==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DNA-BINDING PROTEIN 16-MAR-06 2CHP . COMPND 2 MOLECULE: METALLOREGULATION DNA-BINDING STRESS PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR L.-O.ESSEN,A.MORBITZER . 585 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25648.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 457 78.1 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 . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 19 3.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 425 72.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.4 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 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 1 0 0 10 1 1 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 6 A A > 0 0 91 0, 0.0 4,-1.6 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -67.7 32.9 45.9 31.3 2 7 A K H > + 0 0 187 2,-0.2 4,-2.2 3,-0.1 5,-0.1 0.836 360.0 49.6 -68.8 -40.3 33.3 46.8 27.6 3 8 A T H > S+ 0 0 93 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.932 107.5 53.8 -61.5 -45.4 29.6 46.1 27.3 4 9 A N H > S+ 0 0 44 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.899 111.3 46.5 -53.2 -43.6 29.1 48.4 30.4 5 10 A Q H X S+ 0 0 49 -4,-1.6 4,-2.6 2,-0.2 -1,-0.2 0.916 111.5 49.2 -66.3 -46.6 31.0 51.2 28.6 6 11 A T H X S+ 0 0 70 -4,-2.2 4,-2.6 1,-0.2 5,-0.2 0.902 108.9 54.0 -63.4 -38.5 29.1 50.7 25.3 7 12 A L H X S+ 0 0 78 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.901 109.8 47.5 -62.3 -42.8 25.7 50.8 27.1 8 13 A V H X S+ 0 0 0 -4,-1.8 4,-2.2 -5,-0.2 -2,-0.2 0.981 112.9 48.3 -60.4 -50.4 26.7 54.2 28.7 9 14 A E H X S+ 0 0 35 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.909 112.3 48.5 -59.2 -48.4 27.9 55.7 25.3 10 15 A N H X S+ 0 0 91 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.897 110.0 52.0 -57.4 -42.4 24.7 54.5 23.5 11 16 A S H X S+ 0 0 17 -4,-2.0 4,-1.9 -5,-0.2 -1,-0.2 0.889 108.1 51.4 -65.1 -37.8 22.5 56.0 26.3 12 17 A L H X S+ 0 0 0 -4,-2.2 4,-3.0 2,-0.2 -1,-0.2 0.901 107.3 53.8 -66.1 -38.3 24.3 59.4 26.0 13 18 A N H X S+ 0 0 13 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.870 107.7 50.4 -62.9 -38.6 23.7 59.4 22.2 14 19 A T H X S+ 0 0 38 -4,-2.0 4,-2.4 2,-0.2 68,-0.3 0.916 113.9 44.3 -62.2 -44.3 19.9 58.9 22.8 15 20 A Q H X S+ 0 0 6 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.899 111.0 53.1 -70.8 -40.7 19.8 61.8 25.3 16 21 A L H X S+ 0 0 0 -4,-3.0 4,-2.2 2,-0.2 -1,-0.2 0.929 111.4 48.7 -53.3 -45.5 21.9 64.0 23.0 17 22 A S H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.930 109.5 51.3 -63.7 -42.4 19.4 63.3 20.3 18 23 A N H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.911 110.3 48.9 -57.6 -49.2 16.5 64.1 22.6 19 24 A W H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.872 110.4 50.4 -66.6 -36.3 17.9 67.4 23.6 20 25 A F H X S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.947 112.5 46.6 -63.4 -44.3 18.6 68.4 19.9 21 26 A L H X S+ 0 0 3 -4,-2.7 4,-2.8 2,-0.2 -2,-0.2 0.878 111.0 52.9 -66.3 -34.1 15.0 67.5 18.9 22 27 A L H X S+ 0 0 0 -4,-2.4 4,-2.6 -5,-0.2 -1,-0.2 0.920 105.9 53.3 -63.4 -43.4 13.7 69.4 22.0 23 28 A Y H X S+ 0 0 9 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.917 111.6 47.4 -54.5 -44.3 15.8 72.5 20.9 24 29 A S H >X S+ 0 0 0 -4,-2.1 4,-1.7 2,-0.2 3,-0.5 0.955 111.2 49.3 -61.2 -53.2 14.0 72.2 17.4 25 30 A K H 3X S+ 0 0 8 -4,-2.8 4,-2.7 1,-0.3 5,-0.2 0.880 106.1 57.8 -54.8 -39.8 10.5 71.8 19.0 26 31 A L H 3X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -1,-0.3 0.853 103.4 52.8 -65.5 -35.0 11.1 74.8 21.2 27 32 A H H S- 0 0 45 -2,-0.3 3,-2.6 1,-0.2 56,-0.0 -0.325 98.0 -47.2 94.1 175.5 -3.1 84.2 22.3 36 41 A P T 3 S+ 0 0 125 0, 0.0 3,-0.3 0, 0.0 4,-0.2 0.657 132.3 59.4 -68.4 -11.3 -2.9 86.6 25.2 37 42 A H T 3> S+ 0 0 39 -3,-0.3 4,-2.7 1,-0.2 5,-0.4 0.289 74.1 113.2 -91.4 10.7 0.1 84.7 26.8 38 43 A F H <> S+ 0 0 66 -3,-2.6 4,-2.9 2,-0.2 5,-0.3 0.910 73.9 45.9 -44.5 -56.1 2.1 85.3 23.6 39 44 A F H > S+ 0 0 146 -3,-0.3 4,-2.0 1,-0.2 5,-0.2 0.969 115.7 45.4 -63.1 -45.1 4.7 87.6 25.1 40 45 A T H > S+ 0 0 42 -4,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.910 119.7 38.8 -60.6 -47.9 5.3 85.4 28.2 41 46 A L H X S+ 0 0 0 -4,-2.7 4,-2.8 2,-0.2 5,-0.2 0.864 110.6 57.7 -79.6 -36.6 5.5 82.1 26.3 42 47 A H H X S+ 0 0 31 -4,-2.9 4,-1.2 -5,-0.4 -1,-0.2 0.939 115.4 40.0 -53.1 -46.5 7.5 83.4 23.2 43 48 A E H X S+ 0 0 109 -4,-2.0 4,-2.2 -5,-0.3 -2,-0.2 0.926 113.7 51.9 -70.5 -47.8 10.2 84.6 25.7 44 49 A K H X S+ 0 0 19 -4,-2.5 4,-2.4 -5,-0.2 -2,-0.2 0.897 107.4 53.7 -55.1 -43.9 10.0 81.5 28.0 45 50 A F H X S+ 0 0 0 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.863 107.6 50.2 -63.2 -37.6 10.4 79.1 25.0 46 51 A E H X S+ 0 0 77 -4,-1.2 4,-2.1 -5,-0.2 -1,-0.2 0.904 108.9 52.1 -63.7 -45.3 13.6 81.0 23.9 47 52 A E H X S+ 0 0 117 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.920 111.2 48.6 -54.5 -42.5 15.0 80.7 27.4 48 53 A L H X S+ 0 0 5 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.881 109.7 49.8 -68.0 -40.7 14.3 77.0 27.3 49 54 A Y H X S+ 0 0 11 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.831 106.6 56.0 -68.8 -31.7 15.9 76.5 23.9 50 55 A D H X S+ 0 0 80 -4,-2.1 4,-1.5 2,-0.2 -2,-0.2 0.931 110.5 46.2 -60.5 -43.9 19.0 78.4 25.0 51 56 A H H X S+ 0 0 34 -4,-1.8 4,-1.9 1,-0.2 -2,-0.2 0.875 109.6 53.5 -64.9 -37.9 19.2 75.8 27.9 52 57 A A H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 -1,-0.2 0.898 107.3 51.9 -62.9 -41.8 18.6 72.9 25.5 53 58 A A H X S+ 0 0 21 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.888 109.4 49.6 -61.2 -39.3 21.6 74.1 23.3 54 59 A E H X S+ 0 0 125 -4,-1.5 4,-2.5 2,-0.2 -1,-0.2 0.889 111.1 49.4 -65.5 -43.0 23.9 74.2 26.3 55 60 A T H X S+ 0 0 6 -4,-1.9 4,-2.6 2,-0.2 5,-0.3 0.897 106.7 55.6 -65.7 -45.3 22.8 70.7 27.3 56 61 A V H X S+ 0 0 1 -4,-2.7 4,-2.2 2,-0.2 5,-0.2 0.937 112.0 43.5 -47.0 -53.4 23.4 69.4 23.7 57 62 A D H X S+ 0 0 28 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.917 112.8 52.3 -67.3 -37.6 27.0 70.7 23.9 58 63 A T H X S+ 0 0 73 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.904 112.1 44.3 -63.5 -44.9 27.5 69.4 27.5 59 64 A I H X S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 5,-0.2 0.929 113.6 50.1 -66.3 -45.4 26.4 65.8 26.7 60 65 A A H X S+ 0 0 0 -4,-2.2 4,-2.3 -5,-0.3 -2,-0.2 0.931 111.9 47.8 -62.7 -43.2 28.4 65.6 23.5 61 66 A E H X S+ 0 0 71 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.847 111.1 50.8 -68.5 -32.2 31.6 66.8 25.2 62 67 A R H X S+ 0 0 67 -4,-1.9 4,-1.5 2,-0.2 6,-0.2 0.935 109.6 51.3 -66.8 -43.7 31.1 64.4 28.1 63 68 A L H <>S+ 0 0 2 -4,-2.9 5,-2.5 1,-0.2 3,-0.3 0.923 111.9 47.0 -56.7 -45.8 30.6 61.5 25.5 64 69 A L H ><5S+ 0 0 52 -4,-2.3 3,-2.0 1,-0.2 -1,-0.2 0.942 107.7 56.3 -59.9 -44.9 33.8 62.6 23.8 65 70 A A H 3<5S+ 0 0 72 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.774 106.1 50.4 -64.0 -24.4 35.7 62.8 27.1 66 71 A I T 3<5S- 0 0 30 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.336 127.5 -96.2 -93.6 6.3 34.9 59.2 27.9 67 72 A G T < 5S+ 0 0 47 -3,-2.0 -3,-0.2 1,-0.2 -2,-0.1 0.481 82.2 127.9 94.6 7.1 36.1 57.9 24.5 68 73 A G < - 0 0 3 -5,-2.5 -1,-0.2 -6,-0.2 -62,-0.0 -0.221 57.7-118.6 -88.9-179.5 32.8 57.8 22.6 69 74 A Q - 0 0 114 -2,-0.1 2,-0.1 111,-0.0 -5,-0.1 -0.889 24.4-144.1-127.9 97.0 31.5 59.2 19.4 70 75 A P - 0 0 2 0, 0.0 2,-0.1 0, 0.0 -10,-0.0 -0.309 20.5-117.1 -60.4 137.7 28.6 61.6 19.5 71 76 A V + 0 0 8 1,-0.1 3,-0.0 5,-0.1 -11,-0.0 -0.433 34.9 178.9 -67.8 151.3 25.9 61.5 16.8 72 77 A A + 0 0 2 -2,-0.1 104,-0.3 107,-0.0 2,-0.3 0.120 43.1 79.5-157.8 27.8 26.0 64.8 14.9 73 78 A T S > S- 0 0 21 102,-0.1 4,-2.4 1,-0.1 5,-0.2 -0.961 75.4-121.4-143.5 152.9 23.4 64.9 12.1 74 79 A V H > S+ 0 0 1 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.849 113.5 56.1 -69.9 -30.5 19.7 65.5 12.1 75 80 A K H > S+ 0 0 137 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.940 109.9 46.3 -63.4 -43.9 19.1 62.0 10.5 76 81 A E H > S+ 0 0 68 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.893 110.5 52.4 -63.7 -45.0 21.0 60.4 13.3 77 82 A Y H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.944 110.0 49.3 -54.8 -46.9 19.1 62.5 16.0 78 83 A T H < S+ 0 0 81 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.904 115.0 44.8 -60.6 -42.3 15.8 61.3 14.4 79 84 A E H < S+ 0 0 120 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.789 119.6 39.0 -75.8 -27.1 17.0 57.6 14.5 80 85 A H H < S+ 0 0 74 -4,-2.2 -2,-0.2 -5,-0.1 -1,-0.2 0.676 93.8 95.9 -98.5 -22.3 18.4 57.7 18.0 81 86 A A < - 0 0 22 -4,-2.4 -66,-0.1 -5,-0.2 -67,-0.1 -0.325 58.0-151.8 -69.6 159.7 15.9 59.8 20.0 82 87 A S S S+ 0 0 49 -68,-0.3 2,-0.2 -2,-0.0 -1,-0.1 0.348 85.4 50.8-104.8 -3.9 13.0 58.5 22.1 83 88 A I S S- 0 0 19 22,-0.0 2,-0.3 23,-0.0 -2,-0.1 -0.697 75.9-137.6-123.5 177.3 11.1 61.7 21.4 84 89 A T - 0 0 82 -2,-0.2 18,-0.0 2,-0.2 -2,-0.0 -0.946 16.8-139.7-135.1 154.0 10.2 63.8 18.2 85 90 A D S S+ 0 0 7 -2,-0.3 -57,-0.1 -60,-0.0 -1,-0.0 0.442 81.8 93.5 -87.3 -4.0 10.2 67.4 17.3 86 91 A G + 0 0 20 2,-0.0 2,-0.2 135,-0.0 -2,-0.2 -0.087 44.8 122.3 -79.3 177.5 6.9 66.8 15.4 87 92 A G - 0 0 38 1,-0.1 -2,-0.0 2,-0.0 11,-0.0 -0.667 60.3-104.6 142.3 167.9 3.3 67.1 16.7 88 93 A N + 0 0 170 -2,-0.2 2,-0.4 6,-0.1 -1,-0.1 -0.246 55.6 150.0-122.6 41.8 0.0 68.8 16.1 89 94 A E + 0 0 41 1,-0.2 3,-0.0 5,-0.1 -2,-0.0 -0.631 6.4 153.9 -80.8 135.5 -0.0 71.5 18.8 90 95 A T + 0 0 77 -2,-0.4 -56,-0.2 1,-0.0 -1,-0.2 0.708 51.9 65.7-124.6 -47.1 -1.9 74.7 18.1 91 96 A S S > S- 0 0 44 1,-0.1 4,-2.1 -58,-0.1 5,-0.2 -0.398 83.2-115.2 -83.3 159.1 -3.0 76.3 21.4 92 97 A A H > S+ 0 0 13 -58,-0.3 4,-2.6 1,-0.2 5,-0.2 0.933 116.7 51.0 -57.3 -46.4 -0.8 77.7 24.2 93 98 A S H > S+ 0 0 64 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.865 108.3 51.5 -61.3 -36.6 -1.9 74.9 26.6 94 99 A E H > S+ 0 0 98 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.899 111.2 47.8 -65.4 -43.0 -1.2 72.1 24.1 95 100 A M H X S+ 0 0 3 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.936 113.6 46.9 -60.4 -48.1 2.4 73.5 23.6 96 101 A V H X S+ 0 0 0 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.918 113.1 49.6 -65.0 -41.5 3.0 73.8 27.3 97 102 A Q H X S+ 0 0 80 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.877 106.1 56.3 -60.1 -40.6 1.6 70.3 27.9 98 103 A A H X S+ 0 0 9 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.920 108.5 47.8 -60.0 -41.7 3.8 68.9 25.1 99 104 A L H X S+ 0 0 0 -4,-1.9 4,-2.7 2,-0.2 5,-0.3 0.857 108.0 53.5 -67.8 -40.3 6.9 70.2 26.9 100 105 A V H X S+ 0 0 2 -4,-1.9 4,-2.3 2,-0.2 5,-0.2 0.926 110.2 50.5 -56.4 -40.6 5.8 68.8 30.3 101 106 A N H X S+ 0 0 89 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.955 113.6 42.9 -67.6 -46.6 5.5 65.4 28.5 102 107 A D H X S+ 0 0 15 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.917 114.5 49.4 -66.5 -41.9 9.0 65.6 26.9 103 108 A Y H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.896 111.3 50.2 -68.7 -36.9 10.7 66.9 30.1 104 109 A K H X S+ 0 0 123 -4,-2.3 4,-2.5 -5,-0.3 -1,-0.2 0.914 111.9 47.7 -65.3 -38.7 9.0 64.1 32.2 105 110 A Q H X S+ 0 0 66 -4,-1.9 4,-2.7 -5,-0.2 5,-0.2 0.932 112.2 49.7 -67.8 -45.0 10.2 61.5 29.7 106 111 A I H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.883 109.3 52.4 -58.8 -40.3 13.8 63.0 29.8 107 112 A S H X S+ 0 0 5 -4,-2.3 4,-1.6 2,-0.2 -2,-0.2 0.967 111.8 44.6 -63.8 -48.8 13.8 62.9 33.6 108 113 A S H X S+ 0 0 69 -4,-2.5 4,-1.3 1,-0.2 3,-0.3 0.929 115.6 47.7 -59.9 -46.2 12.8 59.2 33.8 109 114 A E H X S+ 0 0 42 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.875 107.4 55.9 -65.1 -31.8 15.3 58.3 31.1 110 115 A S H X S+ 0 0 0 -4,-2.3 4,-2.1 -5,-0.2 -1,-0.2 0.851 102.4 57.1 -67.1 -31.6 18.1 60.3 32.7 111 116 A K H X S+ 0 0 90 -4,-1.6 4,-1.6 -3,-0.3 -1,-0.2 0.902 105.1 51.5 -65.7 -32.4 17.6 58.3 36.0 112 117 A F H X S+ 0 0 145 -4,-1.3 4,-2.0 1,-0.2 -2,-0.2 0.888 107.0 53.3 -73.6 -36.6 18.2 55.1 33.9 113 118 A V H X S+ 0 0 3 -4,-1.8 4,-3.0 2,-0.2 5,-0.2 0.897 103.9 56.1 -64.4 -38.5 21.5 56.7 32.6 114 119 A I H X S+ 0 0 3 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.944 107.3 50.0 -55.3 -44.9 22.6 57.4 36.2 115 120 A G H X S+ 0 0 40 -4,-1.6 4,-2.3 1,-0.2 -2,-0.2 0.905 113.7 44.8 -62.2 -42.9 22.1 53.6 36.9 116 121 A L H X S+ 0 0 34 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.925 113.3 49.1 -67.2 -44.9 24.2 52.6 33.9 117 122 A A H <>S+ 0 0 0 -4,-3.0 5,-2.7 2,-0.2 -2,-0.2 0.915 112.0 49.2 -58.9 -45.8 26.9 55.2 34.6 118 123 A E H ><5S+ 0 0 99 -4,-2.6 3,-1.8 -5,-0.2 -2,-0.2 0.908 107.1 55.1 -63.1 -40.4 27.2 54.0 38.3 119 124 A E H 3<5S+ 0 0 138 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.845 109.9 47.1 -61.3 -32.2 27.4 50.4 37.1 120 125 A N T 3<5S- 0 0 36 -4,-1.7 -1,-0.3 -116,-0.2 -2,-0.2 0.225 118.0-114.2 -88.7 13.1 30.4 51.4 35.0 121 126 A Q T < 5S+ 0 0 179 -3,-1.8 2,-0.7 1,-0.2 -3,-0.2 0.883 70.1 142.5 55.6 38.4 32.0 53.4 37.9 122 127 A D >< + 0 0 16 -5,-2.7 4,-1.9 1,-0.2 -1,-0.2 -0.750 16.4 165.5-112.1 81.1 31.5 56.7 36.0 123 128 A N H > S+ 0 0 120 -2,-0.7 4,-2.7 1,-0.2 -1,-0.2 0.853 72.9 56.0 -69.0 -34.8 30.5 59.2 38.7 124 129 A A H > S+ 0 0 52 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.907 107.5 47.7 -67.5 -37.8 31.1 62.3 36.6 125 130 A T H > S+ 0 0 0 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.952 112.9 50.1 -66.1 -44.8 28.7 61.1 33.8 126 131 A A H X S+ 0 0 4 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.927 107.7 54.3 -54.8 -44.8 26.1 60.3 36.6 127 132 A D H X S+ 0 0 97 -4,-2.7 4,-2.1 1,-0.2 5,-0.2 0.904 103.0 56.5 -63.7 -38.0 26.6 63.8 38.1 128 133 A L H X S+ 0 0 30 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.934 110.7 43.2 -56.4 -45.9 25.9 65.5 34.8 129 134 A F H X S+ 0 0 0 -4,-1.5 4,-2.2 2,-0.2 -1,-0.2 0.848 107.2 59.3 -76.6 -27.1 22.5 63.8 34.5 130 135 A V H X S+ 0 0 12 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.923 107.8 48.4 -60.6 -47.0 21.7 64.4 38.2 131 136 A G H X S+ 0 0 28 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.907 109.3 52.7 -60.4 -40.8 22.0 68.1 37.5 132 137 A L H X S+ 0 0 15 -4,-2.0 4,-3.0 -5,-0.2 5,-0.3 0.926 105.3 53.5 -60.2 -45.5 19.8 67.8 34.4 133 138 A I H X S+ 0 0 4 -4,-2.2 4,-2.9 1,-0.2 5,-0.3 0.926 107.0 53.8 -54.8 -45.2 17.0 66.1 36.4 134 139 A E H X S+ 0 0 57 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.947 112.6 42.3 -53.7 -51.6 17.0 69.0 38.9 135 140 A E H X S+ 0 0 63 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.920 116.8 45.9 -66.2 -45.6 16.6 71.6 36.1 136 141 A V H X S+ 0 0 1 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.871 110.7 52.0 -72.5 -34.4 14.0 69.7 34.1 137 142 A E H X S+ 0 0 27 -4,-2.9 4,-1.8 -5,-0.3 -1,-0.2 0.835 106.8 55.4 -67.7 -31.8 11.9 68.8 37.2 138 143 A K H X S+ 0 0 81 -4,-1.6 4,-2.3 -5,-0.3 -2,-0.2 0.961 110.6 45.4 -57.8 -49.3 11.9 72.5 38.1 139 144 A Q H X S+ 0 0 9 -4,-1.9 4,-2.9 1,-0.2 5,-0.3 0.871 107.7 56.0 -67.3 -35.0 10.4 73.3 34.7 140 145 A V H X S+ 0 0 17 -4,-2.2 4,-2.9 2,-0.2 5,-0.3 0.932 108.8 49.1 -59.4 -40.9 7.9 70.5 34.9 141 146 A W H X S+ 0 0 27 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.958 115.5 42.9 -64.5 -42.7 6.6 72.1 38.2 142 147 A M H X S+ 0 0 13 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.951 117.6 44.3 -69.6 -49.2 6.4 75.6 36.6 143 148 A L H X S+ 0 0 0 -4,-2.9 4,-1.3 2,-0.2 -2,-0.2 0.911 114.5 49.7 -62.8 -42.4 4.9 74.5 33.3 144 149 A S H < S+ 0 0 40 -4,-2.9 4,-0.3 -5,-0.3 -2,-0.2 0.901 109.7 53.4 -61.1 -40.8 2.4 72.1 35.3 145 150 A S H >< S+ 0 0 18 -4,-2.5 330,-2.9 -5,-0.3 3,-1.4 0.905 103.1 56.2 -62.4 -43.6 1.6 75.2 37.5 146 151 A Y H 3< S+ 0 0 5 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.870 111.5 44.7 -47.9 -43.4 0.8 77.3 34.3 147 152 A L T 3< 0 0 53 -4,-1.3 -1,-0.3 -3,-0.2 -2,-0.2 0.419 360.0 360.0 -82.3 -4.3 -1.8 74.6 33.4 148 153 A G < 0 0 79 -3,-1.4 -3,-0.1 -4,-0.3 326,-0.1 -0.043 360.0 360.0 -86.3 360.0 -3.3 74.2 37.0 149 !