==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXYGEN BINDING 10-SEP-07 2R80 . COMPND 2 MOLECULE: HEMOGLOBIN SUBUNIT ALPHA-A; . SOURCE 2 ORGANISM_SCIENTIFIC: COLUMBA LIVIA; . AUTHOR M.N.PONNUSWAMY,P.CHARLES,S.SUNDARESAN,K.NEELAGANDAN, . 573 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24949.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 444 77.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 13 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 84 14.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 332 57.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 1.9 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 4 0 2 0 2 1 0 1 0 1 2 4 0 2 6 4 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 A V 0 0 146 0, 0.0 429,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 151.2 28.0 -12.5 28.2 2 2 A L - 0 0 15 71,-0.1 122,-0.0 1,-0.1 428,-0.0 -0.383 360.0-119.1 -55.9 133.8 30.7 -13.9 25.9 3 3 A S > - 0 0 49 1,-0.1 4,-2.3 -2,-0.1 5,-0.2 -0.208 25.8-103.1 -68.0 165.2 29.6 -14.2 22.3 4 4 A A H > S+ 0 0 82 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.895 125.5 53.0 -53.4 -39.6 29.4 -17.5 20.4 5 5 A N H > S+ 0 0 78 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.892 107.2 48.8 -67.4 -42.3 32.6 -16.4 18.7 6 6 A D H > S+ 0 0 15 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.912 110.5 52.2 -62.6 -41.8 34.4 -15.7 22.0 7 7 A K H X S+ 0 0 45 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.912 109.5 48.7 -60.5 -45.4 33.4 -19.1 23.3 8 8 A S H X S+ 0 0 60 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.871 110.2 52.0 -64.0 -38.3 34.7 -20.9 20.2 9 9 A N H X S+ 0 0 21 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.920 110.2 48.5 -64.4 -42.1 38.0 -19.0 20.5 10 10 A V H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 5,-0.3 0.940 113.1 46.8 -62.3 -46.3 38.4 -20.0 24.2 11 11 A K H X S+ 0 0 86 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.860 110.4 53.3 -66.6 -34.1 37.6 -23.7 23.3 12 12 A A H X S+ 0 0 61 -4,-2.3 4,-0.9 2,-0.2 -1,-0.2 0.912 111.2 47.5 -65.0 -41.5 40.0 -23.6 20.4 13 13 A V H >X S+ 0 0 5 -4,-2.2 4,-2.5 1,-0.2 3,-0.7 0.962 117.2 39.5 -64.0 -52.9 42.8 -22.2 22.8 14 14 A F H 3X S+ 0 0 32 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.791 110.3 59.6 -74.1 -26.0 42.2 -24.8 25.5 15 15 A A H 3< S+ 0 0 89 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.737 114.2 38.8 -69.2 -23.5 41.7 -27.7 23.1 16 16 A K H << S+ 0 0 155 -4,-0.9 3,-0.3 -3,-0.7 -2,-0.2 0.881 132.4 21.9 -86.8 -50.7 45.1 -27.0 21.7 17 17 A I H >X S+ 0 0 9 -4,-2.5 3,-1.2 1,-0.2 4,-0.6 0.232 84.1 111.3-110.2 11.8 47.1 -26.2 24.9 18 18 A G T 3< S+ 0 0 31 -4,-1.7 3,-0.4 1,-0.2 4,-0.4 0.773 76.0 61.1 -53.6 -29.1 45.0 -27.8 27.6 19 19 A G T 34 S+ 0 0 85 -3,-0.3 -1,-0.2 1,-0.2 3,-0.2 0.811 111.1 38.3 -69.3 -31.5 47.7 -30.4 28.2 20 20 A Q T <> S+ 0 0 98 -3,-1.2 4,-2.2 1,-0.2 3,-0.3 0.428 87.1 101.6 -95.3 -2.3 50.2 -27.6 29.2 21 21 A A H X S+ 0 0 6 -4,-0.6 4,-2.1 -3,-0.4 5,-0.2 0.851 76.9 56.5 -59.3 -38.8 47.6 -25.5 31.1 22 22 A G H > S+ 0 0 15 -4,-0.4 4,-1.7 -3,-0.2 -1,-0.2 0.946 110.1 43.4 -57.1 -52.8 48.9 -26.8 34.4 23 23 A D H > S+ 0 0 113 -3,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.858 111.5 55.5 -57.2 -40.3 52.4 -25.6 33.8 24 24 A L H X S+ 0 0 10 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.875 104.7 53.9 -62.5 -35.6 51.1 -22.3 32.3 25 25 A G H X S+ 0 0 1 -4,-2.1 4,-2.2 -5,-0.2 -2,-0.2 0.911 106.2 51.8 -66.9 -43.2 49.2 -21.7 35.6 26 26 A G H X S+ 0 0 1 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.924 112.0 45.9 -56.1 -44.0 52.3 -22.1 37.6 27 27 A E H X S+ 0 0 34 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.870 109.1 55.0 -69.8 -36.2 54.2 -19.6 35.5 28 28 A A H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.924 111.0 46.2 -60.9 -41.3 51.3 -17.2 35.5 29 29 A L H X S+ 0 0 4 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.901 109.5 52.4 -70.9 -41.1 51.4 -17.3 39.3 30 30 A E H X S+ 0 0 48 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.912 111.5 48.7 -56.7 -45.2 55.1 -16.9 39.5 31 31 A R H X S+ 0 0 4 -4,-2.4 4,-2.5 1,-0.2 5,-0.4 0.861 107.4 54.8 -65.0 -36.5 54.7 -13.8 37.3 32 32 A L H X S+ 0 0 11 -4,-2.1 4,-2.2 1,-0.2 7,-0.3 0.936 110.6 45.9 -58.8 -45.8 51.9 -12.4 39.4 33 33 A F H < S+ 0 0 8 -4,-2.2 7,-0.2 1,-0.2 -2,-0.2 0.843 118.4 40.5 -71.6 -32.7 54.1 -12.6 42.5 34 34 A I H < S+ 0 0 34 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.859 121.6 40.1 -84.8 -35.2 57.2 -11.1 40.9 35 35 A T H < S+ 0 0 16 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.2 0.848 130.4 27.3 -82.9 -33.7 55.4 -8.4 38.8 36 36 A Y S >< S+ 0 0 7 -4,-2.2 3,-2.4 -5,-0.4 4,-0.3 -0.633 70.3 178.8-130.5 75.1 53.0 -7.4 41.5 37 37 A P G > S+ 0 0 66 0, 0.0 3,-1.6 0, 0.0 4,-0.3 0.680 71.9 73.8 -57.1 -23.1 54.6 -8.2 44.8 38 38 A Q G > S+ 0 0 49 1,-0.3 3,-1.4 2,-0.2 4,-0.1 0.791 84.8 68.3 -59.9 -26.7 51.7 -7.0 46.9 39 39 A T G X S+ 0 0 4 -3,-2.4 3,-1.7 -7,-0.3 -1,-0.3 0.727 81.6 76.0 -68.5 -18.9 49.7 -10.1 45.8 40 40 A K G X S+ 0 0 90 -3,-1.6 3,-1.7 -4,-0.3 -1,-0.3 0.737 77.4 74.5 -65.7 -18.5 52.1 -12.3 47.9 41 41 A T G < S+ 0 0 44 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.1 0.583 85.1 64.1 -75.7 -5.2 50.4 -11.2 51.1 42 42 A Y G < S+ 0 0 39 -3,-1.7 -1,-0.3 1,-0.2 3,-0.2 0.582 103.9 50.8 -84.2 -8.3 47.4 -13.4 50.2 43 43 A F X + 0 0 32 -3,-1.7 3,-1.8 -4,-0.2 -1,-0.2 -0.296 58.4 136.6-126.3 46.9 49.7 -16.3 50.5 44 44 A P T 3 S+ 0 0 110 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.684 76.1 59.6 -71.7 -12.2 51.5 -16.0 53.9 45 45 A H T 3 S+ 0 0 130 -3,-0.2 2,-0.3 2,-0.1 -2,-0.1 0.312 95.8 83.0 -93.7 1.8 50.9 -19.7 54.4 46 46 A F S < S- 0 0 43 -3,-1.8 2,-0.8 2,-0.0 -3,-0.1 -0.811 85.2-116.1-102.2 154.9 52.8 -20.6 51.3 47 47 A D - 0 0 80 -2,-0.3 8,-0.4 1,-0.1 7,-0.2 -0.798 35.4-177.5 -77.7 109.5 56.4 -21.1 50.6 48 48 A L + 0 0 39 -2,-0.8 -1,-0.1 6,-0.1 3,-0.1 0.168 31.3 132.7-103.7 18.0 56.8 -18.2 48.1 49 49 A S S > S- 0 0 62 1,-0.1 3,-2.1 2,-0.1 6,-0.2 -0.297 72.3 -89.6 -63.3 146.2 60.4 -18.9 47.2 50 50 A H T 3 S+ 0 0 139 1,-0.3 -1,-0.1 5,-0.0 -2,-0.0 -0.438 115.9 20.6 -67.7 136.6 61.1 -18.9 43.5 51 51 A G T 3 S+ 0 0 57 1,-0.2 -1,-0.3 -2,-0.1 5,-0.1 0.186 90.1 162.1 98.9 -12.9 60.8 -22.3 42.1 52 52 A S <> - 0 0 6 -3,-2.1 4,-1.9 1,-0.1 3,-0.4 0.000 43.8-137.5 -56.9 139.1 58.6 -23.4 45.0 53 53 A A H > S+ 0 0 83 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.791 103.3 58.2 -64.0 -27.8 56.4 -26.5 44.7 54 54 A Q H > S+ 0 0 95 2,-0.2 4,-2.2 -7,-0.2 -1,-0.2 0.880 105.6 48.1 -72.7 -36.1 53.6 -24.8 46.4 55 55 A I H > S+ 0 0 2 -8,-0.4 4,-2.9 -3,-0.4 5,-0.2 0.923 114.8 46.9 -65.0 -42.2 53.4 -22.1 43.8 56 56 A K H X S+ 0 0 98 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.911 112.6 49.1 -68.9 -41.3 53.6 -24.7 41.1 57 57 A G H X S+ 0 0 32 -4,-2.6 4,-1.5 2,-0.2 -1,-0.2 0.902 114.7 44.8 -60.2 -44.9 50.9 -26.8 42.8 58 58 A H H X S+ 0 0 47 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.922 110.1 52.1 -72.7 -43.8 48.6 -23.9 43.2 59 59 A G H X S+ 0 0 0 -4,-2.9 4,-2.2 1,-0.2 5,-0.2 0.878 106.2 57.6 -56.4 -36.4 49.1 -22.4 39.7 60 60 A K H X S+ 0 0 109 -4,-1.8 4,-2.0 -5,-0.2 -1,-0.2 0.925 106.7 48.1 -59.9 -43.5 48.2 -25.8 38.4 61 61 A K H X S+ 0 0 129 -4,-1.5 4,-1.6 2,-0.2 -2,-0.2 