.0 25.8 220 229 A S E -D 227 0B 44 7,-2.0 7,-2.8 -95,-0.1 -1,-0.4 -0.963 62.3-171.4-163.7 153.6 5.4 18.7 23.1 221 230 A K E +D 226 0B 91 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.949 13.0 151.8-158.2 128.6 2.7 20.8 21.5 222 231 A G - 0 0 40 3,-1.8 -2,-0.0 -2,-0.3 -20,-0.0 -0.677 61.5 -73.8-135.6-163.6 2.3 23.2 18.6 223 232 A E S S+ 0 0 180 -2,-0.2 -21,-0.3 1,-0.2 -20,-0.1 0.713 127.5 20.4 -73.5 -21.3 -0.3 24.3 16.2 224 233 A T S S+ 0 0 50 1,-0.2 26,-2.8 -22,-0.1 2,-0.4 0.593 119.9 49.2-122.6 -13.2 -0.2 21.1 14.2 225 234 A K E - E 0 249B 79 24,-0.2 -3,-1.8 2,-0.0 2,-0.4 -0.978 50.9-172.7-138.2 126.5 1.3 18.4 16.3 226 235 A F E -DE 221 248B 0 22,-2.8 22,-2.6 -2,-0.4 2,-0.4 -0.943 3.4-173.0-110.5 137.8 0.7 17.1 19.8 227 236 A M E +DE 220 247B 33 -7,-2.8 -8,-3.1 -2,-0.4 -7,-2.0 -0.967 32.9 115.7-129.5 114.6 2.9 14.5 21.5 228 237 A G E -DE 218 246B 0 18,-3.1 18,-2.3 -2,-0.4 2,-0.4 -0.682 55.3 -79.3-154.8-157.7 1.8 13.2 24.8 229 238 A V E +DE 217 245B 0 -12,-2.3 -13,-2.3 16,-0.2 -12,-1.2 -0.945 34.4 178.7-128.9 142.2 0.6 10.5 27.2 230 239 A C E -DE 215 244B 0 14,-2.7 14,-3.0 -2,-0.4 2,-0.3 -0.898 9.2-159.3-137.7 171.3 -2.9 9.0 27.6 231 240 A Q - 0 0 28 -17,-1.9 12,-0.1 -2,-0.3 3,-0.1 -0.941 19.6-123.7-157.2 130.2 -4.6 6.4 29.7 232 241 A L - 0 0 6 10,-0.4 9,-0.5 -2,-0.3 2,-0.2 -0.416 38.4-107.6 -65.6 145.8 -7.8 4.3 29.5 233 242 A P - 0 0 91 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.533 33.2-144.5 -73.6 142.7 -10.3 4.6 32.4 234 243 A S - 0 0 45 -2,-0.2 3,-0.1 4,-0.1 6,-0.1 -0.750 14.3-113.6-107.8 157.4 -10.4 1.5 34.6 235 244 A K > - 0 0 156 -2,-0.3 3,-2.1 4,-0.2 -1,-0.1 -0.282 52.6 -62.4 -82.4 170.9 -13.5 0.1 36.4 236 245 A N T 3 S+ 0 0 160 1,-0.3 -1,-0.2 -2,-0.1 3,-0.1 -0.280 124.1 3.2 -53.6 132.2 -14.1 -0.0 40.1 237 246 A D T 3 S+ 0 0 180 1,-0.2 2,-0.3 -3,-0.1 -1,-0.3 0.437 102.1 132.5 70.5 -1.0 -11.6 -2.2 41.9 238 247 A E < - 0 0 84 -3,-2.1 -1,-0.2 1,-0.1 -4,-0.1 -0.612 64.1-110.9 -83.4 141.6 -9.7 -2.8 38.5 239 248 A K - 0 0 194 -2,-0.3 -4,-0.2 1,-0.1 -1,-0.1 -0.359 46.8 -97.8 -60.9 148.0 -6.0 -2.4 38.2 240 249 A E - 0 0 126 -6,-0.1 -1,-0.1 1,-0.1 3,-0.1 -0.379 32.8-114.9 -72.8 149.3 -5.1 0.7 36.2 241 250 A Y - 0 0 52 -9,-0.5 -1,-0.1 1,-0.1 -7,-0.1 -0.481 42.1 -94.7 -71.8 153.2 -4.2 0.4 32.5 242 251 A P - 0 0 26 0, 0.0 -10,-0.4 0, 0.0 2,-0.2 -0.342 42.6-101.9 -64.7 151.0 -0.6 1.4 31.6 243 252 A H - 0 0 28 -12,-0.1 2,-0.3 -3,-0.1 -12,-0.2 -0.518 44.7-155.8 -69.5 144.6 0.0 4.9 30.4 244 253 A R E - E 0 230B 12 -14,-3.0 -14,-2.7 -2,-0.2 2,-0.3 -0.903 16.0-112.0-124.9 152.8 0.3 5.1 26.6 245 254 A R E - E 0 229B 35 -65,-0.4 -63,-2.3 -2,-0.3 2,-0.4 -0.641 33.4-171.5 -80.8 139.7 2.0 7.4 24.1 246 255 A I E -cE 182 228B 0 -18,-2.3 -18,-3.1 -2,-0.3 2,-0.4 -0.999 8.7-171.2-132.9 135.7 -0.4 9.4 21.9 247 256 A D E -cE 183 227B 22 -65,-2.5 -63,-2.9 -2,-0.4 2,-0.4 -0.995 4.1-168.6-123.3 134.0 0.5 11.6 18.9 248 257 A I E -cE 184 226B 2 -22,-2.6 -22,-2.8 -2,-0.4 2,-0.5 -0.988 1.2-169.8-125.1 131.1 -2.1 13.8 17.2 249 258 A R E -cE 185 225B 18 -65,-2.7 -63,-3.2 -2,-0.4 2,-0.6 -0.980 11.5-152.6-125.7 118.9 -1.4 15.5 13.8 250 259 A L E -c 186 0B 7 -26,-2.8 -63,-0.2 -2,-0.5 -48,-0.1 -0.835 22.0-173.6 -89.4 118.2 -3.7 18.2 12.4 251 260 A I - 0 0 0 -65,-2.3 -63,-0.4 -2,-0.6 -60,-0.1 -0.886 35.7 -93.2-116.0 142.9 -3.4 18.1 8.6 252 261 A P > - 0 0 7 0, 0.0 3,-2.2 0, 0.0 -60,-0.3 -0.335 38.2-127.3 -54.7 135.8 -5.0 20.5 6.0 253 262 A K G > S+ 0 0 83 -62,-2.6 3,-1.2 -65,-0.5 -61,-0.2 0.847 107.7 53.0 -61.2 -36.6 -8.3 18.9 5.1 254 263 A D G 3 S+ 0 0 89 1,-0.3 -1,-0.3 -63,-0.2 3,-0.2 0.505 107.5 54.5 -75.4 -3.5 -7.6 19.1 1.3 255 264 A Q G <> S+ 0 0 34 -3,-2.2 4,-1.9 1,-0.1 -1,-0.3 0.016 71.2 120.0-117.5 26.2 -4.3 17.3 1.9 256 265 A Y H <> + 0 0 60 -3,-1.2 4,-3.3 1,-0.2 5,-0.3 0.855 68.3 54.1 -57.9 -43.1 -5.8 14.3 3.7 257 266 A Y H > S+ 0 0 82 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.933 112.3 43.1 -67.4 -41.7 -4.7 11.6 1.3 258 267 A C H > S+ 0 0 4 29,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.880 116.3 50.9 -65.5 -36.5 -1.0 12.6 1.5 259 268 A G H X S+ 0 0 0 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.925 111.5 44.8 -67.7 -43.6 -1.4 13.0 5.2 260 269 A V H X S+ 0 0 0 -4,-3.3 4,-1.3 2,-0.2 -1,-0.2 0.835 110.2 55.8 -74.6 -30.0 -3.0 9.6 5.8 261 270 A L H X S+ 0 0 4 -4,-2.1 4,-1.3 -5,-0.3 3,-0.3 0.965 112.7 42.9 -58.8 -53.1 -0.4 8.0 3.5 262 271 A Y H >< S+ 0 0 69 -4,-2.2 3,-0.6 1,-0.2 -2,-0.2 0.955 116.1 45.9 -56.1 -54.7 2.4 9.4 5.7 263 272 A F H 3< S+ 0 0 23 -4,-2.8 -93,-1.5 1,-0.2 -1,-0.2 0.644 106.6 59.3 -74.3 -13.1 0.8 8.7 9.0 264 273 A T H 3< S+ 0 0 1 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.827 90.1 129.4 -80.7 -31.0 -0.2 5.1 8.1 265 274 A G << - 0 0 5 -4,-1.3 2,-0.2 -3,-0.6 -1,-0.1 -0.256 66.6-142.3 62.1-149.0 3.5 4.1 7.4 266 275 A S > - 0 0 4 -3,-0.1 4,-2.5 -4,-0.0 -1,-0.2 0.581 34.9-128.3 -64.7 178.4 5.2 2.0 8.2 267 276 A D H > S+ 0 0 80 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.925 110.5 46.4 -62.5 -46.5 8.3 4.2 8.6 268 277 A I H > S+ 0 0 18 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.904 111.0 53.7 -64.0 -39.5 10.4 1.9 6.4 269 278 A F H > S+ 0 0 0 55,-0.3 4,-3.0 2,-0.2 5,-0.2 0.933 109.1 48.6 -56.5 -47.4 7.6 1.8 3.9 270 279 A N H X S+ 0 0 20 -4,-2.5 4,-2.9 2,-0.2 5,-0.3 0.918 111.6 49.2 -59.7 -45.4 7.5 5.6 3.8 271 280 A K H X S+ 0 0 97 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.928 113.6 46.4 -61.1 -44.6 11.3 5.7 3.2 272 281 A N H X S+ 0 0 45 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.937 115.5 45.2 -64.1 -45.8 11.1 3.1 0.5 273 282 A M H X S+ 0 0 2 -4,-3.0 4,-2.2 2,-0.2 -2,-0.2 0.899 113.9 48.5 -65.1 -42.7 8.2 4.8 -1.3 274 283 A R H X S+ 0 0 71 -4,-2.9 4,-1.8 -5,-0.2 -1,-0.2 0.884 111.5 49.9 -67.3 -37.3 9.7 8.3 -1.0 275 284 A A H X S+ 0 0 42 -4,-2.3 4,-2.1 -5,-0.3 -2,-0.2 0.905 110.7 50.2 -65.6 -41.3 13.0 7.1 -2.3 276 285 A H H X S+ 0 0 37 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.876 106.6 56.0 -62.8 -38.2 11.2 5.4 -5.2 277 286 A A H <>S+ 0 0 0 -4,-2.2 5,-2.6 2,-0.2 4,-0.4 0.921 106.6 49.4 -58.3 -46.0 9.4 8.7 -5.9 278 287 A L H ><5S+ 0 0 94 -4,-1.8 3,-1.6 1,-0.2 -2,-0.2 0.919 107.9 53.0 -61.5 -45.7 12.7 10.6 -6.2 279 288 A E H 3<5S+ 0 0 157 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.828 111.4 48.6 -55.1 -32.8 14.0 7.9 -8.7 280 289 A K T 3<5S- 0 0 84 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.449 127.6 -99.6 -88.5 -3.6 10.8 8.6 -10.6 281 290 A G T < 5S+ 0 0 29 -3,-1.6 11,-2.3 -4,-0.4 2,-0.3 0.781 86.4 106.5 91.0 31.3 11.2 12.3 -10.5 282 291 A F E < -G 291 0D 34 -5,-2.6 2,-0.4 9,-0.3 -1,-0.3 -0.963 