* 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 0.0 150 7 B K 0 0 214 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -44.8 4.0 80.2 -7.8 151 8 B T > - 0 0 81 1,-0.1 4,-2.7 4,-0.0 5,-0.3 -0.302 360.0-109.1 -78.2 162.5 2.8 83.8 -6.9 152 9 B N H > S+ 0 0 78 1,-0.2 4,-1.3 2,-0.2 116,-0.2 0.914 124.7 42.9 -54.2 -41.3 5.3 86.7 -6.5 153 10 B Q H > S+ 0 0 57 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.931 114.6 47.8 -66.7 -49.3 4.4 86.4 -2.7 154 11 B T H > S+ 0 0 49 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.815 107.9 56.2 -66.3 -34.0 4.5 82.6 -2.5 155 12 B L H X S+ 0 0 67 -4,-2.7 4,-1.9 2,-0.2 -1,-0.2 0.904 109.1 47.0 -63.4 -43.6 7.9 82.5 -4.4 156 13 B V H X S+ 0 0 0 -4,-1.3 4,-2.1 -5,-0.3 -2,-0.2 0.973 113.1 48.1 -60.3 -49.8 9.4 84.8 -1.8 157 14 B E H X S+ 0 0 37 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.897 112.7 48.3 -57.5 -46.6 7.9 82.7 1.2 158 15 B N H X S+ 0 0 88 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.863 110.0 51.7 -64.2 -40.9 9.1 79.4 -0.3 159 16 B S H X S+ 0 0 18 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.830 108.1 52.7 -66.4 -35.6 12.7 80.9 -0.9 160 17 B L H X S+ 0 0 0 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.894 107.0 52.9 -65.5 -39.9 12.8 82.0 2.7 161 18 B N H X S+ 0 0 13 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.858 108.0 50.3 -61.9 -37.3 11.9 78.4 3.8 162 19 B T H X S+ 0 0 36 -4,-1.7 4,-2.4 2,-0.2 68,-0.3 0.948 114.2 44.1 -63.6 -45.9 14.7 77.0 1.8 163 20 B Q H X S+ 0 0 5 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.899 110.8 53.7 -69.9 -37.5 17.2 79.5 3.4 164 21 B L H X S+ 0 0 0 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.913 111.8 47.3 -55.0 -46.5 15.8 78.9 6.9 165 22 B S H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 5,-0.2 0.913 109.6 52.3 -64.5 -43.8 16.4 75.2 6.3 166 23 B N H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.908 110.0 48.8 -58.9 -46.2 19.9 75.8 5.0 167 24 B W H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.871 111.3 49.1 -67.2 -35.1 20.9 77.9 8.1 168 25 B F H X S+ 0 0 0 -4,-1.9 4,-1.8 -5,-0.2 -1,-0.2 0.913 112.1 47.7 -67.6 -41.7 19.5 75.2 10.5 169 26 B L H X S+ 0 0 2 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.891 110.5 53.4 -67.7 -31.6 21.4 72.4 8.8 170 27 B L H X S+ 0 0 0 -4,-2.3 4,-2.8 -5,-0.2 5,-0.2 0.940 104.3 54.4 -67.0 -45.4 24.5 74.6 8.8 171 28 B Y H X S+ 0 0 8 -4,-2.4 4,-1.1 1,-0.2 -1,-0.2 0.899 111.1 48.1 -48.4 -46.6 24.1 75.1 12.7 172 29 B S H X S+ 0 0 0 -4,-1.8 4,-1.8 2,-0.2 3,-0.4 0.933 110.8 48.0 -59.9 -50.9 24.0 71.2 12.8 173 30 B K H X S+ 0 0 8 -4,-2.5 4,-2.5 1,-0.3 5,-0.2 0.918 107.3 56.8 -61.6 -41.7 27.1 70.7 10.6 174 31 B L H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -1,-0.3 0.810 104.5 53.1 -61.6 -31.2 29.0 73.3 12.6 175 32 B H H X S+ 0 0 1 -4,-1.1 4,-2.2 -3,-0.4 -1,-0.2 0.920 107.4 51.2 -64.2 -47.1 28.3 71.2 15.8 176 33 B R H X S+ 0 0 21 -4,-1.8 4,-1.8 -104,-0.3 -2,-0.2 0.941 113.7 44.2 -56.7 -45.7 29.8 68.2 14.1 177 34 B F H X S+ 0 0 0 -4,-2.5 4,-1.8 2,-0.2 -1,-0.2 0.877 110.5 54.7 -65.0 -42.8 32.9 70.1 13.2 178 35 B H H < S+ 0 0 1 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.881 115.5 41.4 -52.7 -40.7 33.2 71.7 16.7 179 36 B W H < S+ 0 0 12 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.769 123.0 33.1 -85.7 -28.6 33.1 68.2 18.1 180 37 B Y H < S+ 0 0 79 -4,-1.8 -2,-0.2 -5,-0.2 -3,-0.2 0.505 80.4 120.8-112.0 -6.0 35.3 66.3 15.8 181 38 B V < + 0 0 6 -4,-1.8 2,-0.3 -5,-0.2 58,-0.1 -0.316 39.3 172.2 -59.0 143.4 38.0 68.8 14.7 182 39 B K + 0 0 136 56,-0.2 58,-0.3 7,-0.0 3,-0.3 -0.928 22.9 64.8-148.7 173.4 41.5 67.7 15.6 183 40 B G S > S- 0 0 43 -2,-0.3 3,-2.3 1,-0.2 56,-0.0 -0.331 98.0 -45.1 94.2 179.8 45.2 68.5 15.1 184 41 B P T 3 S+ 0 0 125 0, 0.0 3,-0.4 0, 0.0 4,-0.2 0.649 132.6 58.3 -69.9 -10.5 47.2 71.6 16.1 185 42 B H T 3> S+ 0 0 97 -3,-0.3 4,-2.7 1,-0.2 5,-0.3 0.362 73.8 114.3 -94.1 10.1 44.6 74.1 15.1 186 43 B F H <> S+ 0 0 65 -3,-2.3 4,-2.8 1,-0.2 5,-0.3 0.847 73.6 46.6 -39.9 -55.3 42.1 72.4 17.4 187 44 B F H > S+ 0 0 145 -3,-0.4 4,-2.1 1,-0.2 5,-0.2 0.957 114.9 44.9 -65.6 -45.6 41.7 75.4 19.8 188 45 B T H > S+ 0 0 94 -4,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.936 120.1 40.1 -60.7 -45.5 41.3 78.1 17.1 189 46 B L H X S+ 0 0 6 -4,-2.7 4,-2.8 2,-0.2 5,-0.2 0.892 110.2 56.6 -81.1 -38.5 38.9 76.0 15.0 190 47 B H H X S+ 0 0 32 -4,-2.8 4,-1.2 -5,-0.3 -1,-0.2 0.938 115.3 41.1 -53.1 -46.1 36.8 74.6 18.0 191 48 B E H X S+ 0 0 104 -4,-2.1 4,-2.0 -5,-0.3 -2,-0.2 0.906 112.9 52.1 -69.9 -44.2 36.2 78.1 19.0 192 49 B K H X S+ 0 0 43 -4,-2.5 4,-2.4 -5,-0.2 -2,-0.2 0.930 106.8 53.8 -58.4 -44.7 35.6 79.5 15.6 193 50 B F H X S+ 0 0 0 -4,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.834 107.8 51.1 -62.5 -33.6 33.0 76.9 14.8 194 51 B E H X S+ 0 0 71 -4,-1.2 4,-2.5 -5,-0.2 -1,-0.2 0.895 108.6 50.7 -66.7 -41.9 31.1 77.8 18.0 195 52 B E H X S+ 0 0 120 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.934 111.3 50.0 -60.2 -41.7 31.1 81.5 17.0 196 53 B L H X S+ 0 0 5 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.858 110.1 48.4 -66.1 -38.8 29.7 80.5 13.6 197 54 B Y H X S+ 0 0 9 -4,-1.8 4,-2.9 2,-0.2 -1,-0.2 0.866 107.1 55.9 -73.7 -32.1 26.9 78.3 15.0 198 55 B D H X S+ 0 0 80 -4,-2.5 4,-1.6 2,-0.2 -2,-0.2 0.938 111.0 45.6 -57.2 -44.6 25.9 81.1 17.4 199 56 B H H X S+ 0 0 32 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.891 110.8 53.0 -64.4 -38.0 25.6 83.3 14.2 200 57 B A H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.931 107.2 51.7 -65.8 -44.7 23.7 80.6 12.4 201 58 B A H X S+ 0 0 22 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.893 110.4 48.8 -58.4 -40.5 21.2 80.3 15.3 202 59 B E H X S+ 0 0 126 -4,-1.6 4,-2.5 1,-0.2 -1,-0.2 0.907 111.3 50.5 -64.1 -40.3 20.5 84.1 15.2 203 60 B T H X S+ 0 0 8 -4,-2.1 4,-2.4 2,-0.2 5,-0.3 0.888 106.1 54.4 -66.2 -45.3 20.1 83.9 11.5 204 61 B V H X S+ 0 0 1 -4,-2.5 4,-2.2 2,-0.2 5,-0.2 0.941 112.0 45.0 -51.4 -49.8 17.5 81.0 11.8 205 62 B D H X S+ 0 0 29 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.941 112.8 50.8 -66.6 -41.7 15.4 83.1 14.2 206 63 B T H X S+ 0 0 76 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.911 112.3 44.7 -60.8 -44.7 15.7 86.3 12.1 207 64 B I H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.947 114.0 49.7 -67.0 -45.6 14.6 84.5 8.8 208 65 B A H X S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.3 -2,-0.2 0.910 112.0 48.8 -60.8 -42.4 11.7 82.7 10.5 209 66 B E H X S+ 0 0 70 -4,-2.2 4,-2.3 -5,-0.2 -1,-0.2 0.880 110.6 49.9 -69.9 -33.5 10.5 85.9 12.1 210 67 B R H X S+ 0 0 63 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.901 109.4 52.1 -64.8 -43.0 10.6 87.8 8.8 211 68 B L H <>S+ 0 0 0 -4,-2.6 5,-2.9 2,-0.2 4,-0.2 0.890 111.0 47.6 -59.1 -45.4 8.6 85.0 7.1 212 69 B L H ><5S+ 0 0 49 -4,-2.1 3,-1.8 3,-0.2 -2,-0.2 0.939 108.3 55.2 -58.4 -45.6 6.0 85.2 9.9 213 70 B A H 3<5S+ 0 0 73 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.815 106.6 50.8 -61.1 -30.8 5.9 89.1 9.5 214 71 B I T 3<5S- 0 0 26 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.449 127.0 -96.9 -90.0 4.1 5.1 88.8 5.8 215 72 B G T < 5S+ 0 0 58 -3,-1.8 -3,-0.2 1,-0.3 -2,-0.1 0.528 81.8 127.4 96.2 11.3 2.3 86.3 6.4 216 73 B G < - 0 0 2 -5,-2.9 -1,-0.3 -6,-0.2 -62,-0.0 -0.263 58.1-119.2 -91.7-178.0 4.1 83.1 5.7 217 74 B Q - 0 0 127 -2,-0.1 2,-0.1 -185,-0.0 -5,-0.1 -0.907 24.3-144.6-123.7 101.0 4.6 79.8 7.6 218 75 B P - 0 0 3 0, 0.0 2,-0.1 0, 0.0 -60,-0.1 -0.410 20.3-118.6 -63.8 138.7 8.1 78.9 8.5 219 76 B V - 0 0 8 -2,-0.1 3,-0.0 1,-0.1 -11,-0.0 -0.395 34.3-179.7 -67.0 151.3 9.0 75.1 8.4 220 77 B A + 0 