0.839 108.1 54.0 -64.5 -37.2 44.9 -25.6 40.3 62 62 A V H X S+ 0 0 30 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.942 110.8 46.7 -61.9 -43.1 44.2 -22.1 39.0 63 63 A A H X S+ 0 0 3 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.887 107.4 56.5 -71.2 -34.1 44.7 -23.4 35.4 64 64 A E H X S+ 0 0 102 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.854 105.7 51.7 -66.3 -31.0 42.5 -26.4 36.1 65 65 A A H X S+ 0 0 24 -4,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.892 107.9 51.5 -69.0 -40.4 39.7 -24.1 37.1 66 66 A L H X S+ 0 0 15 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.911 109.4 50.5 -59.9 -39.1 40.1 -22.2 33.9 67 67 A V H X S+ 0 0 35 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.888 109.0 51.0 -67.7 -39.4 39.9 -25.4 32.0 68 68 A E H X S+ 0 0 88 -4,-1.9 4,-1.3 2,-0.2 -1,-0.2 0.911 109.9 50.7 -61.7 -43.4 36.7 -26.4 33.8 69 69 A A H < S+ 0 0 0 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.896 110.4 48.6 -60.8 -41.3 35.3 -23.0 33.0 70 70 A A H >< S+ 0 0 1 -4,-2.3 3,-1.0 1,-0.2 -2,-0.2 0.883 110.1 51.4 -62.6 -39.4 36.2 -23.5 29.3 71 71 A N H 3< S+ 0 0 98 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.740 122.2 32.2 -73.5 -21.5 34.6 -27.0 29.3 72 72 A H T >< S+ 0 0 96 -4,-1.3 3,-1.8 -5,-0.2 -1,-0.3 -0.331 77.6 151.1-128.4 50.5 31.4 -25.6 30.8 73 73 A I T < + 0 0 7 -3,-1.0 3,-0.4 1,-0.3 -71,-0.1 0.581 62.7 64.3 -67.0 -12.8 31.5 -22.2 29.2 74 74 A D T 3 S+ 0 0 131 1,-0.3 -1,-0.3 -3,-0.1 3,-0.1 0.602 116.3 26.9 -88.2 -13.1 27.8 -21.7 29.1 75 75 A D <> + 0 0 96 -3,-1.8 4,-1.9 -6,-0.2 -1,-0.3 -0.497 63.9 156.4-144.8 77.3 27.6 -21.7 32.9 76 76 A I H > S+ 0 0 16 -3,-0.4 4,-1.9 1,-0.2 -3,-0.1 0.830 76.1 60.3 -72.6 -31.3 30.8 -20.6 34.5 77 77 A A H 4 S+ 0 0 54 2,-0.2 -1,-0.2 1,-0.2 7,-0.2 0.953 107.4 45.7 -56.4 -52.2 29.0 -19.6 37.6 78 78 A G H >4 S+ 0 0 37 1,-0.2 3,-1.3 2,-0.2 -2,-0.2 0.937 112.0 51.5 -53.3 -49.5 27.8 -23.2 38.1 79 79 A A H 3< S+ 0 0 31 -4,-1.9 -1,-0.2 -7,-0.3 -2,-0.2 0.844 118.1 36.3 -59.2 -35.6 31.2 -24.6 37.3 80 80 A L T 3X S+ 0 0 5 -4,-1.9 4,-1.4 1,-0.2 -1,-0.3 -0.120 77.5 130.1-117.1 36.4 33.0 -22.4 39.8 81 81 A S H X> S+ 0 0 71 -3,-1.3 4,-1.3 1,-0.2 3,-0.5 0.911 75.1 39.1 -61.1 -55.9 30.5 -22.3 42.6 82 82 A K H 3> S+ 0 0 153 1,-0.2 4,-1.8 -4,-0.2 -1,-0.2 0.873 111.7 59.6 -62.4 -37.8 32.6 -23.1 45.6 83 83 A L H 3> S+ 0 0 37 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.798 100.6 56.0 -65.9 -29.1 35.5 -21.1 44.4 84 84 A S H S+ 0 0 16 -4,-1.4 4,-2.3 -3,-0.5 5,-0.5 0.945 107.4 45.4 -71.5 -51.3 33.4 -17.9 44.3 85 85 A D H X>S+ 0 0 68 -4,-1.3 5,-1.8 1,-0.2 4,-1.0 0.860 112.4 56.8 -57.9 -33.4 32.3 -18.1 48.0 86 86 A L H <>S+ 0 0 65 -4,-1.8 5,-2.8 3,-0.2 6,-0.2 0.929 111.4 38.7 -61.6 -49.1 36.0 -18.9 48.7 87 87 A H H <5S+ 0 0 40 -4,-1.9 6,-2.4 3,-0.2 -2,-0.2 0.884 127.7 28.3 -78.8 -37.3 37.4 -15.8 47.1 88 88 A A H <5S+ 0 0 0 -4,-2.3 -3,-0.2 48,-0.4 -2,-0.1 0.914 130.6 29.9 -92.2 -45.6 34.9 -13.1 48.0 89 89 A Q T < - 0 0 4 -2,-0.3 3,-2.0 1,-0.1 4,-0.4 -0.444 23.3-130.4 -59.9 130.1 40.5 -7.3 46.4 95 95 A P T >> S+ 0 0 30 0, 0.0 3,-1.2 0, 0.0 4,-0.6 0.778 101.2 70.4 -61.4 -22.7 38.8 -7.3 43.0 96 96 A V H 3> S+ 0 0 33 1,-0.2 4,-0.9 2,-0.2 3,-0.5 0.797 88.2 64.9 -63.4 -23.9 41.7 -5.4 41.4 97 97 A N H <> S+ 0 0 16 -3,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.738 87.8 66.9 -76.5 -21.1 43.9 -8.5 41.7 98 98 A F H <> S+ 0 0 34 -3,-1.2 4,-2.4 -4,-0.4 -1,-0.2 0.887 99.1 51.1 -66.3 -36.2 41.8 -10.5 39.4 99 99 A K H X S+ 0 0 83 -4,-0.6 4,-2.1 -3,-0.5 -1,-0.2 0.868 108.0 54.3 -68.2 -31.8 42.7 -8.4 36.4 100 100 A L H X S+ 0 0 7 -4,-0.9 4,-1.9 2,-0.2 -2,-0.2 0.934 111.4 42.8 -68.1 -47.1 46.4 -8.7 37.4 101 101 A L H X S+ 0 0 37 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.914 112.7 53.1 -65.6 -38.9 46.2 -12.5 37.3 102 102 A G H X S+ 0 0 7 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.926 108.8 50.9 -63.5 -39.4 44.2 -12.6 34.2 103 103 A H H X S+ 0 0 13 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.909 106.6 53.1 -61.8 -45.6 46.8 -10.4 32.5 104 104 A C H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.820 105.3 56.0 -53.8 -38.7 49.6 -12.7 33.6 105 105 A F H X S+ 0 0 19 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.922 108.2 47.7 -62.7 -41.3 47.8 -15.6 32.0 106 106 A L H X S+ 0 0 5 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.894 108.6 54.7 -64.8 -40.1 47.7 -13.7 28.8 107 107 A V H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.930 108.0 48.4 -58.8 -48.7 51.4 -13.0 29.1 108 108 A V H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 5,-0.3 0.914 109.9 52.1 -59.1 -42.8 52.2 -16.6 29.5 109 109 A V H X S+ 0 0 13 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.927 110.7 48.8 -57.3 -42.9 50.1 -17.5 26.5 110 110 A A H < S+ 0 0 0 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.871 108.6 53.6 -63.8 -37.4 52.0 -14.9 24.5 111 111 A V H < S+ 0 0 8 -4,-2.1 151,-0.2 -5,-0.2 -1,-0.2 0.935 123.5 24.9 -63.6 -43.6 55.4 -16.2 25.6 112 112 A H H < S+ 0 0 51 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.727 132.1 31.6 -98.8 -22.4 54.7 -19.7 24.5 113 113 A F >X + 0 0 39 -4,-2.6 4,-1.6 -5,-0.3 3,-0.9 -0.439 62.2 158.4-136.6 59.7 52.1 -19.5 21.8 114 114 A P T 34 S+ 0 0 66 0, 0.0 -1,-0.1 0, 0.0 144,-0.1 0.845 76.6 49.0 -59.4 -37.3 52.6 -16.2 19.9 115 115 A S T 34 S+ 0 0 115 1,-0.2 3,-0.2 143,-0.1 -5,-0.1 0.729 108.2 56.1 -78.9 -15.4 50.9 -17.2 16.7 116 116 A L T <4 S+ 0 0 21 -3,-0.9 2,-2.1 1,-0.2 -1,-0.2 0.890 94.0 71.0 -73.2 -39.2 47.9 -18.5 18.6 117 117 A L < + 0 0 2 -4,-1.6 -1,-0.2 -8,-0.2 141,-0.1 -0.415 66.5 163.4 -86.7 67.1 47.4 -15.1 20.4 118 118 A T > - 0 0 57 -2,-2.1 4,-3.0 -3,-0.2 5,-0.2 -0.279 56.6 -99.1 -68.5 167.2 46.1 -13.1 17.5 119 119 A P H > S+ 0 0 19 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.931 126.6 50.5 -57.5 -41.8 44.3 -9.8 18.4 120 120 A E H > S+ 0 0 83 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.936 113.9 43.6 -60.0 -46.4 40.9 -11.5 17.9 121 121 A V H > S+ 0 0 16 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.896 111.1 54.9 -67.5 -39.0 41.9 -14.4 20.2 122 122 A H H X S+ 0 0 1 -4,-3.0 4,-2.6 2,-0.2 5,-0.2 0.934 108.4 50.0 -55.1 -48.6 43.5 -11.9 22.7 123 123 A A H X S+ 0 0 9 -4,-2.5 4,-2.2 -5,-0.2 -2,-0.2 0.919 113.1 45.8 -56.5 -45.9 40.1 -10.1 22.8 124 124 A S H X S+ 0 0 1 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.917 114.2 47.1 -67.4 -41.6 38.2 -13.3 23.5 125 125 A L H X S+ 0 0 7 -4,-3.0 4,-2.7 2,-0.2 5,-0.2 0.876 109.9 53.2 -69.0 -38.0 40.7 -14.6 26.1 126 126 A D H X S+ 0 0 20 -4,-2.6 4,-2.1 -5,-0.2 5,-0.2 0.946 110.5 47.7 -60.1 -47.2 40.7 -11.2 27.9 127 127 A K H X S+ 0 0 29 -4,-2.2 4,-2.5 -5,-0.2 -2,-0.2 0.894 112.1 51.5 -59.9 -38.8 36.8 -11.4 28.0 128 128 A F H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.937 110.1 45.2 -64.8 -49.1 37.1 -15.0 29.3 129 129 A V H X S+ 0 0 19 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.850 115.0 49.7 -67.7 -30.9 39.5 -14.3 32.2 130 130 A L H X S+ 0 0 56 -4,-2.1 4,-2.6 -5,-0.2 -1,-0.2 0.913 107.9 53.4 -71.9 -40.1 37.5 -11.2 33.2 131 131 A A H X S+ 0 0 28 -4,-2.5 4,-2.2 -5,-0.2 -2,-0.2 0.895 110.9 47.2 -59.8 -39.4 34.3 -13.3 33.1 132 132 A V H X S+ 0 0 9 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.936 111.8 49.4 -65.9 -46.2 35.9 -15.8 35.5 133 133 A G H X S+ 0 0 8 -4,-2.2 4,-1.0 1,-0.2 -2,-0.2 0.867 110.8 51.4 -59.6 -38.6 37.1 -13.0 37.8 134 134 A T H >< S+ 0 0 76 -4,-2.6 3,-0.5 2,-0.2 -1,-0.2 0.918 109.5 49.1 -65.4 -46.6 33.6 -11.5 37.8 135 135 A V H >< S+ 0 0 27 -4,-2.2 3,-1.3 1,-0.2 4,-0.2 0.905 110.3 51.7 -56.2 -43.2 32.1 -14.9 38.7 136 136 A L H 3< S+ 0 0 18 -4,-2.4 -48,-0.4 1,-0.3 -1,-0.2 0.705 117.1 38.4 -72.6 -19.2 34.6 -15.3 41.5 137 137 A T T X< S+ 0 0 6 -4,-1.0 3,-2.0 -3,-0.5 4,-0.4 0.135 79.6 119.9-113.3 16.2 33.8 -11.9 43.0 138 138 A A G X + 0 0 37 -3,-1.3 3,-1.4 1,-0.3 -2,-0.1 0.786 64.9 64.8 -58.5 -36.2 30.0 -12.0 42.3 139 139 A K G 3 S+ 0 0 89 1,-0.2 -1,-0.3 -4,-0.2 -2,-0.1 0.715 93.1 64.6 -58.9 -22.0 29.1 -11.6 46.0 140 140 A Y G < 0 0 10 -3,-2.0 -1,-0.2 326,-0.1 -2,-0.2 0.772 360.0 360.0 -70.7 -26.0 30.7 -8.1 46.0 141 141 A R < 0 0 79 -3,-1.4 275,-0.1 -4,-0.4 276,-0.1 0.070 360.0 360.0-129.5 360.0 28.0 -6.9 43.5 142 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 143 1 B V 0 0 95 0, 0.0 2,-0.4 0, 0.0 434,-0.0 0.000 360.0 360.0 360.0 132.9 60.7 5.8 41.3 144 2 B H - 0 0 147 0, 0.0 2,-0.5 0, 0.0 77,-0.0 -0.977 360.0-153.9-117.1 135.3 64.1 4.1 41.8 145 3 B W - 0 0 6 -2,-0.4 2,-0.1 4,-0.0 76,-0.0 -0.935 7.2-146.2-110.9 125.3 65.7 1.9 39.1 146 4 B S > - 0 0 33 -2,-0.5 4,-2.6 1,-0.1 5,-0.2 -0.412 29.9-109.9 -78.2 161.3 68.2 -0.8 39.8 147 5 B A H > S+ 0 0 65 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.900 121.8 52.8 -54.2 -42.5 71.1 -1.7 37.5 148 6 B E H > S+ 0 0 132 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.925 108.9 47.9 -62.2 -46.4 69.3 -5.0 36.7 149 7 B E H > S+ 0 0 41 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.909 110.8 51.8 -62.2 -44.4 66.0 -3.1 35.8 150 8 B K H X S+ 0 0 90 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.922 110.6 48.3 -59.0 -42.0 67.9 -0.7 33.6 151 9 B Q H X S+ 0 0 109 -4,-2.2 4,-2.3 1,-0.2 5,-0.3 0.920 110.3 50.9 -64.0 -45.8 69.6 -3.6 31.7 152 10 B L H X S+ 0 0 35 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.867 115.8 42.8 -59.8 -36.7 66.3 -5.4 31.2 153 11 B I H X S+ 0 0 0 -4,-2.0 4,-2.2 -5,-0.2 -2,-0.2 0.931 115.2 46.3 -77.6 -45.8 64.7 -2.3 29.8 154 12 B T H X S+ 0 0 74 -4,-2.7 4,-2.2 -5,-0.2 -2,-0.2 0.892 112.0 51.0 -68.2 -38.7 67.5 -1.1 27.6 155 13 B S H X S+ 0 0 42 -4,-2.3 4,-1.4 -5,-0.2 -1,-0.2 0.942 111.7 45.9 -65.2 -47.5 68.3 -4.5 26.1 156 14 B I H X S+ 0 0 11 -4,-1.4 4,-1.9 -5,-0.3 -2,-0.2 0.915 112.1 52.8 -61.2 -43.9 64.6 -5.2 25.1 157 15 B W H < S+ 0 0 36 -4,-2.2 3,-0.3 1,-0.2 -2,-0.2 0.944 106.4 51.6 -57.9 -49.5 64.3 -1.7 23.7 158 16 B G H < S+ 0 0 64 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.886 117.7 39.3 -52.2 -37.7 67.4 -2.0 21.5 159 17 B K H < S+ 0 0 167 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.647 89.5 106.9 -95.0 -18.7 66.1 -5.3 20.0 160 18 B V S < S- 0 0 11 -4,-1.9 2,-1.2 -3,-0.3 3,-0.1 -0.356 74.0-121.9 -68.3 137.4 62.4 -4.6 19.6 161 19 B N > - 0 0 67 1,-0.2 4,-2.7 -2,-0.1 5,-0.4 -0.675 29.5-168.4 -72.8 98.0 60.9 -4.1 16.2 162 20 B V H > S+ 0 0 30 -2,-1.2 4,-2.0 1,-0.2 5,-0.3 0.914 78.7 48.3 -64.0 -43.3 59.5 -0.7 16.9 163 21 B A H > S+ 0 0 36 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.948 118.8 37.2 -62.7 -48.0 57.3 -0.4 13.7 164 22 B D H > S+ 0 0 92 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.922 120.1 44.9 -77.0 -40.8 55.7 -3.8 14.0 165 23 B C H X S+ 0 0 5 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.858 113.2 51.6 -73.7 -30.0 55.3 -3.9 17.7 166 24 B G H X S+ 0 0 1 -4,-2.0 4,-2.1 -5,-0.4 5,-0.2 0.919 110.8 47.0 -68.7 -43.3 54.0 -0.4 17.9 167 25 B A H X S+ 0 0 4 -4,-1.9 4,-2.5 -5,-0.3 -2,-0.2 0.909 113.2 50.7 -62.1 -42.3 51.4 -1.1 15.2 168 26 B E H X S+ 0 0 66 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.898 108.6 51.0 -62.8 -43.6 50.5 -4.3 17.1 169 27 B A H X S+ 0 0 7 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.942 113.8 43.4 -63.1 -45.0 50.1 -2.5 20.4 170 28 B L H X S+ 0 0 7 -4,-2.1 4,-2.2 2,-0.2 5,-0.2 0.933 113.4 50.9 -68.0 -44.5 47.8 0.2 19.0 171 29 B A H X S+ 0 0 2 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.942 111.6 48.2 -58.0 -46.2 45.7 -2.3 16.9 172 30 B R H X S+ 0 0 15 -4,-2.5 4,-3.1 1,-0.2 5,-0.5 0.881 107.7 55.3 -63.9 -38.1 45.2 -4.5 20.0 173 31 B L H X S+ 0 0 11 -4,-2.2 4,-2.0 -5,-0.2 7,-0.3 0.953 112.5 43.2 -54.6 -47.7 44.2 -1.5 22.1 174 32 B L H < S+ 0 0 0 -4,-2.2 7,-0.3 2,-0.2 -2,-0.2 0.798 120.6 40.8 -72.7 -29.4 41.5 -0.7 19.6 175 33 B I H < S+ 0 0 20 -4,-2.0 -2,-0.2 -5,-0.2 -3,-0.2 0.928 120.7 39.7 -84.3 -46.4 40.4 -4.3 19.2 176 34 B V H < S+ 0 0 2 -4,-3.1 -3,-0.2 1,-0.3 -2,-0.2 0.845 129.4 29.3 -76.0 -33.1 40.5 -5.4 22.8 177 35 B Y S >< S- 0 0 26 -4,-2.0 3,-2.3 -5,-0.5 -1,-0.3 -0.717 75.6-178.3-127.8 75.2 39.1 -2.2 24.3 178 36 B P G > + 0 0 17 0, 0.0 3,-1.6 0, 0.0 4,-0.3 0.644 70.0 72.9 -68.3 -16.9 36.9 -0.8 21.6 179 37 B W G > S+ 0 0 22 1,-0.3 3,-1.7 2,-0.2 4,-0.3 0.786 85.2 71.6 -60.0 -23.9 35.7 2.4 23.3 180 38 B T G X S+ 0 0 2 -3,-2.3 3,-1.3 -7,-0.3 4,-0.3 0.752 80.3 74.5 -63.9 -21.2 39.3 3.6 22.6 181 39 B Q G X S+ 0 0 29 -3,-1.6 3,-1.7 -7,-0.3 -1,-0.3 0.776 78.6 75.5 -57.7 -28.4 38.3 3.8 18.9 182 40 B R G X S+ 0 0 64 -3,-1.7 3,-0.7 -4,-0.3 -1,-0.2 0.830 92.4 52.0 -53.5 -34.8 36.3 6.9 19.8 183 41 B F G < S+ 0 0 53 -3,-1.3 -1,-0.3 -4,-0.3 3,-0.2 0.594 106.9 54.2 -78.3 -12.6 39.5 9.0 20.0 184 42 B F G X + 0 0 35 -3,-1.7 3,-2.1 -4,-0.3 -1,-0.2 -0.091 61.5 129.6-117.2 30.4 40.7 7.9 16.6 185 43 B S G X + 0 0 96 -3,-0.7 3,-0.7 1,-0.3 -1,-0.1 0.683 69.3 61.0 -65.5 -18.3 37.8 8.8 14.4 186 44 B S G 3 S+ 0 0 112 1,-0.2 -1,-0.3 -3,-0.2 3,-0.1 0.528 86.4 79.2 -79.8 -7.7 40.0 10.6 11.9 187 45 B F G < S- 0 0 42 -3,-2.1 2,-0.4 1,-0.3 14,-0.3 0.509 91.8-139.1 -83.4 -4.3 41.9 7.4 11.2 188 46 B G < + 0 0 51 -3,-0.7 2,-0.6 -4,-0.1 -1,-0.3 -0.686 66.0 34.4 90.8-132.3 39.2 6.0 8.9 189 47 B N + 0 0 92 -2,-0.4 10,-0.1 1,-0.1 3,-0.1 -0.505 51.2 144.6 -76.7 109.6 38.2 2.4 8.9 190 48 B L + 0 0 16 -2,-0.6 -1,-0.1 1,-0.1 6,-0.1 -0.066 35.6 117.1-123.0 29.2 38.2 0.8 12.4 191 49 B S S S+ 0 0 97 4,-0.0 2,-0.3 2,-0.0 -1,-0.1 0.437 75.8 20.5 -90.1 -2.7 35.2 -1.4 11.8 192 50 B S S > S- 0 0 55 1,-0.1 4,-2.9 -3,-0.1 5,-0.2 -0.976 78.0-109.3-155.3 161.0 36.8 -4.8 12.2 193 51 B A H > S+ 0 0 36 -2,-0.3 4,-2.6 2,-0.2 5,-0.2 0.891 122.3 49.2 -56.7 -43.3 40.0 -6.4 13.6 194 52 B T H > S+ 0 0 120 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.932 112.3 47.6 -60.5 -48.3 41.3 -7.0 10.1 195 53 B A H > S+ 0 0 21 2,-0.2 4,-0.7 1,-0.2 -2,-0.2 0.896 113.6 47.7 -61.7 -44.3 40.5 -3.3 9.1 196 54 B I H >< S+ 0 0 2 -4,-2.9 3,-1.0 1,-0.2 -2,-0.2 0.951 112.5 48.1 -61.7 -49.9 42.2 -2.0 12.3 197 55 B S H 3< S+ 0 0 43 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.830 117.2 42.6 -63.4 -31.1 45.3 -4.1 11.8 198 56 B G H 3< S+ 0 0 55 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.499 84.3 118.9 -91.8 -2.2 45.6 -3.1 8.2 199 57 B N S+ 0 0 92 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.837 96.0 52.1 -65.5 -30.7 47.8 2.6 7.6 201 59 B N H > S+ 0 0 79 -14,-0.3 4,-2.6 2,-0.2 5,-0.2 0.901 110.0 48.5 -67.9 -41.2 47.1 5.4 10.1 202 60 B V H > S+ 0 0 0 -15,-0.2 4,-2.6 2,-0.2 5,-0.2 0.941 113.5 48.6 -59.7 -48.9 46.9 2.9 12.9 203 61 B K H X S+ 0 0 94 -4,-2.5 4,-1.4 1,-0.2 -2,-0.2 0.909 113.9 44.4 -59.7 -44.0 50.2 1.4 11.8 204 