54.3-145.6-136.7 155.0 8.8 13.2 -7.7 283 292 A T E -G 290 0D 46 7,-2.9 7,-2.5 -2,-0.3 2,-0.4 -0.990 16.1-163.6-122.1 132.2 9.0 14.3 -4.1 284 293 A I E +G 289 0D 10 -2,-0.4 2,-0.2 5,-0.2 5,-0.2 -0.946 16.1 159.4-114.9 128.6 6.5 13.2 -1.5 285 294 A N - 0 0 52 3,-2.3 -23,-0.1 -2,-0.4 -2,-0.0 -0.684 59.9 -83.2-125.5-169.7 5.8 14.7 1.9 286 295 A E S S+ 0 0 35 -2,-0.2 -23,-0.1 1,-0.2 -24,-0.1 0.514 126.3 39.4 -75.0 -0.3 2.8 14.5 4.3 287 296 A Y S S- 0 0 76 1,-0.3 2,-0.3 -29,-0.2 -29,-0.3 0.751 119.7 -5.0-113.2 -39.0 1.1 17.3 2.3 288 297 A T - 0 0 8 -30,-0.1 -3,-2.3 -31,-0.1 2,-0.4 -0.946 48.0-126.4-152.6 162.4 1.8 16.9 -1.4 289 298 A I E -G 284 0D 1 13,-0.4 13,-2.6 -2,-0.3 -5,-0.2 -0.999 37.4-177.7-116.8 131.2 3.4 15.1 -4.2 290 299 A R E -G 283 0D 78 -7,-2.5 -7,-2.9 -2,-0.4 2,-0.1 -0.932 26.2-114.5-127.8 148.4 5.4 17.4 -6.5 291 300 A P E -G 282 0D 43 0, 0.0 8,-3.3 0, 0.0 2,-0.6 -0.475 27.1-126.2 -73.5 152.6 7.4 16.9 -9.7 292 301 A L B -H 298 0E 61 -11,-2.3 6,-0.2 6,-0.2 5,-0.1 -0.930 25.9-137.7 -98.5 118.6 11.2 17.5 -9.6 293 302 A G - 0 0 37 4,-2.2 3,-0.5 -2,-0.6 -12,-0.0 -0.196 31.0 -96.2 -66.1 164.5 12.2 20.0 -12.2 294 303 A V S S+ 0 0 162 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.864 124.8 49.5 -50.6 -36.7 15.4 19.5 -14.3 295 304 A T S S- 0 0 124 2,-0.1 -1,-0.2 1,-0.0 3,-0.1 0.853 119.9 -99.6 -73.4 -37.6 17.2 21.8 -11.9 296 305 A G S S+ 0 0 53 -3,-0.5 2,-0.2 1,-0.4 -2,-0.1 0.137 79.9 121.7 134.2 -23.5 16.3 20.3 -8.5 297 306 A V - 0 0 104 -5,-0.1 -4,-2.2 1,-0.1 -1,-0.4 -0.535 65.9-114.3 -73.8 135.9 13.5 22.5 -7.3 298 307 A A B -H 292 0E 37 -2,-0.2 -6,-0.2 -6,-0.2 -1,-0.1 -0.440 32.2-141.0 -66.5 142.4 10.2 20.9 -6.5 299 308 A G - 0 0 22 -8,-3.3 -1,-0.1 1,-0.2 3,-0.1 -0.002 39.2 -51.1 -89.1-161.5 7.3 22.0 -8.8 300 309 A E - 0 0 148 1,-0.1 -1,-0.2 -10,-0.1 -11,-0.0 -0.438 68.8 -86.7 -78.6 148.9 3.7 22.6 -8.0 301 310 A P - 0 0 59 0, 0.0 -11,-0.2 0, 0.0 -1,-0.1 -0.266 43.2-132.0 -54.7 130.4 1.5 20.1 -6.1 302 311 A L - 0 0 46 -13,-2.6 -13,-0.4 1,-0.1 2,-0.1 -0.552 31.9 -88.7 -84.0 151.1 -0.1 17.5 -8.3 303 312 A P - 0 0 98 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.382 46.2-178.0 -58.5 129.1 -3.9 16.6 -8.1 304 313 A V + 0 0 38 -2,-0.1 -47,-0.2 1,-0.1 -46,-0.1 -0.972 20.3 158.8-133.3 117.3 -4.5 13.8 -5.5 305 314 A D S S+ 0 0 126 -2,-0.4 2,-0.3 1,-0.2 3,-0.1 0.267 71.8 18.0-119.7 13.0 -8.0 12.5 -4.9 306 315 A S S > S- 0 0 32 1,-0.1 4,-0.8 0, 0.0 3,-0.5 -0.963 77.5-108.7-167.9 157.4 -7.1 9.1 -3.4 307 316 A E H >> S+ 0 0 17 -2,-0.3 4,-1.2 1,-0.2 3,-1.1 0.907 119.5 60.4 -56.9 -39.2 -4.2 7.4 -1.8 308 317 A K H 3> S+ 0 0 97 1,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.801 91.6 64.9 -61.7 -30.7 -4.0 5.3 -5.0 309 318 A D H 3> S+ 0 0 51 -3,-0.5 4,-1.9 1,-0.2 -1,-0.3 0.858 100.4 53.0 -59.4 -35.5 -3.4 8.5 -7.1 310 319 A I H S+ 0 0 0 -4,-1.2 5,-2.4 1,-0.2 3,-0.3 0.894 109.5 56.6 -61.4 -39.7 1.0 5.3 -6.1 312 321 A D H ><5S+ 0 0 76 -4,-2.6 3,-1.5 1,-0.2 -2,-0.2 0.910 100.5 57.1 -61.2 -43.0 -0.1 5.8 -9.7 313 322 A Y H 3<5S+ 0 0 63 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.856 112.7 40.0 -55.0 -39.5 2.2 8.9 -10.1 314 323 A I T 3<5S- 0 0 0 -4,-1.1 -1,-0.3 -3,-0.3 -2,-0.2 0.277 115.6-114.5 -98.8 11.8 5.2 6.8 -9.2 315 324 A Q T < 5 + 0 0 129 -3,-1.5 2,-0.4 -4,-0.3 -3,-0.2 0.879 66.9 140.9 61.0 42.3 4.1 3.7 -11.1 316 325 A W < - 0 0 57 -5,-2.4 -1,-0.2 -6,-0.1 2,-0.1 -0.907 57.1-114.1-108.3 142.4 3.6 1.4 -8.1 317 326 A K - 0 0 193 -2,-0.4 2,-0.1 1,-0.1 -5,-0.0 -0.504 50.1 -92.0 -66.4 145.0 0.7 -1.0 -7.9 318 327 A Y - 0 0 69 -2,-0.1 2,-0.5 1,-0.0 -1,-0.1 -0.353 39.5-156.5 -62.6 136.7 -1.6 0.1 -5.0 319 328 A R - 0 0 65 -3,-0.1 -1,-0.0 -2,-0.1 -8,-0.0 -0.969 13.4-131.6-118.4 121.6 -0.8 -1.5 -1.6 320 329 A E > - 0 0 91 -2,-0.5 3,-2.3 1,-0.1 -146,-0.0 -0.316 32.6-105.0 -62.4 152.9 -3.5 -1.7 1.0 321 330 A P G > S+ 0 0 15 0, 0.0 3,-2.1 0, 0.0 -147,-0.1 0.840 120.4 61.8 -47.9 -41.2 -2.5 -0.5 4.5 322 331 A K G 3 S+ 0 0 130 1,-0.3 3,-0.4 -149,-0.2 -148,-0.1 0.726 102.5 52.8 -61.8 -19.9 -2.2 -4.0 5.8 323 332 A D G < S+ 0 0 85 -3,-2.3 -1,-0.3 1,-0.2 -3,-0.1 0.141 92.2 75.3-101.7 20.6 0.5 -4.6 3.2 324 333 A R < + 0 0 0 -3,-2.1 2,-1.7 -150,-0.1 -55,-0.3 0.190 56.7 117.7-115.1 12.6 2.6 -1.6 4.2 325 334 A S 0 0 69 -3,-0.4 -60,-0.1 1,-0.2 -59,-0.0 -0.619 360.0 360.0 -83.8 82.4 4.1 -3.1 7.4 326 335 A E 0 0 41 -2,-1.7 -1,-0.2 -287,-0.0 -288,-0.1 0.637 360.0 360.0-103.8 360.0 7.7 -3.1 6.4