0 2 -2,-0.1 -192,-0.3 1,-0.0 2,-0.3 0.046 42.3 79.3-158.9 27.4 10.1 74.1 11.9 221 78 B T S > S- 0 0 17 1,-0.1 4,-2.6 -194,-0.1 5,-0.2 -0.985 75.4-119.8-135.8 159.3 11.0 70.4 12.1 222 79 B V H > S+ 0 0 1 -2,-0.3 4,-2.3 1,-0.3 5,-0.1 0.816 113.9 56.1 -66.7 -34.6 14.2 68.6 11.1 223 80 B K H > S+ 0 0 140 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.929 111.5 43.1 -60.8 -47.5 12.3 66.4 8.6 224 81 B E H > S+ 0 0 71 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.876 111.4 53.9 -66.2 -40.4 11.1 69.6 6.8 225 82 B Y H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.937 109.6 49.4 -57.8 -46.1 14.6 71.3 7.0 226 83 B T H < S+ 0 0 76 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.917 114.7 43.7 -56.7 -47.4 16.0 68.2 5.4 227 84 B E H < S+ 0 0 136 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.769 120.2 40.4 -72.6 -27.3 13.4 68.3 2.6 228 85 B H H < S+ 0 0 75 -4,-2.6 -2,-0.2 -5,-0.1 -1,-0.2 0.639 92.8 97.1 -97.3 -19.5 13.5 72.1 2.0 229 86 B A < - 0 0 21 -4,-2.1 -66,-0.1 -5,-0.2 -67,-0.1 -0.336 58.9-151.2 -69.7 156.8 17.2 72.8 2.2 230 87 B S S S+ 0 0 45 -68,-0.3 2,-0.2 -2,-0.1 -1,-0.1 0.387 86.2 49.7-103.5 -5.6 19.6 73.1 -0.8 231 88 B I S S- 0 0 17 22,-0.0 2,-0.3 23,-0.0 -2,-0.1 -0.724 76.8-137.4-121.0 177.3 22.5 72.0 1.4 232 89 B T - 0 0 79 -2,-0.2 -2,-0.0 2,-0.2 -59,-0.0 -0.896 15.5-142.2-129.5 155.5 22.9 69.0 3.8 233 90 B D S S+ 0 0 8 -2,-0.3 -57,-0.1 -61,-0.1 -1,-0.0 0.455 78.5 98.1 -91.0 -1.8 24.5 68.5 7.3 234 91 B G + 0 0 24 -161,-0.0 2,-0.2 2,-0.0 -2,-0.2 -0.170 42.8 119.7 -78.5 169.3 25.8 65.1 6.1 235 92 B G - 0 0 37 1,-0.1 -2,-0.0 2,-0.0 0, 0.0 -0.708 59.4-118.4 148.1 162.7 29.3 64.5 5.0 236 93 B N + 0 0 162 -2,-0.2 -1,-0.1 6,-0.0 6,-0.0 0.049 50.2 155.3-117.1 26.6 32.5 62.5 5.8 237 94 B E + 0 0 47 1,-0.1 3,-0.0 5,-0.1 -2,-0.0 -0.272 5.4 160.4 -58.3 131.6 34.9 65.4 6.5 238 95 B T + 0 0 80 -2,-0.0 -56,-0.2 1,-0.0 -1,-0.1 0.707 48.0 65.0-122.3 -46.4 37.7 64.3 8.8 239 96 B S S > S- 0 0 47 1,-0.1 4,-2.0 -58,-0.1 5,-0.2 -0.478 82.7-115.8 -80.9 157.7 40.7 66.8 8.5 240 97 B A H > S+ 0 0 15 -58,-0.3 4,-2.3 1,-0.2 5,-0.2 0.877 118.7 51.1 -55.0 -43.3 40.6 70.5 9.6 241 98 B S H > S+ 0 0 62 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.893 108.0 51.9 -66.4 -39.1 41.1 71.5 5.9 242 99 B E H > S+ 0 0 102 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.909 111.7 46.7 -61.3 -43.5 38.2 69.3 4.8 243 100 B M H X S+ 0 0 2 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.931 113.3 47.8 -63.0 -47.2 35.9 70.9 7.4 244 101 B V H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.920 112.1 50.0 -63.2 -42.9 37.0 74.5 6.5 245 102 B Q H X S+ 0 0 83 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.903 106.9 55.2 -64.7 -36.8 36.6 73.8 2.7 246 103 B A H X S+ 0 0 8 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.926 108.9 49.0 -58.9 -46.3 33.0 72.3 3.4 247 104 B L H X S+ 0 0 0 -4,-2.0 4,-3.0 2,-0.2 5,-0.3 0.914 108.4 52.3 -59.7 -44.5 32.1 75.6 5.1 248 105 B V H X S+ 0 0 2 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.946 111.2 48.8 -58.4 -44.1 33.5 77.7 2.1 249 106 B N H X S+ 0 0 89 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.915 113.9 43.8 -62.2 -46.3 31.3 75.6 -0.2 250 107 B D H X S+ 0 0 16 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.904 114.3 50.0 -70.0 -35.5 28.1 76.0 1.8 251 108 B Y H X S+ 0 0 0 -4,-3.0 4,-2.7 1,-0.2 -1,-0.2 0.885 109.7 51.3 -72.0 -38.1 28.7 79.7 2.4 252 109 B K H X S+ 0 0 121 -4,-2.4 4,-2.4 -5,-0.3 -1,-0.2 0.935 111.7 47.3 -61.0 -43.5 29.3 80.4 -1.3 253 110 B Q H X S+ 0 0 68 -4,-1.8 4,-2.2 -5,-0.2 5,-0.2 0.919 111.3 50.9 -60.0 -47.0 26.1 78.6 -2.1 254 111 B I H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.927 109.6 50.8 -61.0 -42.0 24.2 80.5 0.5 255 112 B S H X S+ 0 0 3 -4,-2.7 4,-1.6 2,-0.2 -2,-0.2 0.937 110.7 47.2 -60.5 -52.0 25.5 83.8 -0.8 256 113 B S H X S+ 0 0 67 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.890 115.8 45.6 -58.5 -37.8 24.5 83.1 -4.5 257 114 B E H X S+ 0 0 50 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.870 107.9 56.2 -77.6 -33.2 21.0 81.9 -3.5 258 115 B S H X S+ 0 0 0 -4,-2.4 4,-1.6 -5,-0.2 -1,-0.2 0.826 103.9 55.3 -62.7 -35.9 20.5 84.9 -1.1 259 116 B K H X S+ 0 0 105 -4,-1.6 4,-1.5 2,-0.2 -1,-0.2 0.895 107.0 50.4 -63.3 -40.7 21.2 87.2 -4.2 260 117 B F H X S+ 0 0 143 -4,-1.4 4,-2.2 1,-0.2 -2,-0.2 0.896 106.1 55.5 -59.8 -41.2 18.4 85.4 -6.0 261 118 B V H X S+ 0 0 2 -4,-2.1 4,-2.8 2,-0.2 5,-0.2 0.903 102.7 55.5 -56.7 -44.1 16.1 86.0 -2.9 262 119 B I H X S+ 0 0 30 -4,-1.6 4,-2.7 2,-0.2 -1,-0.2 0.910 107.5 51.0 -55.8 -46.7 16.8 89.8 -3.2 263 120 B G H X S+ 0 0 38 -4,-1.5 4,-2.0 1,-0.2 -1,-0.2 0.922 112.2 45.2 -58.7 -45.9 15.6 89.6 -6.8 264 121 B L H X S+ 0 0 33 -4,-2.2 4,-1.0 1,-0.2 -1,-0.2 0.891 114.5 47.7 -63.2 -42.5 12.4 87.8 -5.8 265 122 B A H ><>S+ 0 0 0 -4,-2.8 5,-2.8 2,-0.2 3,-0.6 0.915 111.6 50.6 -64.8 -43.6 11.7 90.1 -2.9 266 123 B E H ><5S+ 0 0 118 -4,-2.7 3,-1.6 1,-0.3 -2,-0.2 0.876 106.6 54.9 -63.7 -37.4 12.3 93.2 -5.0 267 124 B E H 3<5S+ 0 0 137 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.744 109.0 48.9 -69.6 -22.9 9.9 91.9 -7.7 268 125 B N T <<5S- 0 0 44 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.106 118.2-113.6 -97.0 18.3 7.3 91.6 -5.0 269 126 B Q T < 5S+ 0 0 179 -3,-1.6 2,-0.7 1,-0.2 -3,-0.2 0.834 73.2 139.2 48.7 37.6 8.0 95.2 -3.8 270 127 B D >< + 0 0 17 -5,-2.8 4,-1.7 1,-0.2 -1,-0.2 -0.724 16.3 162.8-108.6 83.1 9.3 93.7 -0.5 271 128 B N H > S+ 0 0 115 -2,-0.7 4,-2.2 1,-0.2 -1,-0.2 0.827 71.7 59.4 -71.3 -32.3 12.4 95.9 0.3 272 129 B A H > S+ 0 0 52 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.919 106.2 47.0 -66.6 -40.3 12.6 94.8 4.0 273 130 B T H > S+ 0 0 0 1,-0.2 4,-1.6 2,-0.2 3,-0.3 0.945 112.0 51.0 -64.5 -48.0 13.0 91.1 3.1 274 131 B A H X S+ 0 0 3 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.896 107.0 55.5 -52.8 -44.8 15.7 92.0 0.4 275 132 B D H X S+ 0 0 112 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.873 102.1 54.5 -61.2 -39.0 17.6 94.0 3.1 276 133 B L H X S+ 0 0 30 -4,-1.6 4,-1.8 -3,-0.3 -1,-0.2 0.953 112.9 44.7 -57.9 -45.6 17.8 91.1 5.5 277 134 B F H X S+ 0 0 0 -4,-1.6 4,-2.3 1,-0.2 -2,-0.2 0.850 107.5 57.1 -69.9 -33.5 19.4 89.1 2.7 278 135 B V H X S+ 0 0 52 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.904 108.4 48.2 -58.1 -45.6 21.7 91.9 1.7 279 136 B G H X S+ 0 0 31 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.866 109.9 52.0 -62.8 -41.1 23.1 91.9 5.3 280 137 B L H X S+ 0 0 14 -4,-1.8 4,-3.1 1,-0.2 5,-0.2 0.883 105.9 54.6 -63.5 -39.5 23.5 88.1 5.3 281 138 B I H X S+ 0 0 19 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.917 106.6 52.0 -58.7 -46.7 25.5 88.3 2.0 282 139 B E H X S+ 0 0 135 -4,-1.8 4,-1.3 2,-0.2 -1,-0.2 0.927 114.2 41.9 -56.0 -49.1 27.9 90.8 3.7 283 140 B E H X S+ 0 0 62 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.934 115.8 48.6 -68.4 -43.0 28.5 88.6 6.7 284 141 B V H X S+ 0 0 0 -4,-3.1 4,-2.5 1,-0.2 -1,-0.2 0.892 109.3 50.6 -67.7 -41.4 28.8 85.3 4.8 285 142 B E H X S+ 0 0 87 -4,-2.4 4,-1.7 -5,-0.2 -1,-0.2 0.785 107.9 55.2 -67.4 -29.1 31.3 86.7 2.1 286 143 B K H X S+ 0 0 104 -4,-1.3 4,-2.3 -5,-0.2 -1,-0.2 0.928 109.5 46.8 -61.0 -50.6 33.5 88.0 5.0 287 144 B Q H X S+ 0 0 5 -4,-2.2 4,-3.1 1,-0.2 5,-0.3 0.919 107.9 55.4 -62.8 -41.7 33.6 84.5 6.4 288 145 B V H X S+ 0 0 17 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.932 108.9 48.6 -54.5 -45.4 34.3 83.0 3.0 289 146 B W H X S+ 0 0 164 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.925 113.8 46.1 -58.3 -45.8 37.4 85.4 2.8 290 147 B M H X S+ 0 0 71 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.929 115.8 44.4 -65.6 -48.2 38.6 84.4 6.3 291 148 B L H X S+ 0 0 8 -4,-3.1 4,-1.2 2,-0.2 -1,-0.2 0.864 113.9 49.5 -67.2 -37.4 38.1 80.6 5.7 292 149 B S H < S+ 0 0 45 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.859 108.0 55.0 -65.5 -37.4 39.7 80.7 2.2 293 150 B S H >< S+ 0 0 64 -4,-2.2 3,-1.8 -5,-0.2 -2,-0.2 0.901 102.9 56.2 -62.1 -44.2 42.6 82.7 3.7 294 151 B Y H 3< S+ 0 0 78 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.852 110.0 45.8 -51.0 -40.2 43.1 79.9 6.3 295 152 B L T 3< 0 0 59 -4,-1.2 -1,-0.3 -3,-0.1 -2,-0.2 0.354 360.0 360.0 -84.0 1.6 43.5 77.4 3.4 296 153 B G < 0 0 125 -3,-1.8 -3,-0.1 -4,-0.2 -4,-0.0 -0.181 360.0 360.0 -93.3 360.0 45.8 79.7 1.4 297 !