62 B A H X S+ 0 0 58 -4,-2.3 4,-1.5 -5,-0.2 -1,-0.2 0.906 115.2 47.9 -70.9 -40.0 51.9 4.8 11.5 205 63 B H H X S+ 0 0 52 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.893 105.9 58.2 -67.8 -37.5 50.6 6.1 14.8 206 64 B G H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 5,-0.2 0.874 103.3 53.8 -56.8 -40.7 51.5 2.9 16.6 207 65 B K H X S+ 0 0 108 -4,-1.4 4,-2.3 1,-0.2 -1,-0.2 0.925 107.7 50.0 -60.7 -44.2 55.1 3.4 15.6 208 66 B K H X S+ 0 0 145 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.861 109.4 53.0 -58.1 -40.5 55.0 6.9 17.1 209 67 B V H X S+ 0 0 32 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.935 111.3 42.5 -66.5 -47.1 53.6 5.5 20.3 210 68 B L H X S+ 0 0 4 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.891 110.5 57.5 -69.4 -34.0 56.3 2.9 20.8 211 69 B T H X S+ 0 0 56 -4,-2.3 4,-1.1 -5,-0.2 -2,-0.2 0.930 105.7 51.7 -56.4 -41.9 58.9 5.5 19.8 212 70 B S H >X S+ 0 0 23 -4,-2.0 4,-1.1 2,-0.2 3,-0.7 0.907 104.8 53.3 -63.7 -44.3 57.6 7.6 22.7 213 71 B F H >X S+ 0 0 20 -4,-2.1 4,-2.0 1,-0.2 3,-0.7 0.904 103.4 61.3 -54.7 -38.0 57.9 4.7 25.1 214 72 B G H 3X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.849 94.9 59.6 -52.9 -36.6 61.5 4.7 23.8 215 73 B D H < S+ 0 0 8 -4,-2.0 3,-0.5 1,-0.2 -2,-0.2 0.883 104.0 58.0 -50.9 -43.7 63.8 4.1 28.1 218 76 B K H 3< S+ 0 0 137 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.682 123.3 18.9 -71.8 -20.6 66.4 6.7 27.1 219 77 B N T X< + 0 0 80 -3,-1.0 3,-1.7 -4,-0.7 -1,-0.3 -0.567 66.6 175.2-147.7 89.0 66.1 8.6 30.4 220 78 B L T < S+ 0 0 15 -3,-0.5 3,-0.4 1,-0.3 -2,-0.1 0.689 81.0 51.8 -69.6 -21.7 64.5 6.6 33.1 221 79 B D T 3 S+ 0 0 113 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.319 108.7 52.2 -96.6 7.0 65.0 9.2 35.8 222 80 B N <> + 0 0 79 -3,-1.7 4,-2.3 -6,-0.2 -1,-0.2 0.016 66.2 122.2-127.1 24.9 63.4 12.0 33.7 223 81 B I H > S+ 0 0 5 -3,-0.4 4,-1.8 1,-0.2 5,-0.1 0.902 70.5 58.5 -59.1 -39.8 60.1 10.4 32.7 224 82 B K H 4 S+ 0 0 119 1,-0.2 4,-0.4 2,-0.2 3,-0.3 0.939 111.8 40.6 -55.4 -49.3 58.0 13.1 34.3 225 83 B G H >4 S+ 0 0 43 1,-0.2 3,-1.2 2,-0.2 4,-0.5 0.899 109.8 58.5 -66.0 -42.8 59.6 15.8 32.1 226 84 B T H 3< S+ 0 0 46 -4,-2.3 4,-0.3 1,-0.2 -1,-0.2 0.850 114.2 37.6 -55.8 -34.6 59.7 13.7 29.0 227 85 B F T 3X S+ 0 0 3 -4,-1.8 4,-2.3 -3,-0.3 -1,-0.2 0.344 85.1 101.2-104.5 8.3 55.9 13.3 29.1 228 86 B A H <> S+ 0 0 48 -3,-1.2 4,-1.7 -4,-0.4 -1,-0.2 0.915 87.9 41.4 -60.9 -48.4 54.8 16.7 30.3 229 87 B Q H > S+ 0 0 166 -4,-0.5 4,-1.9 1,-0.2 -1,-0.2 0.909 115.2 50.7 -67.3 -40.9 53.7 18.0 26.9 230 88 B L H > S+ 0 0 57 -4,-0.3 4,-2.6 1,-0.2 5,-0.2 0.847 106.2 57.7 -63.9 -30.0 52.1 14.7 25.9 231 89 B S H X>S+ 0 0 3 -4,-2.3 4,-2.2 2,-0.2 5,-0.5 0.910 104.0 50.8 -67.3 -40.8 50.2 14.9 29.2 232 90 B E H X>S+ 0 0 116 -4,-1.7 4,-1.6 1,-0.2 5,-1.3 0.938 113.2 47.4 -59.7 -46.3 48.7 18.2 28.3 233 91 B L H X>S+ 0 0 73 -4,-1.9 5,-2.5 3,-0.2 4,-0.7 0.940 116.1 40.4 -56.6 -55.8 47.7 16.7 25.0 234 92 B H H <5S+ 0 0 50 -4,-2.6 6,-2.8 3,-0.2 -1,-0.2 0.812 127.8 31.0 -72.5 -30.6 46.1 13.5 26.3 235 93 B C H <5S+ 0 0 1 -4,-2.2 4,-0.4 -5,-0.2 -3,-0.2 0.939 128.3 29.2 -92.0 -57.1 44.5 15.1 29.3 236 94 B D H < - 0 0 32 -2,-0.6 3,-2.1 1,-0.1 4,-0.4 -0.453 19.2-123.3 -67.1 137.6 41.0 8.8 31.1 242 100 B P T >> S+ 0 0 37 0, 0.0 4,-1.3 0, 0.0 3,-1.0 0.702 103.7 75.3 -57.1 -21.4 44.2 7.6 32.6 243 101 B E H 3> S+ 0 0 61 1,-0.3 4,-1.9 2,-0.2 5,-0.1 0.851 90.5 59.7 -59.5 -29.1 42.9 4.0 33.0 244 102 B N H <> S+ 0 0 8 -3,-2.1 4,-2.4 1,-0.2 -1,-0.3 0.809 96.4 58.9 -70.8 -25.4 43.4 3.7 29.3 245 103 B F H <> S+ 0 0 19 -3,-1.0 4,-2.2 -4,-0.4 -1,-0.2 0.885 106.0 50.4 -66.0 -39.7 47.1 4.4 29.8 246 104 B R H X S+ 0 0 38 -4,-1.3 4,-2.2 2,-0.2 -2,-0.2 0.928 109.6 50.6 -59.7 -44.2 47.2 1.4 32.0 247 105 B L H X S+ 0 0 14 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.901 109.7 48.7 -63.7 -44.2 45.4 -0.7 29.4 248 106 B L H X S+ 0 0 29 -4,-2.4 4,-2.8 1,-0.2 -1,-0.2 0.918 110.1 53.3 -62.0 -40.3 47.9 0.3 26.7 249 107 B G H X S+ 0 0 1 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.925 109.1 48.6 -57.6 -45.5 50.8 -0.5 29.1 250 108 B D H X S+ 0 0 9 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.901 110.9 50.8 -63.6 -44.4 49.3 -4.0 29.6 251 109 B I H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.930 107.4 52.7 -57.6 -47.1 48.9 -4.5 25.9 252 110 B L H X S+ 0 0 3 -4,-2.8 4,-2.7 1,-0.2 5,-0.2 0.916 107.0 53.1 -56.1 -42.4 52.5 -3.5 25.3 253 111 B V H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.925 109.9 47.7 -57.0 -47.0 53.7 -6.0 27.8 254 112 B I H X S+ 0 0 4 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.908 111.4 51.2 -60.0 -43.1 51.7 -8.7 26.0 255 113 B I H X S+ 0 0 7 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.909 110.8 47.7 -59.8 -45.6 53.2 -7.6 22.7 256 114 B L H X S+ 0 0 2 -4,-2.7 4,-2.4 2,-0.2 5,-0.3 0.899 109.3 54.3 -62.7 -40.4 56.7 -7.7 24.1 257 115 B A H X S+ 0 0 0 -4,-2.4 4,-2.0 -5,-0.2 7,-0.2 0.929 110.5 46.3 -58.5 -46.7 56.0 -11.2 25.5 258 116 B A H < S+ 0 0 30 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.893 114.5 47.5 -61.8 -38.8 55.0 -12.4 22.1 259 117 B H H < S+ 0 0 83 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.862 122.7 31.3 -71.5 -36.8 57.9 -10.8 20.4 260 118 B F H >< S- 0 0 31 -4,-2.4 3,-1.7 1,-0.2 -2,-0.2 0.571 83.1-170.2-103.8 -15.3 60.6 -12.1 22.8 261 119 B G G >< S- 0 0 16 -4,-2.0 3,-2.4 -5,-0.3 -1,-0.2 -0.287 72.0 -1.5 58.3-137.7 59.2 -15.4 24.0 262 120 B K G 3 S+ 0 0 157 1,-0.3 -1,-0.3 -151,-0.2 -150,-0.1 0.617 122.9 72.4 -65.4 -13.6 61.1 -16.9 26.9 263 121 B D G < S+ 0 0 124 -3,-1.7 2,-1.7 1,-0.2 -1,-0.3 0.698 79.8 80.3 -70.3 -17.5 63.6 -14.1 26.9 264 122 B F S < S- 0 0 0 -3,-2.4 -1,-0.2 -7,-0.2 -3,-0.1 -0.573 78.1-177.1 -86.0 71.2 60.7 -12.1 28.4 265 123 B T > - 0 0 46 -2,-1.7 4,-2.8 1,-0.1 5,-0.2 -0.072 43.3 -98.9 -66.9 167.3 61.4 -13.6 31.8 266 124 B P H > S+ 0 0 24 0, 0.0 4,-2.5 0, 0.0 5,-0.1 0.915 127.7 50.8 -57.1 -38.8 59.2 -12.8 34.9 267 125 B E H > S+ 0 0 89 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.874 108.4 50.9 -65.0 -38.4 61.9 -10.2 35.9 268 126 B C H > S+ 0 0 2 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.930 110.9 49.3 -61.3 -47.3 61.8 -8.6 32.5 269 127 B Q H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 5,-0.3 0.915 108.8 53.1 -54.9 -46.2 58.0 -8.4 32.7 270 128 B A H X S+ 0 0 23 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.919 110.7 46.7 -56.1 -46.4 58.3 -6.9 36.2 271 129 B A H X S+ 0 0 1 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.903 114.6 46.3 -66.4 -41.0 60.7 -4.2 34.9 272 130 B W H X S+ 0 0 2 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.868 110.7 50.7 -73.1 -36.9 58.5 -3.4 31.9 273 131 B Q H X S+ 0 0 3 -4,-2.8 4,-1.8 2,-0.2 -2,-0.2 0.918 110.2 51.9 -64.4 -41.6 55.3 -3.2 33.8 274 132 B K H X S+ 0 0 47 -4,-2.3 4,-2.4 -5,-0.3 -2,-0.2 0.939 110.2 50.0 -54.2 -45.7 57.0 -0.9 36.2 275 133 B L H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.932 110.0 46.9 -62.5 -49.1 58.1 1.2 33.2 276 134 B V H X S+ 0 0 5 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.825 112.1 53.0 -65.5 -25.6 54.6 1.5 31.6 277 135 B R H X S+ 0 0 64 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.909 108.4 48.6 -73.8 -42.4 53.2 2.4 35.0 278 136 B V H X S+ 0 0 8 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.919 