* 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 0.0 298 9 C N > 0 0 107 0, 0.0 4,-1.9 0, 0.0 116,-0.1 0.000 360.0 360.0 360.0 -51.8 10.0 56.6 51.9 299 10 C Q H > + 0 0 66 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.896 360.0 48.6 -65.7 -46.6 8.5 59.6 49.9 300 11 C T H > S+ 0 0 93 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.887 109.4 53.7 -63.8 -37.9 6.6 61.1 52.9 301 12 C L H > S+ 0 0 92 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.888 109.8 48.2 -63.0 -42.9 9.7 60.8 55.1 302 13 C V H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.945 112.2 48.1 -60.0 -51.0 11.7 62.8 52.5 303 14 C E H X S+ 0 0 44 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.937 112.3 48.9 -58.4 -47.6 9.0 65.5 52.2 304 15 C N H X S+ 0 0 90 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.912 109.2 53.0 -59.5 -39.2 8.8 65.8 56.0 305 16 C S H X S+ 0 0 17 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.861 107.5 51.6 -67.7 -36.9 12.6 66.1 56.3 306 17 C L H X S+ 0 0 0 -4,-2.2 4,-3.3 2,-0.2 -1,-0.2 0.912 106.4 53.6 -65.8 -40.2 12.7 68.9 53.7 307 18 C N H X S+ 0 0 15 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.914 108.2 50.7 -63.7 -36.4 10.0 70.9 55.6 308 19 C T H X S+ 0 0 39 -4,-1.9 4,-2.4 2,-0.2 68,-0.4 0.948 114.4 43.5 -61.4 -47.2 12.2 70.6 58.8 309 20 C Q H X S+ 0 0 5 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.931 111.3 53.6 -69.8 -40.7 15.2 71.9 56.9 310 21 C L H X S+ 0 0 0 -4,-3.3 4,-2.4 1,-0.2 5,-0.2 0.957 111.8 47.0 -51.2 -49.9 13.2 74.6 55.1 311 22 C S H X S+ 0 0 0 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.907 108.9 53.7 -57.4 -43.9 12.0 75.8 58.6 312 23 C N H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.937 110.0 48.5 -59.9 -45.5 15.6 75.7 60.0 313 24 C W H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.875 110.4 48.9 -69.2 -37.3 16.8 77.9 57.2 314 25 C F H X S+ 0 0 1 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.914 112.9 48.6 -65.4 -40.6 14.0 80.5 57.6 315 26 C L H X S+ 0 0 2 -4,-2.6 4,-2.5 -5,-0.2 -2,-0.2 0.875 110.6 50.6 -71.0 -30.5 14.6 80.6 61.3 316 27 C L H X S+ 0 0 0 -4,-2.2 4,-2.7 -5,-0.2 -1,-0.2 0.908 106.0 55.3 -67.4 -42.2 18.4 81.1 60.7 317 28 C Y H X S+ 0 0 8 -4,-2.2 4,-1.2 2,-0.2 -2,-0.2 0.891 111.3 46.9 -49.6 -51.5 17.6 84.0 58.2 318 29 C S H >X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 3,-0.6 0.950 112.0 48.1 -56.8 -53.3 15.7 85.5 61.2 319 30 C K H 3X S+ 0 0 7 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.859 107.0 57.2 -59.3 -39.0 18.5 84.9 63.8 320 31 C L H 3X S+ 0 0 0 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.817 104.5 52.2 -62.6 -34.0 21.1 86.4 61.4 321 32 C H H S- 0 0 45 -2,-0.3 3,-2.3 1,-0.2 56,-0.0 -0.324 98.9 -45.8 95.2 178.7 32.4 96.1 69.8 330 41 C P T 3 S+ 0 0 125 0, 0.0 3,-0.3 0, 0.0 4,-0.2 0.646 132.0 60.1 -68.0 -10.8 35.4 96.7 67.7 331 42 C H T 3> S+ 0 0 99 -3,-0.3 4,-2.5 1,-0.2 5,-0.3 0.299 73.5 113.9 -94.1 13.5 34.5 93.9 65.2 332 43 C F H <> S+ 0 0 64 -3,-2.3 4,-2.7 1,-0.2 5,-0.3 0.848 72.1 47.2 -43.3 -54.7 31.2 95.6 64.4 333 44 C F H > S+ 0 0 148 -3,-0.3 4,-2.0 2,-0.2 5,-0.2 0.969 114.8 45.5 -64.8 -47.2 31.9 96.4 60.8 334 45 C T H > S+ 0 0 96 -4,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.935 119.8 39.0 -57.9 -52.1 33.2 93.0 59.8 335 46 C L H X S+ 0 0 5 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.834 110.0 57.7 -75.8 -35.9 30.5 91.0 61.6 336 47 C H H X S+ 0 0 31 -4,-2.7 4,-1.3 -5,-0.3 -1,-0.2 0.941 115.3 40.4 -57.5 -41.3 27.6 93.4 60.6 337 48 C E H X S+ 0 0 106 -4,-2.0 4,-2.2 -5,-0.3 -2,-0.2 0.931 113.6 52.4 -73.2 -43.9 28.6 92.7 57.0 338 49 C K H X S+ 0 0 42 -4,-2.6 4,-2.1 1,-0.2 5,-0.2 0.925 107.5 52.5 -61.0 -44.3 29.3 89.0 57.4 339 50 C F H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.873 108.5 50.6 -59.5 -38.0 25.9 88.4 59.0 340 51 C E H X S+ 0 0 71 -4,-1.3 4,-2.1 -5,-0.2 -2,-0.2 0.919 108.7 51.1 -64.0 -45.6 24.2 90.1 56.0 341 52 C E H X S+ 0 0 121 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.909 111.2 50.0 -53.6 -44.2 26.1 87.9 53.5 342 53 C L H X S+ 0 0 5 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.863 108.9 50.1 -67.9 -34.7 25.0 84.8 55.5 343 54 C Y H X S+ 0 0 10 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.870 106.4 55.3 -77.3 -28.0 21.3 85.8 55.5 344 55 C D H X S+ 0 0 79 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.945 111.5 45.7 -61.5 -45.7 21.4 86.4 51.8 345 56 C H H X S+ 0 0 33 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.892 110.7 53.0 -62.4 -42.3 22.6 82.8 51.4 346 57 C A H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.922 107.5 51.0 -58.7 -46.8 20.0 81.6 53.9 347 58 C A H X S+ 0 0 20 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.858 110.2 49.5 -56.8 -41.4 17.2 83.3 51.8 348 59 C E H X S+ 0 0 128 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.884 110.7 51.0 -66.0 -37.4 18.5 81.6 48.6 349 60 C T H X S+ 0 0 9 -4,-2.1 4,-2.4 2,-0.2 5,-0.3 0.927 106.3 54.4 -70.2 -44.8 18.6 78.2 50.5 350 61 C V H X S+ 0 0 1 -4,-2.6 4,-2.1 2,-0.2 5,-0.3 0.945 111.4 44.9 -45.1 -53.9 15.0 78.7 51.7 351 62 C D H X S+ 0 0 28 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.937 112.9 50.5 -65.8 -41.4 13.8 79.2 48.1 352 63 C T H X S+ 0 0 77 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.877 112.1 45.7 -63.3 -42.8 15.9 76.3 46.7 353 64 C I H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 -1,-0.2 0.941 114.0 48.8 -66.3 -47.1 14.6 73.7 49.3 354 65 C A H X S+ 0 0 0 -4,-2.1 4,-2.2 -5,-0.3 -2,-0.2 0.916 112.5 48.7 -57.7 -45.5 10.9 74.9 48.9 355 66 C E H X S+ 0 0 22 -4,-2.4 4,-2.0 -5,-0.3 -1,-0.2 0.893 110.9 49.3 -68.7 -34.4 11.2 74.7 45.1 356 67 C R H X S+ 0 0 17 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.924 109.8 52.4 -63.3 -47.6 12.7 71.2 45.2 357 68 C L H <>S+ 0 0 0 -4,-2.8 5,-2.7 1,-0.2 3,-0.3 0.923 111.1 47.3 -54.1 -46.2 10.0 70.0 47.6 358 69 C L H ><5S+ 0 0 17 -4,-2.2 3,-1.4 1,-0.2 -1,-0.2 0.916 107.8 55.7 -60.5 -43.0 7.3 71.3 45.1 359 70 C A H 3<5S+ 0 0 24 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.769 106.8 50.5 -65.6 -26.2 9.1 69.6 42.1 360 71 C I T 3<5S- 0 0 27 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.398 127.9 -97.7 -92.1 1.5 8.9 66.2 43.9 361 72 C G T < 5S+ 0 0 54 -3,-1.4 -3,-0.2 -4,-0.3 -2,-0.1 0.530 80.6 130.1 98.8 9.1 5.2 66.7 44.6 362 73 C G < - 0 0 1 -5,-2.7 -1,-0.2 -6,-0.2 -62,-0.0 -0.162 57.0-120.1 -82.9 179.8 5.3 68.0 48.2 363 74 C Q - 0 0 124 -2,-0.1 2,-0.1 0, 0.0 3,-0.0 -0.909 24.9-144.4-126.8 97.1 3.8 71.0 50.0 364 75 C P - 0 0 3 0, 0.0 2,-0.1 0, 0.0 -57,-0.0 -0.403 21.8-116.1 -59.3 131.9 6.3 73.4 51.6 365 76 C V - 0 0 8 -2,-0.1 3,-0.0 1,-0.1 -11,-0.0 -0.447 34.7-178.0 -59.2 149.7 5.3 75.0 54.9 366 77 C A + 0 0 1 -2,-0.1 102,-0.3 -3,-0.0 2,-0.3 0.032 43.6 77.9-155.2 30.7 5.0 78.7 54.4 367 78 C T S > S- 0 0 21 1,-0.1 4,-2.4 100,-0.1 5,-0.2 -0.986 76.0-119.8-140.1 153.0 4.1 80.6 57.7 368 79 C V H > S+ 0 0 3 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.858 114.6 57.3 -63.9 -31.9 6.2 81.6 60.7 369 80 C K H > S+ 0 0 142 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.939 109.1 45.2 -59.7 -46.8 4.0 79.5 63.0 370 81 C E H > S+ 0 0 68 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.907 110.9 53.1 -66.1 -40.7 4.7 76.4 60.8 371 82 C Y H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.964 109.7 48.9 -58.5 -54.2 8.5 77.2 60.7 372 83 C T H < S+ 0 0 79 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.916 116.2 43.9 -46.7 -46.1 8.5 77.4 64.5 373 84 C E H < S+ 0 0 120 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.815 119.8 38.5 -74.9 -33.5 6.7 74.1 64.8 374 85 C H H < S+ 0 0 73 -4,-2.7 -2,-0.2 -5,-0.1 -1,-0.2 0.665 93.8 99.5 -96.4 -17.4 8.7 72.1 62.1 375 86 C A < - 0 0 20 -4,-2.5 -66,-0.1 -5,-0.3 -67,-0.1 -0.290 58.4-153.0 -68.1 150.2 12.2 73.4 62.8 376 87 C S S S+ 0 0 44 -68,-0.4 2,-0.2 2,-0.0 -1,-0.1 0.493 84.9 48.7 -98.1 -7.4 14.8 71.5 64.8 377 88 C I S S- 0 0 16 22,-0.0 2,-0.3 23,-0.0 -2,-0.1 -0.576 79.0-133.0-111.5-176.7 16.5 74.8 65.8 378 89 C T - 0 0 79 -2,-0.2 -2,-0.0 2,-0.2 18,-0.0 -0.964 12.6-143.6-130.9 154.3 15.1 78.1 67.1 379 90 C D S S+ 0 0 7 -2,-0.3 -57,-0.1 -61,-0.0 -1,-0.1 0.496 79.6 94.3 -88.7 -1.5 15.6 81.8 66.2 380 91 C G + 0 0 23 133,-0.1 2,-0.2 2,-0.0 -2,-0.2 -0.155 43.1 114.4 -76.7 177.5 15.4 82.6 69.9 381 92 C G - 0 0 38 1,-0.1 -2,-0.0 2,-0.0 0, 0.0 -0.662 60.9-109.7 139.9 168.7 18.3 83.0 72.4 382 93 C N + 0 0 155 -2,-0.2 2,-0.2 6,-0.0 -1,-0.1 -0.149 49.8 156.2-124.6 38.5 20.0 85.6 74.6 383 94 C E + 0 0 41 1,-0.2 3,-0.0 5,-0.1 -2,-0.0 -0.472 4.8 161.2 -65.4 137.5 23.3 86.1 72.9 384 95 C T + 0 0 83 -2,-0.2 -56,-0.2 -57,-0.0 -1,-0.2 0.648 49.0 64.5-127.2 -43.5 24.8 89.5 73.6 385 96 C S S > S- 0 0 48 1,-0.1 4,-2.2 -58,-0.1 5,-0.1 -0.447 85.2-112.4 -86.9 164.0 28.6 89.5 72.8 386 97 C A H > S+ 0 0 14 -58,-0.3 4,-2.6 1,-0.2 5,-0.2 0.893 118.8 50.6 -58.7 -43.3 30.2 89.1 69.3 387 98 C S H > S+ 0 0 64 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.881 107.4 51.3 -65.2 -44.2 31.6 85.7 70.5 388 99 C E H > S+ 0 0 96 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.903 112.1 48.4 -55.4 -46.3 28.3 84.4 71.8 389 100 C M H X S+ 0 0 3 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.950 113.8 45.2 -58.4 -50.2 26.7 85.3 68.4 390 101 C V H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.910 112.5 51.8 -63.8 -40.2 29.4 83.6 66.4 391 102 C Q H X S+ 0 0 84 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.902 106.8 53.4 -65.0 -41.3 29.3 80.6 68.7 392 103 C A H X S+ 0 0 8 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.916 108.2 50.8 -57.5 -39.9 25.5 80.3 68.2 393 104 C L H X S+ 0 0 0 -4,-1.8 4,-3.2 1,-0.2 5,-0.3 0.956 107.8 52.6 -62.3 -48.1 26.0 80.3 64.4 394 105 C V H X S+ 0 0 2 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.886 109.8 49.7 -50.3 -47.8 28.6 77.5 64.7 395 106 C N H X S+ 0 0 84 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.920 113.4 44.5 -61.4 -48.5 26.1 75.4 66.7 396 107 C D H X S+ 0 0 15 -4,-2.2 4,-2.9 2,-0.2 5,-0.2 0.917 114.1 48.1 -63.3 -45.9 23.3 75.8 64.3 397 108 C Y H X S+ 0 0 0 -4,-3.2 4,-1.9 2,-0.2 -2,-0.2 0.921 111.3 51.8 -62.3 -39.2 25.4 75.2 61.1 398 109 C K H X S+ 0 0 120 -4,-2.4 4,-1.8 -5,-0.3 -2,-0.2 0.887 112.7 46.0 -60.5 -39.5 26.9 72.0 62.8 399 110 C Q H X S+ 0 0 69 -4,-1.8 4,-2.7 2,-0.2 5,-0.2 0.917 110.9 51.5 -71.8 -46.3 23.4 70.8 63.5 400 111 C I H X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.898 108.3 53.1 -56.2 -39.4 22.1 71.6 60.0 401 112 C S H X S+ 0 0 3 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.954 110.1 45.7 -69.5 -43.8 25.0 69.7 58.5 402 113 C S H X S+ 0 0 76 -4,-1.8 4,-1.3 1,-0.2 -1,-0.2 0.888 115.0 48.4 -64.1 -42.8 24.4 66.4 60.5 403 114 C E H X S+ 0 0 52 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.893 108.4 53.9 -65.2 -37.8 20.7 66.7 59.7 404 115 C S H X S+ 0 0 1 -4,-2.6 4,-2.0 -5,-0.2 -2,-0.2 0.873 104.8 54.7 -64.8 -37.1 21.4 67.3 56.0 405 116 C K H X S+ 0 0 106 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.884 107.6 50.5 -61.5 -36.3 23.6 64.1 55.9 406 117 C F H X S+ 0 0 143 -4,-1.3 4,-2.0 1,-0.2 -2,-0.2 0.905 107.8 53.2 -69.5 -37.8 20.6 62.2 57.3 407 118 C V H X S+ 0 0 3 -4,-2.0 4,-2.7 1,-0.2 5,-0.2 0.905 104.4 55.9 -61.2 -38.7 18.4 63.7 54.5 408 119 C I H X S+ 0 0 24 -4,-2.0 4,-2.9 1,-0.2 5,-0.2 0.945 106.9 49.1 -63.0 -43.9 20.8 62.5 51.9 409 120 C G H X S+ 0 0 37 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.942 112.0 48.7 -60.5 -43.9 20.5 58.9 53.1 410 121 C L H X S+ 0 0 37 -4,-2.0 4,-1.4 2,-0.2 -2,-0.2 0.930 113.5 46.6 -59.9 -46.9 16.6 59.2 53.1 411 122 C A H <>S+ 0 0 0 -4,-2.7 5,-2.7 1,-0.2 3,-0.3 0.933 112.1 49.8 -62.7 -48.8 16.7 60.6 49.5 412 123 C E H ><5S+ 0 0 120 -4,-2.9 3,-1.7 -5,-0.2 -1,-0.2 0.885 108.4 53.3 -55.8 -44.2 19.1 58.0 48.2 413 124 C E H 3<5S+ 0 0 141 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.826 110.2 49.2 -62.9 -29.4 17.0 55.1 49.7 414 125 C N T 3<5S- 0 0 43 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.259 118.3-115.7 -92.9 14.2 14.0 56.7 47.8 415 126 C Q T < 5S+ 0 0 161 -3,-1.7 2,-0.8 1,-0.2 -3,-0.2 0.806 71.6 138.1 56.2 35.4 16.0 56.8 44.6 416 127 C D >< + 0 0 17 -5,-2.7 4,-1.7 1,-0.2 -1,-0.2 -0.768 17.6 164.9-111.7 81.4 15.9 60.6 44.6 417 128 C N H > S+ 0 0 47 -2,-0.8 4,-2.5 1,-0.2 -1,-0.2 0.810 72.5 57.7 -70.5 -31.2 19.5 61.5 43.5 418 129 C A H > S+ 0 0 1 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.864 107.8 46.1 -68.0 -37.1 18.6 65.1 42.7 419 130 C T H > S+ 0 0 0 2,-0.2 4,-1.6 1,-0.2 3,-0.4 0.939 113.1 51.2 -69.8 -45.8 17.2 65.9 46.2 420 131 C A H X S+ 0 0 4 -4,-1.7 4,-1.9 1,-0.2 3,-0.3 0.944 106.3 54.8 -56.4 -46.5 20.2 64.3 47.7 421 132 C D H X S+ 0 0 51 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.861 101.8 58.2 -54.6 -35.8 22.5 66.4 45.5 422 133 C L H X S+ 0 0 27 -4,-1.2 4,-1.8 -3,-0.4 -1,-0.2 0.955 108.6 44.3 -64.1 -41.9 20.9 69.6 46.8 423 134 C F H X S+ 0 0 0 -4,-1.6 4,-2.3 -3,-0.3 -1,-0.2 0.802 107.9 58.5 -73.3 -31.4 21.8 68.7 50.4 424 135 C V H X S+ 0 0 56 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.927 107.8 47.0 -55.9 -55.3 25.4 67.7 49.4 425 136 C G H X S+ 0 0 30 -4,-2.0 4,-1.6 1,-0.2 -2,-0.2 0.914 111.2 52.8 -52.5 -44.5 26.0 71.2 48.0 426 137 C L H X S+ 0 0 13 -4,-1.8 4,-2.9 1,-0.2 -2,-0.2 0.890 104.8 53.4 -61.2 -44.0 24.5 72.7 51.1 427 138 C I H X S+ 0 0 18 -4,-2.3 4,-2.7 1,-0.2 5,-0.3 0.896 105.7 55.4 -58.7 -42.7 26.9 70.7 53.4 428 139 C E H X S+ 0 0 138 -4,-1.7 4,-1.4 2,-0.2 -1,-0.2 0.904 112.4 42.1 -52.0 -48.3 29.8 72.0 51.4 429 140 C E H X S+ 0 0 60 -4,-1.6 4,-1.7 1,-0.2 -2,-0.2 0.939 115.4 47.9 -75.3 -41.9 28.8 75.6 52.0 430 141 C V H X S+ 0 0 1 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.870 109.9 51.0 -66.7 -40.9 27.8 75.2 55.7 431 142 C E H X S+ 0 0 88 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.813 106.6 55.9 -68.1 -32.0 30.9 73.4 56.7 432 143 C K H X S+ 0 0 103 -4,-1.4 4,-2.3 -5,-0.3 -1,-0.2 0.927 110.4 45.6 -53.0 -50.2 33.0 76.2 55.0 433 144 C Q H X S+ 0 0 7 -4,-1.7 4,-3.4 2,-0.2 5,-0.3 0.911 108.4 55.5 -68.6 -34.8 31.2 78.7 57.3 434 145 C V H X S+ 0 0 17 -4,-2.5 4,-2.6 1,-0.2 5,-0.2 0.924 109.9 47.2 -62.9 -45.9 31.7 76.5 60.3 435 146 C W H X S+ 0 0 164 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.920 114.9 45.9 -55.7 -48.9 35.5 76.6 59.6 436 147 C M H X S+ 0 0 76 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.951 116.4 43.9 -62.2 -49.0 35.5 80.4 59.1 437 148 C L H X S+ 0 0 6 -4,-3.4 4,-1.3 2,-0.2 -2,-0.2 0.895 114.5 49.8 -65.8 -40.5 33.4 81.2 62.2 438 149 C S H X S+ 0 0 44 -4,-2.6 4,-0.5 -5,-0.3 -1,-0.2 0.875 108.5 53.7 -65.3 -36.6 35.3 78.7 64.4 439 150 C S H >< S+ 0 0 66 -4,-2.4 3,-1.2 -5,-0.2 -2,-0.2 0.911 104.0 54.8 -65.7 -40.7 38.5 80.3 63.2 440 151 C Y H 3< S+ 0 0 77 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.858 110.5 47.2 -54.2 -37.4 37.3 83.8 64.3 441 152 C L H 3< 0 0 54 -4,-1.3 -1,-0.3 -5,-0.1 -2,-0.2 0.551 360.0 360.0 -80.3 -9.2 36.7 82.2 67.8 442 153 C G << 0 0 125 -3,-1.2 -3,-0.1 -4,-0.5 -4,-0.0 0.197 360.0 360.0 -79.0 360.0 40.2 80.6 67.7 443 !