112.3 49.2 -59.4 -44.9 55.7 5.2 35.5 279 137 B V H X S+ 0 0 3 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.945 110.8 49.6 -58.6 -46.9 54.9 6.4 32.0 280 138 B A H X S+ 0 0 16 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.882 110.2 51.7 -60.4 -39.0 51.1 6.3 32.7 281 139 B H H < S+ 0 0 73 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.868 109.1 50.1 -64.0 -39.9 51.7 8.2 35.9 282 140 B A H < S+ 0 0 6 -4,-2.1 3,-0.3 1,-0.2 -1,-0.2 0.809 110.8 48.7 -70.3 -31.7 53.7 10.9 34.1 283 141 B L H < S+ 0 0 18 -4,-2.0 2,-0.9 1,-0.2 3,-0.4 0.797 107.6 57.4 -75.2 -30.2 50.9 11.3 31.5 284 142 B A S < S+ 0 0 13 -4,-1.6 4,-0.3 -5,-0.2 -1,-0.2 -0.570 78.5 99.5 -99.1 66.7 48.3 11.5 34.3 285 143 B R + 0 0 95 -2,-0.9 -1,-0.2 -3,-0.3 -2,-0.1 0.728 53.6 79.7-116.7 -48.2 49.8 14.5 36.1 286 144 B K S S+ 0 0 69 -3,-0.4 -2,-0.1 -4,-0.2 -4,-0.0 0.507 103.2 48.6 -53.1 1.4 47.8 17.5 34.9 287 145 B Y 0 0 62 145,-0.0 -2,-0.1 279,-0.0 -1,-0.1 0.595 360.0 360.0 -91.7 -97.2 45.3 16.2 37.5 288 146 B H 0 0 65 -4,-0.3 -2,-0.1 144,-0.1 282,-0.1 0.259 360.0 360.0-112.7 360.0 46.4 15.2 40.9 289 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 290 1 C V 0 0 129 0, 0.0 2,-0.3 0, 0.0 126,-0.0 0.000 360.0 360.0 360.0 161.4 23.9 -10.1 42.5 291 2 C L - 0 0 22 71,-0.1 2,-0.1 125,-0.1 -150,-0.0 -0.504 360.0-139.6 -59.8 126.6 21.4 -7.7 44.0 292 3 C S > - 0 0 51 -2,-0.3 4,-2.0 1,-0.1 5,-0.2 -0.328 25.0-101.1 -78.4 170.2 19.9 -9.5 47.0 293 4 C A H > S+ 0 0 78 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.858 125.8 51.6 -60.1 -32.8 16.2 -9.2 47.9 294 5 C N H > S+ 0 0 80 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.893 105.7 54.4 -73.9 -36.3 17.0 -6.7 50.5 295 6 C D H > S+ 0 0 8 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.917 108.6 50.4 -58.5 -43.3 19.0 -4.6 48.0 296 7 C K H X S+ 0 0 56 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.910 108.9 50.0 -65.7 -43.9 15.9 -4.6 45.8 297 8 C S H X S+ 0 0 67 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.927 111.3 50.0 -53.7 -47.0 13.7 -3.5 48.6 298 9 C N H X S+ 0 0 30 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.904 110.9 48.5 -62.6 -45.9 16.1 -0.7 49.4 299 10 C V H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.939 112.4 47.5 -61.7 -45.1 16.3 0.5 45.8 300 11 C K H X S+ 0 0 94 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.888 110.8 52.9 -67.5 -34.6 12.5 0.5 45.4 301 12 C A H X S+ 0 0 42 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.904 108.6 49.9 -62.6 -44.6 12.1 2.4 48.6 302 13 C V H X S+ 0 0 1 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.952 113.4 45.0 -57.5 -49.0 14.6 5.0 47.5 303 14 C F H X S+ 0 0 22 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.846 110.1 54.8 -69.2 -31.0 12.8 5.5 44.2 304 15 C A H < S+ 0 0 78 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.919 110.7 46.7 -63.6 -46.4 9.4 5.5 45.9 305 16 C K H < S+ 0 0 118 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.899 112.4 48.2 -58.4 -46.4 10.7 8.3 48.2 306 17 C I H >< S+ 0 0 5 -4,-2.3 3,-2.1 -5,-0.2 -2,-0.2 0.920 85.7 151.8 -61.0 -43.8 12.2 10.3 45.3 307 18 C G G >< + 0 0 38 -4,-2.3 3,-1.5 1,-0.3 -1,-0.2 -0.205 69.1 2.1 50.2-127.0 8.9 9.9 43.4 308 19 C G G 3 S+ 0 0 89 1,-0.3 3,-0.4 -4,-0.1 4,-0.3 0.539 120.9 75.4 -71.3 -5.1 8.1 12.7 41.0 309 20 C Q G <> + 0 0 88 -3,-2.1 4,-2.3 1,-0.2 3,-0.3 0.552 66.3 97.7 -80.5 -8.2 11.4 14.4 41.8 310 21 C A H <> S+ 0 0 12 -3,-1.5 4,-2.1 1,-0.2 -1,-0.2 0.871 79.0 52.1 -48.9 -51.0 13.4 11.8 39.8 311 22 C G H > S+ 0 0 22 -3,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.904 110.9 46.8 -54.3 -45.5 13.7 14.0 36.7 312 23 C D H > S+ 0 0 113 -3,-0.3 4,-1.9 -4,-0.3 -1,-0.2 0.886 110.7 52.4 -65.3 -41.3 15.0 17.0 38.5 313 24 C L H X S+ 0 0 3 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.835 105.3 56.0 -65.3 -31.6 17.5 14.8 40.4 314 25 C G H X S+ 0 0 3 -4,-2.1 4,-2.2 -5,-0.2 -1,-0.2 0.914 106.7 49.9 -63.1 -45.2 18.7 13.4 37.1 315 26 C G H X S+ 0 0 2 -4,-1.7 4,-2.3 1,-0.2 -2,-0.2 0.906 111.5 48.9 -58.8 -40.4 19.4 16.9 35.9 316 27 C E H X S+ 0 0 36 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.900 108.6 52.6 -67.9 -38.4 21.3 17.6 39.1 317 28 C A H X S+ 0 0 4 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.903 111.6 46.4 -63.6 -43.5 23.4 14.5 38.8 318 29 C L H X S+ 0 0 5 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.882 109.6 53.5 -67.4 -39.6 24.4 15.4 35.3 319 30 C E H X S+ 0 0 39 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.917 111.4 47.0 -59.5 -42.9 25.2 18.9 36.3 320 31 C R H X S+ 0 0 5 -4,-2.4 4,-2.5 2,-0.2 5,-0.4 0.840 108.2 56.0 -66.6 -36.2 27.5 17.5 39.0 321 32 C L H X S+ 0 0 10 -4,-1.9 4,-2.4 1,-0.2 7,-0.3 0.950 110.2 43.8 -59.4 -49.7 29.0 15.1 36.6 322 33 C F H < S+ 0 0 9 -4,-2.3 7,-0.2 1,-0.2 -2,-0.2 0.837 119.1 42.5 -68.9 -35.1 30.1 17.9 34.2 323 34 C I H < S+ 0 0 57 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.886 121.4 38.8 -77.1 -40.0 31.4 20.2 36.9 324 35 C T H < S+ 0 0 15 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.2 0.840 130.8 28.2 -82.1 -34.2 33.2 17.5 39.0 325 36 C Y S >< S+ 0 0 9 -4,-2.4 3,-2.5 -5,-0.4 -1,-0.3 -0.657 70.6 178.8-128.8 73.2 34.5 15.5 36.1 326 37 C P G > S+ 0 0 61 0, 0.0 3,-1.9 0, 0.0 4,-0.2 0.711 73.1 72.8 -54.1 -29.2 34.9 18.1 33.2 327 38 C Q G > S+ 0 0 43 1,-0.3 3,-1.4 2,-0.2 4,-0.1 0.751 84.8 68.5 -56.1 -26.6 36.3 15.4 30.8 328 39 C T G X S+ 0 0 3 -3,-2.5 3,-1.5 -7,-0.3 -1,-0.3 0.730 80.5 75.7 -68.2 -20.0 32.8 14.0 30.6 329 40 C K G X S+ 0 0 92 -3,-1.9 3,-2.0 -4,-0.3 -1,-0.2 0.727 76.0 80.9 -60.8 -20.9 31.7 17.1 28.7 330 41 C T G < S+ 0 0 44 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.1 0.704 84.3 59.2 -57.6 -27.1 33.5 15.7 25.6 331 42 C Y G < S+ 0 0 40 -3,-1.5 -1,-0.3 1,-0.2 3,-0.2 0.568 103.7 52.0 -80.7 -9.9 30.5 13.4 24.9 332 43 C F X + 0 0 35 -3,-2.0 3,-1.8 -4,-0.2 -1,-0.2 -0.342 55.3 138.2-125.5 50.0 28.1 16.4 24.5 333 44 C P T 3 S+ 0 0 109 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.760 76.2 59.6 -69.0 -19.2 29.7 18.8 22.0 334 45 C H T 3 S+ 0 0 128 -3,-0.2 2,-0.3 2,-0.1 -2,-0.1 0.428 94.9 88.5 -82.5 -2.3 26.3 19.2 20.4 335 46 C F S < S- 0 0 33 -3,-1.8 2,-0.7 2,-0.0 -3,-0.1 -0.690 83.2-119.6 -96.6 149.5 24.8 20.5 23.8 336 47 C D - 0 0 77 -2,-0.3 8,-0.4 1,-0.1 7,-0.2 -0.825 36.5-179.3 -73.2 116.7 24.6 23.9 25.3 337 48 C L + 0 0 52 -2,-0.7 -1,-0.1 -4,-0.1 3,-0.1 0.143 30.8 127.9-112.0 16.8 26.7 23.1 28.4 338 49 C S S > S- 0 0 65 1,-0.2 3,-1.9 2,-0.1 6,-0.2 -0.247 75.5 -76.6 -67.4 159.5 26.6 26.5 30.1 339 50 C H T 3 S+ 0 0 168 1,-0.2 -1,-0.2 5,-0.0 -2,-0.0 -0.382 122.0 18.1 -58.2 127.4 25.5 26.8 33.7 340 51 C G T 3 S+ 0 0 46 1,-0.2 -1,-0.2 -3,-0.1 5,-0.1 0.418 87.7 174.4 93.0 -2.2 21.7 26.5 34.0 341 52 C S <> - 0 0 3 -3,-1.9 4,-1.8 1,-0.1 -1,-0.2 -0.096 31.2-149.8 -50.2 126.5 21.5 24.8 30.6 342 53 C A H > S+ 0 0 78 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.798 97.8 58.2 -65.1 -27.0 18.0 23.6 29.7 343 54 C Q H > S+ 0 0 81 2,-0.2 4,-2.5 -7,-0.2 -1,-0.2 0.901 104.4 49.5 -75.8 -40.3 19.5 20.9 27.5 344 55 C I H > S+ 0 0 9 -8,-0.4 4,-2.5 2,-0.2 -2,-0.2 0.941 114.0 46.5 -59.8 -43.9 21.5 19.5 30.5 345 56 C K H X S+ 0 0 85 -4,-1.8 4,-1.5 1,-0.2 -2,-0.2 0.916 112.3 49.6 -66.7 -44.1 18.3 19.5 32.5 346 57 C G H X S+ 0 0 31 -4,-2.8 4,-1.2 2,-0.2 -1,-0.2 0.901 112.8 47.4 -60.3 -42.6 16.2 17.9 29.8 347 58 C H H X S+ 0 0 47 -4,-2.5 4,-2.2 1,-0.2 3,-0.3 0.893 105.6 58.4 -67.6 -39.3 18.8 15.2 29.3 348 59 C G H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.851 101.5 56.9 -56.5 -37.1 19.0 14.5 33.0 349 60 C K H X S+ 0 0 107 -4,-1.5 4,-2.3 2,-0.2 -1,-0.2 0.872 105.7 50.2 -61.9 -37.8 15.3 13.8 32.9 350 61 C K H X S+ 0 0 136 -4,-1.2 4,-1.9 -3,-0.3 -2,-0.2 0.929 110.2 49.5 -65.3 -44.9 15.9 11.1 30.3 351 62 C V H X S+ 0 0 41 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.911 112.2 47.9 -58.5 -44.1 18.7 9.5 32.4 352 63 C A H X S+ 0 0 3 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.904 107.0 56.4 -68.1 -40.2 16.5 9.5 35.4 353 64 C E H X S+ 0 0 131 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.905 108.5 48.8 -51.8 -44.6 13.6 8.0 33.4 354 65 C A H X S+ 0 0 26 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.886 109.9 49.7 -66.8 -38.4 15.9 5.1 32.5 355 66 C L H X S+ 0 0 20 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.903 109.2 53.4 -65.9 -40.3 17.0 4.6 36.1 356 67 C V H X S+ 0 0 42 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.925 109.0 49.1 -57.8 -45.6 13.3 4.5 37.2 357 68 C E H X S+ 0 0 82 -4,-2.2 4,-1.5 1,-0.2 -2,-0.2 0.904 109.5 51.6 -63.6 -38.4 12.6 1.9 34.6 358 69 C A H < S+ 0 0 0 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.895 110.3 48.8 -62.9 -40.2 15.6 -0.1 35.8 359 70 C A H >< S+ 0 0 1 -4,-2.3 3,-1.0 1,-0.2 -2,-0.2 0.891 111.4 50.2 -64.1 -38.9 14.2 0.1 39.4 360 71 C N H 3< S+ 0 0 95 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.758 121.1 34.5 -70.6 -24.6 10.8 -1.0 38.2 361 72 C H T >< S+ 0 0 97 -4,-1.5 3,-2.1 -5,-0.2 -1,-0.3 -0.246 76.1 142.6-120.6 44.0 12.3 -3.9 36.4 362 73 C I G X + 0 0 9 -3,-1.0 3,-0.5 1,-0.3 -71,-0.1 0.729 63.6 65.8 -68.1 -19.5 15.1 -4.6 38.9 363 74 C D G 3 S+ 0 0 129 1,-0.3 -1,-0.3 -3,-0.1 -4,-0.1 0.716 118.5 21.4 -72.8 -20.8 14.8 -8.3 38.4 364 75 C D G <> + 0 0 100 -3,-2.1 4,-1.8 -6,-0.2 -1,-0.3 -0.460 65.7 158.0-148.8 74.0 16.0 -8.1 34.8 365 76 C I H <> S+ 0 0 16 -3,-0.5 4,-2.2 1,-0.2 5,-0.1 0.856 76.8 58.6 -66.4 -39.8 17.9 -4.9 34.1 366 77 C A H 4 S+ 0 0 57 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.881 108.1 47.6 -55.2 -42.0 19.7 -6.3 31.1 367 78 C G H >4 S+ 0 0 43 1,-0.2 3,-0.6 2,-0.2 4,-0.2 0.924 112.8 46.8 -65.2 -45.2 16.3 -6.9 29.5 368 79 C A H 3< S+ 0 0 49 -4,-1.8 3,-0.2 -7,-0.2 -2,-0.2 0.854 122.9 32.6 -69.5 -34.3 14.9 -3.5 30.2 369 80 C L T >< S+ 0 0 10 -4,-2.2 3,-0.7 1,-0.2 -1,-0.2 0.209 78.7 121.0-111.6 14.0 18.0 -1.5 29.1 370 81 C S T < S+ 0 0 39 -3,-0.6 -1,-0.2 -4,-0.5 -2,-0.1 0.869 80.2 42.3 -46.8 -46.8 19.3 -3.7 26.2 371 82 C K T 3 0 0 149 -4,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.796 360.0 360.0 -80.1 -20.7 19.0 -1.1 23.5 372 83 C L < 0 0 52 -3,-0.7 4,-2.2 2,-0.2 -1,-0.2 0.847 360.0 360.0 -70.0 360.0 20.4 1.6 25.7 373 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 374 85 C D >> 0 0 46 0, 0.0 4,-1.8 0, 0.0 5,-1.4 0.000 360.0 360.0 360.0 -45.0 23.8 -0.7 22.2 375 86 C L I 4> + 0 0 62 -4,-1.9 5,-3.0 3,-0.2 4,-0.4 0.940 360.0 38.7 -59.4 -48.1 23.6 3.1 22.1 376 87 C H I 45S+ 0 0 42 -4,-2.2 6,-2.5 3,-0.2 -1,-0.2 0.914 126.5 32.1 -75.3 -40.8 26.2 3.8 24.7 377 88 C A I 45S+ 0 0 0 48,-0.3 -2,-0.2 4,-0.2 -1,-0.1 0.900 129.5 28.7 -87.0 -42.7 28.7 1.0 23.9 378 89 C Q I <5S+ 0 0 108 -4,-1.8 -3,-0.2 2,-0.1 -2,-0.1 0.885 132.0 26.1 -88.4 -43.1 28.4 0.6 20.1 379 90 C K I - 0 0 4 -2,-0.3 3,-2.0 1,-0.1 4,-0.4 -0.414 22.5-128.9 -60.2 128.0 34.5 4.8 28.3 384 95 C P T >> S+ 0 0 24 0, 0.0 3,-1.3 0, 0.0 4,-0.7 0.790 103.2 69.2 -54.2 -27.0 33.3 2.4 31.0 385 96 C V H >> S+ 0 0 22 1,-0.3 4,-1.3 2,-0.2 3,-0.6 0.813 89.0 64.4 -61.7 -27.7 35.0 4.5 33.7 386 97 C N H <> S+ 0 0 16 -3,-2.0 4,-2.3 1,-0.2 -1,-0.3 0.757 90.4 63.3 -72.9 -20.8 32.4 7.2 33.2 387 98 C F H <> S+ 0 0 30 -3,-1.3 4,-2.2 -4,-0.4 -1,-0.2 0.858 102.6 50.3 -69.5 -33.3 29.5 5.0 34.3 388 99 C K H X + 0 0 28 -4,-3.0 4,-1.3 -5,-0.2 3,-0.9 -0.424 64.1 155.0-133.9 58.7 17.4 12.4 51.3 403 114 C P T 34 S+ 0 0 60 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.847 74.1 56.0 -62.7 -34.9 20.2 12.0 53.9 404 115 C S T 34 S+ 0 0 112 1,-0.2 3,-0.2 -3,-0.1 -5,-0.1 0.825 106.5 51.8 -65.2 -27.4 18.1 10.0 56.3 405 116 C L T <4 S+ 0 0 31 -3,-0.9 2,-1.8 1,-0.2 -1,-0.2 0.837 93.1 75.7 -75.8 -33.9 17.3 7.4 53.7 406 117 C L < + 0 0 1 -4,-1.3 -1,-0.2 -8,-0.2 141,-0.1 -0.401 62.5 160.3 -89.2 65.4 20.9 6.8 52.6 407 118 C T > - 0 0 59 -2,-1.8 4,-2.7 -3,-0.2 5,-0.2 -0.160 60.4 -94.3 -62.8 170.7 22.1 4.7 55.5 408 119 C P H > S+ 0 0 13 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.907 127.9 49.4 -58.5 -38.7 25.2 2.6 55.0 409 120 C E H > S+ 0 0 73 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.901 113.6 43.8 -66.8 -44.2 23.0 -0.4 54.1 410 121 C V H > S+ 0 0 13 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.877 111.1 56.2 -69.1 -38.2 20.9 1.6 51.6 411 122 C H H X S+ 0 0 1 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.927 107.6 48.8 -50.5 -52.8 24.1 3.2 50.3 412 123 C A H X S+ 0 0 9 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.922 112.7 47.6 -56.8 -46.0 25.5 -0.3 49.6 413 124 C S H X S+ 0 0 1 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.906 113.4 47.2 -63.4 -41.2 22.3 -1.3 47.8 414 125 C L H X S+ 0 0 0 -4,-2.7 4,-2.8 2,-0.2 5,-0.2 0.876 111.1 52.1 -71.1 -38.5 22.1 1.8 45.7 415 126 C D H X S+ 0 0 17 -4,-2.7 4,-2.2 -5,-0.2 5,-0.2 0.933 109.4 48.6 -58.5 -48.4 25.8 1.4 44.8 416 127 C K H X S+ 0 0 41 -4,-2.5 4,-2.4 -5,-0.2 -2,-0.2 0.923 112.1 52.2 -58.3 -41.5 25.2 -2.1 43.7 417 128 C F H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.940 110.4 43.7 -58.2 -54.1 22.2 -0.8 41.6 418 129 C V H X S+ 0 0 11 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.865 115.1 50.9 -66.7 -31.3 24.0 1.9 39.8 419 130 C L H X S+ 0 0 50 -4,-2.2 4,-2.3 -5,-0.2 -1,-0.2 0.872 107.6 52.6 -69.7 -38.1 26.9 -0.4 39.1 420 131 C A H X S+ 0 0 24 -4,-2.4 4,-1.9 -5,-0.2 -2,-0.2 0.900 110.4 48.4 -61.9 -41.7 24.5 -3.0 37.8 421 132 C V H X S+ 0 0 12 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.943 111.8 49.0 -62.8 -46.9 23.1 -0.4 35.4 422 133 C G H X S+ 0 0 9 -4,-2.4 4,-1.0 1,-0.2 -2,-0.2 0.886 109.8 52.5 -59.9 -40.5 26.6 0.6 34.3 423 134 C T H < S+ 0 0 71 -4,-2.3 3,-0.3 2,-0.2 -1,-0.2 0.879 110.0 48.0 -63.1 -39.0 27.5 -3.0 33.7 424 135 C V H >< S+ 0 0 26 -4,-1.9 3,-1.6 1,-0.2 4,-0.2 0.931 109.8 52.7 -66.3 -44.9 24.5 -3.6 31.6 425 136 C L H 3< S+ 0 0 18 -4,-2.4 -48,-0.3 1,-0.3 -1,-0.2 0.655 112.2 45.3 -68.9 -15.6 25.2 -0.4 29.6 426 137 C T T >< S+ 0 0 10 -4,-1.0 3,-2.1 -3,-0.3 -1,-0.3 0.262 78.9 113.8-107.4 10.6 28.7 -1.6 28.9 427 138 C A G X + 0 0 18 -3,-1.6 3,-2.3 1,-0.3 -1,-0.1 0.790 65.9 63.6 -53.1 -40.1 27.7 -5.1 28.0 428 139 C K G 3 S+ 0 0 80 1,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.333 91.7 66.6 -75.3 10.9 28.7 -4.9 24.3 429 140 C Y G < 0 0 14 -3,-2.1 -1,-0.3 -252,-0.1 -2,-0.2 0.295 360.0 360.0-100.1 1.8 32.3 -4.4 25.5 430 141 C R < 0 0 106 -3,-2.3 -302,-0.1 -429,-0.1 -303,-0.0 -0.674 360.0 360.0-136.4 360.0 32.1 -8.0 26.8 431 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 432 1 D V 0 0 94 0, 0.0 2,-0.4 0, 0.0 -144,-0.1 0.000 360.0 360.0 360.0 125.7 48.3 20.9 41.8 433 2 D H - 0 0 143 0, 