* 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 0.0 444 9 D N > 0 0 109 0, 0.0 4,-1.5 0, 0.0 116,-0.1 0.000 360.0 360.0 360.0 -40.3 6.7 110.9 72.3 445 10 D Q H > + 0 0 66 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.905 360.0 47.8 -76.5 -43.3 10.0 109.0 71.7 446 11 D T H > S+ 0 0 89 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.733 110.0 55.2 -67.8 -26.7 8.8 105.6 73.1 447 12 D L H > S+ 0 0 92 2,-0.2 4,-1.9 3,-0.1 -1,-0.2 0.848 108.2 48.1 -68.5 -46.3 5.6 105.9 70.9 448 13 D V H X S+ 0 0 0 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.970 112.6 49.0 -58.7 -52.6 7.7 106.4 67.8 449 14 D E H X S+ 0 0 40 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.907 112.3 46.9 -55.4 -44.5 9.9 103.4 68.7 450 15 D N H X S+ 0 0 92 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.856 110.5 53.8 -65.4 -37.6 6.9 101.1 69.4 451 16 D S H X S+ 0 0 17 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.886 107.0 50.7 -67.9 -35.5 5.3 102.3 66.1 452 17 D L H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.877 106.7 55.4 -65.4 -38.5 8.4 101.4 64.2 453 18 D N H X S+ 0 0 13 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.848 106.1 50.9 -60.7 -37.7 8.4 97.8 65.8 454 19 D T H X S+ 0 0 39 -4,-1.6 4,-1.9 2,-0.2 68,-0.3 0.931 113.7 44.3 -66.9 -43.7 4.9 97.2 64.6 455 20 D Q H X S+ 0 0 6 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.896 111.5 52.3 -67.8 -38.6 5.8 98.3 61.0 456 21 D L H X S+ 0 0 0 -4,-2.9 4,-2.1 1,-0.2 5,-0.2 0.945 110.8 50.1 -60.2 -44.1 9.0 96.3 61.0 457 22 D S H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.863 108.4 51.9 -58.6 -42.9 6.9 93.3 62.1 458 23 D N H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.887 108.8 50.0 -61.6 -43.3 4.4 93.9 59.3 459 24 D W H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.874 110.5 49.8 -68.4 -36.5 7.2 94.0 56.6 460 25 D F H X S+ 0 0 1 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.915 112.2 47.1 -68.6 -38.8 8.7 90.7 57.9 461 26 D L H X S+ 0 0 3 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.874 110.6 52.2 -68.8 -33.8 5.3 89.0 57.9 462 27 D L H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.874 105.0 55.7 -64.9 -46.7 4.6 90.3 54.4 463 28 D Y H X S+ 0 0 8 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.932 110.3 47.3 -47.0 -48.6 8.0 88.9 53.3 464 29 D S H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 3,-0.4 0.951 112.3 47.4 -57.4 -49.8 6.8 85.5 54.6 465 30 D K H X S+ 0 0 7 -4,-2.4 4,-2.2 1,-0.3 5,-0.2 0.881 107.0 57.3 -64.4 -39.2 3.3 85.7 52.9 466 31 D L H X S+ 0 0 0 -4,-2.8 4,-2.0 2,-0.2 -1,-0.3 0.813 104.9 52.3 -64.3 -34.5 4.9 86.7 49.6 467 32 D H H X S+ 0 0 1 -4,-1.5 4,-2.5 -3,-0.4 5,-0.2 0.953 107.9 51.8 -60.8 -47.0 7.0 83.5 49.7 468 33 D R H X S+ 0 0 24 -4,-2.0 4,-1.8 -102,-0.3 -2,-0.2 0.916 113.2 43.8 -54.3 -46.6 3.8 81.5 50.2 469 34 D F H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.874 110.9 54.7 -68.4 -39.5 2.2 83.1 47.2 470 35 D H H < S+ 0 0 0 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.909 115.4 40.3 -56.9 -42.5 5.4 82.7 45.1 471 36 D W H < S+ 0 0 2 -4,-2.5 -2,-0.2 1,-0.1 -1,-0.2 0.794 123.6 34.7 -78.9 -30.7 5.4 79.0 45.8 472 37 D Y H < S+ 0 0 65 -4,-1.8 -2,-0.2 -5,-0.2 -3,-0.2 0.573 79.9 120.0-109.9 -12.2 1.7 78.2 45.5 473 38 D V < + 0 0 2 -4,-2.0 2,-0.3 -5,-0.2 58,-0.1 -0.235 39.8 173.1 -54.5 140.6 0.4 80.5 42.8 474 39 D K + 0 0 96 56,-0.2 3,-0.3 -328,-0.1 58,-0.3 -0.922 22.7 65.0-145.6 171.3 -1.1 78.6 39.8 475 40 D G S > S- 0 0 8 -330,-2.9 3,-2.6 -2,-0.3 -327,-0.1 -0.318 97.6 -46.0 95.1 175.0 -2.9 79.1 36.6 476 41 D P T 3 S+ 0 0 56 0, 0.0 3,-0.3 0, 0.0 4,-0.2 0.574 131.5 58.7 -69.1 -5.5 -2.0 80.7 33.3 477 42 D H T 3> S+ 0 0 80 -3,-0.3 4,-2.3 1,-0.2 5,-0.3 0.226 73.5 115.4 -96.7 11.2 -0.6 83.9 35.0 478 43 D F H <> S+ 0 0 0 -3,-2.6 4,-2.7 1,-0.2 5,-0.4 0.851 71.4 47.7 -44.4 -51.3 1.9 81.7 36.9 479 44 D F H > S+ 0 0 4 -3,-0.3 4,-1.9 1,-0.2 5,-0.2 0.964 115.0 45.0 -67.5 -42.3 5.1 83.1 35.3 480 45 D T H > S+ 0 0 72 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.903 119.5 39.7 -63.1 -45.1 4.1 86.7 35.7 481 46 D L H X S+ 0 0 5 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.876 110.7 56.2 -79.9 -41.9 2.9 86.4 39.3 482 47 D H H X S+ 0 0 10 -4,-2.7 4,-1.5 -5,-0.3 -2,-0.2 0.947 115.7 40.9 -51.1 -48.1 5.7 84.0 40.5 483 48 D E H X S+ 0 0 103 -4,-1.9 4,-2.2 -5,-0.4 3,-0.3 0.953 113.5 51.7 -68.6 -46.4 8.2 86.6 39.3 484 49 D K H X S+ 0 0 41 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.900 107.6 53.5 -55.9 -43.5 6.2 89.6 40.6 485 50 D F H X S+ 0 0 0 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.874 108.6 50.1 -64.8 -33.1 5.9 88.0 44.1 486 51 D E H X S+ 0 0 73 -4,-1.5 4,-2.2 -3,-0.3 -1,-0.2 0.922 109.1 50.4 -65.1 -47.0 9.7 87.6 44.2 487 52 D E H X S+ 0 0 116 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.941 111.3 50.6 -57.4 -44.5 10.4 91.2 43.2 488 53 D L H X S+ 0 0 5 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.863 109.3 48.9 -64.8 -38.0 8.0 92.3 46.0 489 54 D Y H X S+ 0 0 9 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.801 106.0 56.2 -71.8 -28.8 9.6 90.2 48.7 490 55 D D H X S+ 0 0 80 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.929 110.4 46.7 -62.0 -46.4 13.0 91.5 47.7 491 56 D H H X S+ 0 0 35 -4,-2.0 4,-2.5 -5,-0.2 -2,-0.2 0.926 110.0 53.4 -60.1 -41.2 11.5 95.0 48.4 492 57 D A H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.910 108.3 50.0 -61.9 -41.7 10.0 93.8 51.7 493 58 D A H X S+ 0 0 22 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.876 110.2 49.6 -66.1 -38.8 13.4 92.5 52.9 494 59 D E H X S+ 0 0 130 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.917 111.7 50.0 -62.3 -43.8 15.1 95.9 52.0 495 60 D T H X S+ 0 0 7 -4,-2.5 4,-2.6 2,-0.2 5,-0.3 0.906 106.4 55.1 -61.4 -45.8 12.3 97.7 53.9 496 61 D V H X S+ 0 0 1 -4,-2.4 4,-2.3 1,-0.2 5,-0.2 0.949 111.3 44.6 -51.0 -51.2 12.8 95.4 56.9 497 62 D D H X S+ 0 0 26 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.932 112.7 50.9 -66.7 -39.3 16.5 96.3 57.1 498 63 D T H X S+ 0 0 70 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.906 112.6 45.5 -66.7 -43.1 15.9 100.1 56.6 499 64 D I H X S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 5,-0.2 0.944 113.7 48.8 -59.7 -52.8 13.2 100.3 59.3 500 65 D A H X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.3 -2,-0.2 0.894 112.5 48.4 -55.9 -45.7 15.3 98.3 61.8 501 66 D E H X S+ 0 0 69 -4,-2.3 4,-2.0 -5,-0.2 -1,-0.2 0.852 110.4 50.0 -72.7 -29.3 18.3 100.5 61.1 502 67 D R H X S+ 0 0 67 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.939 109.6 52.4 -67.0 -44.7 16.4 103.7 61.5 503 68 D L H <>S+ 0 0 0 -4,-2.9 5,-2.8 1,-0.2 4,-0.4 0.903 111.7 47.1 -52.7 -47.1 15.0 102.4 64.9 504 69 D L H ><5S+ 0 0 51 -4,-2.2 3,-1.7 1,-0.2 -1,-0.2 0.934 107.6 56.1 -57.8 -47.4 18.6 101.7 66.0 505 70 D A H 3<5S+ 0 0 72 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.799 106.9 49.2 -61.3 -27.5 19.7 105.1 64.8 506 71 D I T 3<5S- 0 0 32 -4,-1.6 -1,-0.3 -3,-0.2 -2,-0.2 0.494 127.1 -96.3 -90.9 0.1 17.1 106.9 67.0 507 72 D G T < 5S+ 0 0 59 -3,-1.7 -3,-0.2 -4,-0.4 -2,-0.1 0.533 81.3 129.6 98.5 11.6 18.1 104.8 70.1 508 73 D G < - 0 0 2 -5,-2.8 -1,-0.2 -6,-0.2 -62,-0.0 -0.235 57.0-120.6 -93.5 179.1 15.5 102.1 70.0 509 74 D Q - 0 0 126 -2,-0.1 2,-0.1 -183,-0.0 -5,-0.0 -0.916 25.5-145.0-126.6 98.0 15.6 98.3 70.1 510 75 D P - 0 0 2 0, 0.0 2,-0.1 0, 0.0 -60,-0.1 -0.375 20.5-115.6 -65.2 136.0 14.1 96.5 67.0 511 76 D V + 0 0 8 -2,-0.1 3,-0.0 1,-0.1 -11,-0.0 -0.404 35.8 177.3 -61.7 152.4 12.2 93.3 67.5 512 77 D A + 0 0 1 -2,-0.1 -190,-0.3 1,-0.0 2,-0.3 0.060 42.9 79.7-164.4 28.7 14.1 90.4 65.8 513 78 D T S > S- 0 0 19 -192,-0.1 4,-2.5 -191,-0.1 5,-0.2 -0.960 75.9-120.6-137.2 154.8 12.4 87.0 66.4 514 79 D V H > S+ 0 0 1 -2,-0.3 4,-2.3 2,-0.2 5,-0.2 0.799 114.7 57.1 -65.9 -26.1 9.4 85.6 64.6 515 80 D K H > S+ 0 0 138 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.938 109.8 45.7 -69.1 -46.1 7.5 85.3 68.0 516 81 D E H > S+ 0 0 71 2,-0.2 4,-1.7 1,-0.2 5,-0.2 0.903 110.8 52.2 -59.9 -42.7 8.0 89.1 68.4 517 82 D Y H X S+ 0 0 0 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.913 111.2 46.4 -60.8 -44.7 6.9 89.8 64.9 518 83 D T H < S+ 0 0 84 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.937 115.4 48.5 -58.7 -46.2 3.7 87.8 65.4 519 84 D E H < S+ 0 0 125 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.712 120.9 33.6 -64.9 -24.4 3.2 89.6 68.8 520 85 D H H < S+ 0 0 76 -4,-1.7 -1,-0.2 -3,-0.2 -2,-0.2 0.582 94.4 99.3-113.3 -19.2 3.8 93.2 67.4 521 86 D A < - 0 0 22 -4,-1.8 -66,-0.1 -5,-0.2 -67,-0.1 -0.376 55.1-153.7 -71.1 154.6 2.4 93.1 63.8 522 87 D S S S+ 0 0 45 -68,-0.3 2,-0.2 -2,-0.1 -1,-0.1 0.395 83.6 50.3-104.4 -6.5 -1.1 94.5 62.8 523 88 D I S S- 0 0 16 22,-0.0 2,-0.3 23,-0.0 -2,-0.1 -0.702 78.9-135.1-113.9-180.0 -1.3 92.1 59.7 524 89 D T - 0 0 82 -2,-0.2 18,-0.0 2,-0.2 -2,-0.0 -0.926 15.0-143.9-130.1 157.2 -0.7 88.3 59.6 525 90 D D S S+ 0 0 9 -2,-0.3 -57,-0.1 -61,-0.0 -1,-0.1 0.471 79.6 95.1 -91.7 -2.7 1.2 86.0 57.2 526 91 D G + 0 0 21 -159,-0.0 2,-0.2 2,-0.0 -2,-0.2 -0.166 44.9 117.1 -74.7 176.9 -1.6 83.4 57.8 527 92 D G - 0 0 38 1,-0.1 -2,-0.0 2,-0.0 0, 0.0 -0.604 61.3-110.5 140.4 164.7 -4.6 83.0 55.5 528 93 D N + 0 0 157 -2,-0.2 2,-0.1 6,-0.0 -1,-0.1 -0.079 52.1 153.3-116.1 30.6 -6.3 80.5 53.2 529 94 D E + 0 0 45 1,-0.2 3,-0.1 5,-0.1 -2,-0.0 -0.385 4.0 155.9 -62.9 132.4 -5.7 82.1 49.8 530 95 D T + 0 0 78 -2,-0.1 -56,-0.2 1,-0.0 -1,-0.2 0.665 49.4 66.7-124.7 -48.1 -5.6 79.6 46.9 531 96 D S S > S- 0 0 46 1,-0.1 4,-2.0 -58,-0.1 5,-0.1 -0.410 83.6-115.4 -77.8 160.2 -6.5 81.3 43.6 532 97 D A H > S+ 0 0 15 -58,-0.3 4,-2.6 1,-0.2 5,-0.2 0.890 117.9 51.4 -58.2 -48.6 -4.3 84.0 41.9 533 98 D S H > S+ 0 0 64 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.904 107.8 52.2 -57.9 -43.0 -7.1 86.6 42.5 534 99 D E H > S+ 0 0 96 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.890 111.4 47.5 -59.1 -40.7 -7.3 85.7 46.2 535 100 D M H X S+ 0 0 1 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.949 114.0 45.3 -69.7 -45.4 -3.5 86.2 46.6 536 101 D V H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.916 113.2 50.4 -65.3 -42.3 -3.4 89.5 44.7 537 102 D Q H X S+ 0 0 84 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.919 108.1 54.4 -61.6 -40.4 -6.5 90.8 46.6 538 103 D A H X S+ 0 0 6 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.899 108.3 48.3 -58.2 -41.9 -4.8 89.8 49.9 539 104 D L H X S+ 0 0 0 -4,-2.0 4,-3.0 2,-0.2 5,-0.3 0.907 108.9 53.6 -65.8 -40.5 -1.7 91.8 48.9 540 105 D V H X S+ 0 0 3 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.946 109.5 49.5 -58.4 -47.0 -3.9 94.8 48.1 541 106 D N H X S+ 0 0 88 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.954 113.7 44.6 -55.5 -49.5 -5.5 94.6 51.6 542 107 D D H X S+ 0 0 14 -4,-2.3 4,-3.2 1,-0.2 -2,-0.2 0.921 112.9 49.8 -65.9 -44.9 -2.1 94.4 53.4 543 108 D Y H X S+ 0 0 0 -4,-3.0 4,-2.7 1,-0.2 -1,-0.2 0.885 110.3 50.2 -65.1 -39.6 -0.5 97.3 51.4 544 109 D K H X S+ 0 0 125 -4,-2.3 4,-2.1 -5,-0.3 -1,-0.2 0.875 112.3 47.5 -62.1 -39.6 -3.5 99.6 52.0 545 110 D Q H X S+ 0 0 65 -4,-1.9 4,-2.7 -5,-0.2 5,-0.3 0.944 111.4 51.9 -69.0 -46.2 -3.3 98.8 55.8 546 111 D I H X S+ 0 0 0 -4,-3.2 4,-2.5 -5,-0.2 -2,-0.2 0.933 109.1 50.6 -55.7 -47.3 0.4 99.5 55.6 547 112 D S H X S+ 0 0 4 -4,-2.7 4,-1.6 2,-0.2 -2,-0.2 0.945 112.0 44.3 -55.2 -53.1 -0.1 102.9 53.9 548 113 D S H X S+ 0 0 67 -4,-2.1 4,-1.1 1,-0.2 -1,-0.2 0.925 115.9 48.0 -63.7 -41.1 -2.7 104.3 56.4 549 114 D E H X S+ 0 0 56 -4,-2.7 4,-1.9 1,-0.2 3,-0.2 0.872 107.1 55.5 -65.3 -37.2 -0.7 103.1 59.4 550 115 D S H X S+ 0 0 1 -4,-2.5 4,-2.3 -5,-0.3 -1,-0.2 0.831 101.6 59.9 -62.8 -30.8 2.5 104.6 57.9 551 116 D K H X S+ 0 0 111 -4,-1.6 4,-1.5 2,-0.2 -1,-0.2 0.888 104.1 49.5 -66.3 -32.2 0.6 107.9 57.8 552 117 D F H X S+ 0 0 136 -4,-1.1 4,-2.4 -3,-0.2 5,-0.2 0.921 107.4 54.1 -69.2 -41.5 0.1 107.7 61.5 553 118 D V H X S+ 0 0 3 -4,-1.9 4,-2.9 1,-0.2 5,-0.2 0.933 106.2 53.9 -56.9 -44.8 3.9 107.0 62.0 554 119 D I H X S+ 0 0 22 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.888 108.8 48.2 -54.6 -44.7 4.6 110.2 60.0 555 120 D G H X S+ 0 0 37 -4,-1.5 4,-2.2 2,-0.2 -1,-0.2 0.913 112.8 46.8 -66.7 -43.8 2.4 112.3 62.3 556 121 D L H X S+ 0 0 25 -4,-2.4 4,-1.5 2,-0.2 -2,-0.2 0.938 113.6 49.6 -60.9 -45.1 4.0 110.9 65.5 557 122 D A H <>S+ 0 0 0 -4,-2.9 5,-3.1 -5,-0.2 -2,-0.2 0.932 111.3 47.8 -60.0 -49.9 7.5 111.4 64.0 558 123 D E H ><5S+ 0 0 113 -4,-2.5 3,-1.7 3,-0.2 -1,-0.2 0.902 107.6 55.5 -55.7 -47.5 6.7 115.0 63.0 559 124 D E H 3<5S+ 0 0 144 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.812 110.0 48.0 -54.7 -32.7 5.3 115.8 66.5 560 125 D N T 3<5S- 0 0 47 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.321 118.7-114.4 -92.1 13.5 8.7 114.5 67.9 561 126 D Q T < 5S+ 0 0 170 -3,-1.7 2,-0.7 1,-0.2 -3,-0.2 0.840 71.9 140.9 51.5 39.7 10.6 116.8 65.4 562 127 D D >< + 0 0 17 -5,-3.1 4,-1.9 1,-0.2 -1,-0.2 -0.672 14.7 161.6-107.8 74.6 11.9 113.6 63.7 563 128 D N H > S+ 0 0 123 -2,-0.7 4,-2.2 1,-0.2 -1,-0.2 0.836 70.8 59.4 -62.1 -38.6 11.7 114.6 60.0 564 129 D A H > S+ 0 0 57 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.906 107.0 44.8 -64.3 -43.6 14.2 111.8 59.0 565 130 D T H > S+ 0 0 0 1,-0.2 4,-1.6 2,-0.2 3,-0.2 0.936 112.6 52.4 -62.5 -44.1 12.0 109.0 60.3 566 131 D A H X S+ 0 0 5 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.901 105.9 54.9 -55.4 -42.6 8.9 110.6 58.8 567 132 D D H X S+ 0 0 115 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.855 101.7 58.1 -63.6 -38.1 10.7 110.8 55.4 568 133 D L H X S+ 0 0 33 -4,-1.5 4,-1.7 -3,-0.2 -1,-0.2 0.922 110.5 42.2 -52.4 -50.1 11.4 107.1 55.4 569 134 D F H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.843 107.5 59.2 -72.5 -36.3 7.7 106.3 55.7 570 135 D V H X S+ 0 0 59 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.915 108.4 47.7 -54.8 -44.0 6.7 108.9 53.1 571 136 D G H X S+ 0 0 31 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.894 109.5 53.0 -66.0 -38.1 8.9 107.1 50.6 572 137 D L H X S+ 0 0 14 -4,-1.7 4,-2.9 1,-0.2 5,-0.2 0.876 106.5 52.0 -62.5 -39.9 7.4 103.7 51.6 573 138 D I H X S+ 0 0 18 -4,-2.3 4,-2.5 2,-0.2 5,-0.3 0.929 106.4 55.0 -64.2 -43.0 3.8 105.0 51.0 574 139 D E H X S+ 0 0 146 -4,-1.9 4,-1.5 1,-0.2 -2,-0.2 0.972 112.8 42.7 -53.4 -52.6 4.9 106.2 47.5 575 140 D E H X S+ 0 0 65 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.914 114.4 47.9 -62.6 -45.3 6.1 102.6 46.7 576 141 D V H X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.884 109.6 52.1 -68.0 -37.2 3.2 100.7 48.2 577 142 D E H X S+ 0 0 88 -4,-2.5 4,-1.8 -5,-0.2 -1,-0.2 0.808 107.6 53.0 -71.5 -26.5 0.5 102.8 46.6 578 143 D K H X S+ 0 0 110 -4,-1.5 4,-2.5 -5,-0.3 -1,-0.2 0.928 110.5 46.9 -66.0 -45.1 2.1 102.3 43.2 579 144 D Q H X S+ 0 0 7 -4,-1.9 4,-3.0 1,-0.2 5,-0.3 0.900 109.7 54.9 -64.2 -39.9 2.0 98.5 43.9 580 145 D V H X S+ 0 0 16 -4,-2.6 4,-2.7 2,-0.2 5,-0.3 0.911 108.9 47.8 -58.5 -44.9 -1.6 98.8 45.0 581 146 D W H X S+ 0 0 164 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.949 114.3 46.2 -60.9 -50.3 -2.5 100.5 41.7 582 147 D M H X S+ 0 0 73 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.938 116.7 43.0 -54.1 -50.4 -0.7 97.8 39.7 583 148 D L H X S+ 0 0 6 -4,-3.0 4,-1.4 1,-0.2 -2,-0.2 0.898 114.7 49.9 -68.7 -38.5 -2.2 94.9 41.6 584 149 D S H < S+ 0 0 43 -4,-2.7 4,-0.3 -5,-0.3 -1,-0.2 0.893 107.9 54.6 -65.1 -40.1 -5.7 96.5 41.5 585 150 D S H >< S+ 0 0 62 -4,-2.5 3,-1.6 -5,-0.3 -2,-0.2 0.912 102.8 56.9 -58.4 -45.7 -5.3 97.0 37.8 586 151 D Y H 3< S+ 0 0 76 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.866 111.1 44.4 -48.2 -43.0 -4.5 93.2 37.4 587 152 D L T 3< 0 0 58 -4,-1.4 -1,-0.3 -3,-0.2 -2,-0.2 0.423 360.0 360.0 -79.5 -5.2 -7.9 92.5 39.1 588 153 D G < 0 0 125 -3,-1.6 -3,-0.1 -4,-0.3 -4,-0.0 -0.072 360.0 360.0 -88.5 360.0 -9.8 95.2 37.1