0.0 2,-0.5 0, 0.0 77,-0.0 -0.958 360.0-157.3-115.5 136.7 47.1 24.4 42.1 434 3 D W - 0 0 8 -2,-0.4 2,-0.1 4,-0.0 76,-0.0 -0.967 10.8-146.3-115.0 119.1 44.3 25.5 44.5 435 4 D S > - 0 0 23 -2,-0.5 4,-2.6 1,-0.1 5,-0.2 -0.376 28.1-110.5 -72.7 162.1 42.3 28.7 43.8 436 5 D A H > S+ 0 0 72 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.899 121.6 53.1 -56.9 -40.4 41.0 31.0 46.5 437 6 D E H > S+ 0 0 133 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.922 109.4 46.9 -64.2 -43.4 37.5 29.8 45.7 438 7 D E H > S+ 0 0 41 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.924 111.2 51.8 -63.7 -44.7 38.5 26.2 46.0 439 8 D K H X S+ 0 0 80 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.895 110.8 48.6 -57.1 -42.5 40.2 26.8 49.3 440 9 D Q H X S+ 0 0 118 -4,-2.3 4,-1.8 2,-0.2 5,-0.3 0.858 109.4 51.6 -67.3 -38.4 37.1 28.6 50.6 441 10 D L H X S+ 0 0 42 -4,-2.1 4,-1.1 -5,-0.2 -1,-0.2 0.887 115.8 42.8 -65.1 -36.9 34.8 25.8 49.5 442 11 D I H X S+ 0 0 0 -4,-2.1 4,-2.6 -5,-0.2 -2,-0.2 0.952 117.3 42.4 -72.9 -51.9 37.0 23.3 51.4 443 12 D T H X S+ 0 0 66 -4,-2.8 4,-2.4 1,-0.2 -3,-0.2 0.841 111.1 55.1 -70.3 -29.6 37.7 25.2 54.6 444 13 D S H < S+ 0 0 49 -4,-1.8 4,-0.4 -5,-0.2 -1,-0.2 0.930 113.3 41.4 -72.2 -42.0 34.2 26.4 55.0 445 14 D I H >< S+ 0 0 8 -4,-1.1 3,-1.7 -5,-0.3 4,-0.3 0.940 114.3 52.5 -64.2 -47.6 32.8 22.9 54.9 446 15 D W H >< S+ 0 0 38 -4,-2.6 3,-1.7 1,-0.3 -2,-0.2 0.862 97.9 64.8 -61.4 -37.0 35.6 21.5 57.0 447 16 D G T 3< S+ 0 0 67 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.673 108.2 42.6 -58.0 -18.1 35.0 24.1 59.8 448 17 D K T < S+ 0 0 149 -3,-1.7 2,-0.4 -4,-0.4 -1,-0.3 0.322 88.4 116.6-111.6 2.8 31.6 22.5 60.3 449 18 D V < - 0 0 18 -3,-1.7 2,-0.9 -4,-0.3 3,-0.1 -0.585 56.8-145.8 -76.9 129.1 32.6 18.9 60.1 450 19 D N > - 0 0 75 -2,-0.4 4,-2.9 1,-0.2 5,-0.4 -0.841 13.0-163.3 -86.2 105.3 32.2 16.6 63.1 451 20 D V H > S+ 0 0 28 -2,-0.9 4,-1.9 1,-0.2 48,-0.2 0.828 84.5 52.4 -65.3 -33.8 35.2 14.4 62.6 452 21 D A H > S+ 0 0 35 2,-0.2 4,-2.3 3,-0.2 -1,-0.2 0.969 116.6 37.6 -65.1 -51.5 33.9 11.7 65.0 453 22 D D H > S+ 0 0 105 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.935 121.0 44.1 -66.5 -48.0 30.5 11.4 63.4 454 23 D C H X S+ 0 0 5 -4,-2.9 4,-2.4 2,-0.2 -1,-0.2 0.866 114.6 51.5 -66.3 -33.2 31.7 11.8 59.8 455 24 D G H X S+ 0 0 1 -4,-1.9 4,-2.2 -5,-0.4 5,-0.3 0.922 108.0 49.8 -72.7 -42.7 34.6 9.4 60.5 456 25 D A H X S+ 0 0 21 -4,-2.3 4,-2.0 -5,-0.2 5,-0.2 0.901 113.7 47.7 -53.4 -44.1 32.4 6.7 61.9 457 26 D E H X S+ 0 0 77 -4,-2.0 4,-2.4 -5,-0.2 -2,-0.2 0.932 111.4 49.7 -65.2 -47.3 30.1 7.0 58.9 458 27 D A H X S+ 0 0 8 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.910 114.0 42.4 -62.9 -44.5 32.9 7.0 56.4 459 28 D L H X S+ 0 0 7 -4,-2.2 4,-2.2 2,-0.2 5,-0.2 0.924 113.3 51.8 -75.0 -37.8 34.7 3.9 57.7 460 29 D A H X S+ 0 0 6 -4,-2.0 4,-2.0 -5,-0.3 5,-0.2 0.950 111.5 49.1 -58.4 -43.6 31.5 1.9 58.3 461 30 D R H X S+ 0 0 13 -4,-2.4 4,-3.0 1,-0.2 5,-0.5 0.890 107.6 53.7 -65.1 -38.6 30.5 2.7 54.8 462 31 D L H X S+ 0 0 14 -4,-2.1 4,-1.8 1,-0.2 7,-0.3 0.952 113.2 43.4 -56.8 -48.5 33.9 1.6 53.4 463 32 D L H < S+ 0 0 0 -4,-2.2 7,-0.3 1,-0.2 -2,-0.2 0.814 121.7 39.0 -69.0 -31.5 33.6 -1.8 55.2 464 33 D I H < S+ 0 0 22 -4,-2.0 -2,-0.2 -5,-0.2 -3,-0.2 0.873 120.7 40.7 -87.1 -42.8 29.9 -2.3 54.2 465 34 D V H < S+ 0 0 5 -4,-3.0 -3,-0.2 1,-0.3 -2,-0.2 0.853 129.2 29.5 -77.7 -34.3 29.9 -1.0 50.7 466 35 D Y S >< S- 0 0 22 -4,-1.8 3,-2.3 -5,-0.5 -1,-0.3 -0.731 76.0-178.0-126.0 75.8 33.3 -2.5 49.7 467 36 D P G > S+ 0 0 22 0, 0.0 3,-1.6 0, 0.0 4,-0.2 0.656 70.5 72.3 -64.8 -19.1 33.5 -5.6 51.9 468 37 D W G > S+ 0 0 23 1,-0.3 3,-1.7 2,-0.2 4,-0.3 0.760 84.8 72.6 -60.7 -24.2 36.9 -6.8 50.8 469 38 D T G X S+ 0 0 2 -3,-2.3 3,-1.5 -7,-0.3 4,-0.3 0.743 77.5 76.9 -64.8 -20.6 38.3 -3.9 52.8 470 39 D Q G X S+ 0 0 29 -3,-1.6 3,-1.6 -7,-0.3 -1,-0.3 0.780 78.3 74.7 -55.9 -27.1 37.3 -5.8 56.0 471 40 D R G X S+ 0 0 76 -3,-1.7 3,-0.6 1,-0.3 -1,-0.3 0.812 91.8 53.3 -56.3 -32.8 40.4 -7.9 55.3 472 41 D F G < S+ 0 0 52 -3,-1.5 -1,-0.3 -4,-0.3 3,-0.2 0.603 107.0 52.1 -78.9 -11.2 42.6 -5.0 56.5 473 42 D F G X + 0 0 32 -3,-1.6 3,-1.9 -4,-0.3 -1,-0.2 -0.170 60.3 134.3-122.5 39.1 40.8 -4.7 59.8 474 43 D S G X S+ 0 0 106 -3,-0.6 3,-0.9 1,-0.3 -1,-0.1 0.838 71.9 57.8 -60.2 -33.9 40.8 -8.2 61.3 475 44 D S G 3 S+ 0 0 104 1,-0.2 -1,-0.3 -3,-0.2 3,-0.1 0.436 84.1 84.6 -78.0 0.6 41.8 -6.9 64.7 476 45 D F G < S- 0 0 34 -3,-1.9 2,-0.4 1,-0.3 14,-0.4 0.472 89.7-135.3 -85.2 -1.7 38.8 -4.6 65.0 477 46 D G < + 0 0 52 -3,-0.9 2,-0.6 -4,-0.1 -1,-0.3 -0.707 68.3 32.7 93.3-131.9 36.5 -7.4 66.4 478 47 D N + 0 0 90 -2,-0.4 3,-0.1 1,-0.1 10,-0.1 -0.517 50.4 145.3 -77.7 108.5 33.0 -8.0 65.1 479 48 D L + 0 0 22 -2,-0.6 -1,-0.1 1,-0.1 6,-0.1 -0.106 33.8 124.0-123.4 30.7 32.5 -7.1 61.4 480 49 D S S S+ 0 0 97 4,-0.0 2,-0.3 2,-0.0 -1,-0.1 0.590 75.0 6.9 -75.5 -16.4 30.0 -9.9 60.9 481 50 D S S > S- 0 0 52 1,-0.1 4,-2.3 -3,-0.1 5,-0.2 -0.968 78.2-101.3-157.1 164.5 27.1 -7.8 59.6 482 51 D A H > S+ 0 0 21 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.910 123.9 50.4 -57.6 -41.9 26.3 -4.3 58.5 483 52 D T H > S+ 0 0 103 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.926 110.0 48.9 -63.4 -45.0 24.7 -3.6 61.8 484 53 D A H > S+ 0 0 19 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.886 110.0 52.5 -61.8 -37.6 27.7 -5.0 63.8 485 54 D I H >< S+ 0 0 3 -4,-2.3 3,-1.1 1,-0.2 -2,-0.2 0.943 109.5 47.7 -67.2 -45.7 30.0 -2.8 61.7 486 55 D S H 3< S+ 0 0 49 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.782 116.2 45.5 -65.1 -27.7 28.0 0.4 62.4 487 56 D G H 3< S+ 0 0 45 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.436 84.8 115.3 -91.5 -3.2 27.9 -0.5 66.1 488 57 D N S+ 0 0 89 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.798 92.3 55.8 -69.7 -25.0 33.5 1.0 68.7 490 59 D N H > S+ 0 0 77 -14,-0.4 4,-2.6 2,-0.2 5,-0.2 0.888 107.2 49.6 -72.8 -38.5 36.8 0.2 67.1 491 60 D V H > S+ 0 0 2 -15,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.933 112.4 49.0 -60.8 -45.4 35.5 1.2 63.7 492 61 D K H X S+ 0 0 94 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.930 112.4 47.1 -59.1 -47.7 34.1 4.4 65.3 493 62 D A H X S+ 0 0 57 -4,-2.5 4,-1.3 1,-0.2 -2,-0.2 0.933 114.3 45.8 -63.3 -46.9 37.4 5.2 66.9 494 63 D H H X S+ 0 0 58 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.899 107.0 59.3 -64.7 -39.7 39.5 4.6 63.9 495 64 D G H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.887 102.4 53.8 -53.6 -41.4 37.1 6.5 61.7 496 65 D K H X S+ 0 0 113 -4,-1.7 4,-2.3 1,-0.2 -1,-0.2 0.911 107.9 50.0 -62.1 -40.6 37.7 9.6 63.8 497 66 D K H X S+ 0 0 149 -4,-1.3 4,-2.0 2,-0.2 -2,-0.2 0.910 109.3 51.5 -63.1 -42.1 41.5 9.2 63.2 498 67 D V H X S+ 0 0 37 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.940 112.3 45.2 -62.7 -47.7 41.0 8.9 59.5 499 68 D L H X S+ 0 0 3 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.876 109.0 55.5 -64.7 -38.7 38.9 12.1 59.3 500 69 D T H X S+ 0 0 68 -4,-2.3 4,-1.1 -5,-0.2 -1,-0.2 0.914 107.3 52.4 -58.6 -37.7 41.3 14.0 61.6 501 70 D S H >X S+ 0 0 22 -4,-2.0 4,-1.0 1,-0.2 3,-0.9 0.927 104.6 52.6 -64.9 -46.4 44.0 13.1 59.0 502 71 D F H >X S+ 0 0 20 -4,-2.1 4,-2.0 1,-0.3 3,-0.8 0.878 103.6 60.9 -54.3 -35.7 41.9 14.5 56.2 503 72 D G H 3X S+ 0 0 4 -4,-1.9 4,-2.0 1,-0.2 -1,-0.3 0.837 96.1 59.2 -59.3 -34.1 41.8 17.6 58.4 504 73 D D H < S+ 0 0 10 -4,-2.0 3,-0.6 1,-0.2 -2,-0.2 0.871 105.4 57.8 -54.1 -40.5 42.6 20.8 54.6 507 76 D K H 3< S+ 0 0 173 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.713 124.0 17.7 -69.1 -26.8 45.0 22.8 56.9 508 77 D N T X< + 0 0 77 -3,-0.9 3,-1.6 -4,-0.6 -1,-0.3 -0.574 67.2 173.6-147.2 81.4 47.8 22.9 54.4 509 78 D L G X S+ 0 0 14 -3,-0.6 3,-1.0 1,-0.3 -1,-0.1 0.811 78.5 56.1 -61.2 -32.8 46.5 22.2 50.9 510 79 D D G 3 S+ 0 0 101 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.578 108.5 47.9 -78.6 -8.3 49.8 23.0 49.1 511 80 D N G <> + 0 0 78 -3,-1.6 4,-2.6 -6,-0.2 -1,-0.2 0.006 67.4 122.5-120.1 26.9 51.7 20.4 51.2 512 81 D I H <> S+ 0 0 2 -3,-1.0 4,-2.0 1,-0.2 5,-0.1 0.906 73.5 57.5 -56.4 -40.3 49.5 17.4 51.0 513 82 D K H 4 S+ 0 0 125 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.937 112.8 39.4 -56.6 -48.9 52.4 15.3 49.5 514 83 D G H >4 S+ 0 0 39 1,-0.2 3,-1.3 2,-0.2 4,-0.4 0.918 111.1 57.6 -66.7 -42.6 54.6 16.0 52.5 515 84 D T H 3< S+ 0 0 48 -4,-2.6 4,-0.3 1,-0.3 3,-0.3 0.849 113.7 39.1 -59.1 -35.9 51.8 15.7 55.1 516 85 D F T 3X S+ 0 0 4 -4,-2.0 4,-2.2 -5,-0.2 -1,-0.3 0.350 84.2 101.6-100.2 7.5 51.0 12.1 53.9 517 86 D A H <> S+ 0 0 24 -3,-1.3 4,-1.4 -4,-0.4 -1,-0.2 0.900 86.0 44.0 -59.0 -43.8 54.5 10.8 53.3 518 87 D Q H > S+ 0 0 174 -4,-0.4 4,-1.8 -3,-0.3 -1,-0.2 0.926 113.2 51.0 -70.4 -42.6 54.7 8.8 56.5 519 88 D L H > S+ 0 0 58 -4,-0.3 4,-2.9 1,-0.2 5,-0.2 0.819 103.3 61.2 -63.1 -28.9 51.1 7.4 56.1 520 89 D S H X>S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 5,-0.6 0.920 102.3 51.3 -63.0 -42.5 52.1 6.4 52.6 521 90 D E H X>S+ 0 0 78 -4,-1.4 5,-1.7 -3,-0.2 4,-0.8 0.940 112.8 46.2 -56.4 -47.7 54.8 4.1 54.1 522 91 D L H <>S+ 0 0 71 -4,-1.8 5,-1.8 3,-0.2 4,-0.4 0.950 119.0 38.5 -61.0 -50.9 52.2 2.6 56.4 523 92 D H H <5S+ 0 0 48 -4,-2.9 6,-2.6 3,-0.2 -2,-0.2 0.849 127.9 30.4 -73.2 -35.0 49.5 2.1 53.8 524 93 D C H X5S+ 0 0 2 -4,-2.9 4,-0.9 -5,-0.2 -3,-0.2 0.954 128.8 28.0 -88.3 -64.0 51.7 1.0 50.9 525 94 D D T < - 0 0 36 -2,-0.5 3,-1.9 1,-0.1 4,-0.5 -0.445 19.5-125.0 -64.4 135.0 45.8 -1.1 46.6 531 100 D P T >> S+ 0 0 46 0, 0.0 4,-1.4 0, 0.0 3,-0.9 0.703 103.9 74.5 -54.7 -22.1 45.4 2.6 45.8 532 101 D E H 3> S+ 0 0 69 1,-0.3 4,-2.1 2,-0.2 5,-0.1 0.868 90.6 59.2 -60.0 -33.4 42.0 2.0 44.2 533 102 D N H <> S+ 0 0 9 -3,-1.9 4,-2.3 1,-0.2 -1,-0.3 0.797 98.0 57.7 -64.8 -29.0 40.7 1.7 47.7 534 103 D F H <> S+ 0 0 22 -3,-0.9 4,-2.1 -4,-0.5 -1,-0.2 0.892 106.8 49.5 -66.2 -39.6 41.9 5.2 48.5 535 104 D R H X S+ 0 0 39 -4,-1.4 4,-2.4 2,-0.2 -2,-0.2 0.923 110.1 50.5 -60.3 -46.3 39.7 6.4 45.6 536 105 D L H X S+ 0 0 17 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.903 109.8 49.2 -63.4 -40.8 36.7 4.5 47.0 537 106 D L H X S+ 0 0 30 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.918 109.8 53.4 -62.6 -40.7 37.2 6.0 50.5 538 107 D G H X S+ 0 0 1 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.917 108.4 48.6 -57.6 -47.0 37.4 9.4 48.9 539 108 D D H X S+ 0 0 7 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.904 111.0 51.1 -59.1 -44.7 34.1 8.8 47.1 540 109 D I H X S+ 0 0 1 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.934 108.4 51.7 -58.8 -45.9 32.5 7.6 50.4 541 110 D L H X S+ 0 0 2 -4,-2.8 4,-2.9 1,-0.2 5,-0.2 0.924 107.7 52.4 -58.0 -43.9 33.7 10.8 52.1 542 111 D V H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.917 110.8 47.4 -58.1 -43.7 32.2 12.9 49.4 543 112 D I H X S+ 0 0 4 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.903 111.1 51.7 -63.6 -41.6 28.8 11.1 49.9 544 113 D I H X S+ 0 0 9 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.935 111.6 46.3 -60.3 -45.6 29.1 11.6 53.7 545 114 D L H X S+ 0 0 0 -4,-2.9 4,-3.0 1,-0.2 5,-0.4 0.916 110.7 53.2 -63.9 -41.3 29.7 15.3 53.3 546 115 D A H X S+ 0 0 0 -4,-2.5 4,-2.2 -5,-0.2 7,-0.2 0.926 110.4 47.9 -58.0 -44.6 26.8 15.6 50.8 547 116 D A H < S+ 0 0 22 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.872 116.7 42.3 -64.6 -39.0 24.5 13.9 53.4 548 117 D H H < S+ 0 0 112 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.911 123.3 34.4 -76.4 -40.2 25.6 16.1 56.2 549 118 D F H >< S+ 0 0 19 -4,-3.0 3,-2.3 1,-0.2 -2,-0.2 0.645 81.7 175.8 -97.3 -14.5 25.7 19.4 54.4 550 119 D G G >< S+ 0 0 11 -4,-2.2 3,-1.9 -5,-0.4 -1,-0.2 -0.175 71.6 12.0 54.4-120.3 22.8 18.9 52.0 551 120 D K G 3 S+ 0 0 148 1,-0.3 -1,-0.3 -151,-0.2 -2,-0.1 0.747 122.8 65.0 -70.1 -16.5 22.1 22.0 50.0 552 121 D D G < S+ 0 0 118 -3,-2.3 2,-1.7 1,-0.2 -1,-0.3 0.654 82.7 82.5 -72.5 -14.9 25.4 23.6 51.1 553 122 D F S < S- 0 0 0 -3,-1.9 -1,-0.2 -7,-0.2 -3,-0.1 -0.525 73.8-179.1 -90.0 70.2 27.3 20.9 49.2 554 123 D T > - 0 0 44 -2,-1.7 4,-2.7 1,-0.1 5,-0.2 -0.041 44.1 -99.2 -65.9 167.4 26.9 22.6 45.9 555 124 D P H > S+ 0 0 22 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.909 127.5 49.4 -55.3 -41.1 28.3 21.1 42.6 556 125 D E H > S+ 0 0 80 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.872 109.9 51.1 -66.6 -36.3 31.4 23.4 42.9 557 126 D C H > S+ 0 0 2 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.930 110.1 49.6 -64.7 -44.2 31.9 22.3 46.5 558 127 D Q H X S+ 0 0 0 -4,-2.7 4,-2.9 1,-0.2 5,-0.3 0.913 108.8 52.7 -58.7 -45.7 31.7 18.7 45.3 559 128 D A H X S+ 0 0 26 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.908 110.7 47.2 -58.9 -41.1 34.3 19.4 42.6 560 129 D A H X S+ 0 0 2 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.888 114.3 46.4 -68.1 -40.7 36.7 20.9 45.2 561 130 D W H X S+ 0 0 0 -4,-2.2 4,-2.8 2,-0.2 5,-0.2 0.871 110.7 51.2 -71.5 -39.3 36.2 17.9 47.6 562 131 D Q H X S+ 0 0 6 -4,-2.9 4,-2.0 2,-0.2 -2,-0.2 0.930 111.2 49.9 -61.5 -43.4 36.6 15.3 44.9 563 132 D K H X S+ 0 0 48 -4,-2.1 4,-2.3 -5,-0.3 -2,-0.2 0.940 110.7 50.2 -56.4 -48.2 39.8 17.1 43.9 564 133 D L H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.934 110.6 47.5 -58.9 -49.0 41.0 17.1 47.5 565 134 D V H X S+ 0 0 4 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.841 112.2 50.7 -65.7 -29.7 40.3 13.4 48.0 566 135 D R H X S+ 0 0 60 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.880 110.4 48.9 -70.9 -39.2 42.1 12.6 44.8 567 136 D V H X S+ 0 0 11 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.900 113.0 47.6 -69.1 -41.8 45.1 14.6 45.8 568 137 D V H X S+ 0 0 4 -4,-2.6 4,-2.7 2,-0.2 5,-0.2 0.943 111.4 51.2 -59.5 -48.1 45.2 12.9 49.2 569 138 D A H X S+ 0 0 11 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.904 110.5 48.5 -55.8 -44.6 44.9 9.5 47.5 570 139 D H H < S+ 0 0 72 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.894 111.2 50.6 -66.0 -37.2 47.8 10.3 45.2 571 140 D A H >< S+ 0 0 6 -4,-2.1 3,-1.3 1,-0.2 4,-0.2 0.898 110.3 49.6 -64.4 -41.3 49.9 11.4 48.2 572 141 D L H 3< S+ 0 0 21 -4,-2.7 3,-0.4 1,-0.3 -1,-0.2 0.794 109.9 51.4 -67.3 -29.3 49.1 8.2 50.0 573 142 D A T >< S+ 0 0 17 -4,-1.6 3,-2.6 -5,-0.2 -1,-0.3 0.370 77.5 108.8 -85.8 3.7 50.1 6.2 47.0 574 143 D R T < + 0 0 81 -3,-1.3 -1,-0.2 1,-0.3 -2,-0.1 0.830 69.2 62.4 -50.9 -41.0 53.4 8.0 46.7 575 144 D K T 3 S+ 0 0 57 -3,-0.4 -1,-0.3 -4,-0.2 -2,-0.1 0.622 102.4 62.4 -63.0 -16.8 55.4 5.0 47.8 576 145 D Y < 0 0 61 -3,-2.6 -52,-0.0 -433,-0.0 -51,-0.0 -0.073 360.0 360.0 -85.4-157.7 54.0 3.2 44.6 577 146 D H 0 0 82 -2,-0.1 -3,-0.1 -434,-0.0 -2,-0.1 0.473 360.0 360.0 -54.4 360.0 54.8 4.4 41.0