==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 14-DEC-06 2JBW . COMPND 2 MOLECULE: 2,6-DIHYDROXY-PSEUDO-OXYNICOTINE HYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ARTHROBACTER NICOTINOVORANS; . AUTHOR C.SCHLEBERGER,P.SACHELARU,R.BRANDSCH,G.E.SCHULZ . 1429 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 55012.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1055 73.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 139 9.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 54 3.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.3 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 . 89 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 191 13.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 528 36.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 25 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 2 1 3 5 7 1 8 4 1 6 1 1 2 2 2 0 4 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 3 8 4 8 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 2 2 0 0 0 4 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 4 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 8 A K > 0 0 179 0, 0.0 4,-1.9 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 157.7 97.9 26.9 132.7 2 9 A P H > + 0 0 82 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.858 360.0 53.8 -59.7 -34.7 96.1 29.4 135.1 3 10 A E H > S+ 0 0 62 2,-0.2 4,-2.5 1,-0.2 23,-0.0 0.861 107.2 49.4 -65.7 -38.8 93.8 30.2 132.2 4 11 A D H 4 S+ 0 0 101 -3,-0.3 -1,-0.2 2,-0.2 0, 0.0 0.833 109.2 52.1 -73.3 -33.6 92.9 26.5 131.6 5 12 A E H < S+ 0 0 42 -4,-1.9 -2,-0.2 1,-0.2 3,-0.2 0.908 112.6 45.4 -64.1 -44.7 92.2 26.0 135.3 6 13 A X H < S+ 0 0 7 -4,-1.9 2,-2.0 1,-0.2 -2,-0.2 0.923 106.5 61.9 -62.8 -50.6 89.8 29.0 135.3 7 14 A D < + 0 0 17 -4,-2.5 2,-1.2 -5,-0.1 -1,-0.2 -0.490 64.7 158.9 -72.4 65.1 88.1 27.8 132.0 8 15 A N > - 0 0 46 -2,-2.0 4,-2.7 -3,-0.2 5,-0.3 -0.793 19.4-172.6 -92.2 94.6 86.8 24.6 133.4 9 16 A W H > S+ 0 0 39 -2,-1.2 4,-2.7 1,-0.2 5,-0.3 0.926 77.9 46.2 -59.2 -51.9 84.2 24.1 130.8 10 17 A G H > S+ 0 0 11 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.952 116.1 45.6 -50.8 -57.1 82.4 21.2 132.4 11 18 A R H > S+ 0 0 16 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.943 117.6 42.0 -54.0 -57.4 82.4 22.7 135.9 12 19 A L H X>S+ 0 0 0 -4,-2.7 5,-2.4 2,-0.2 4,-0.8 0.912 116.3 47.1 -63.1 -43.8 81.2 26.1 134.8 13 20 A I H ><5S+ 0 0 28 -4,-2.7 3,-1.0 -5,-0.3 -1,-0.2 0.951 113.5 47.6 -66.3 -46.7 78.6 24.9 132.3 14 21 A L H 3<5S+ 0 0 36 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.807 108.9 56.0 -60.5 -30.6 77.0 22.3 134.6 15 22 A D H 3<5S- 0 0 1 -4,-1.7 134,-0.3 -5,-0.3 -1,-0.3 0.641 128.3 -97.8 -81.0 -16.2 76.9 24.9 137.4 16 23 A G T <<5 + 0 0 28 -3,-1.0 2,-0.3 -4,-0.8 -3,-0.2 0.493 69.9 148.7 116.2 5.0 74.9 27.2 135.1 17 24 A V < - 0 0 8 -5,-2.4 -1,-0.3 -6,-0.2 2,-0.1 -0.564 56.3-105.2 -66.1 131.0 77.4 29.6 133.6 18 25 A S > - 0 0 26 -2,-0.3 4,-2.1 1,-0.1 5,-0.1 -0.338 14.8-141.4 -61.5 129.9 76.2 30.6 130.1 19 26 A Y H > S+ 0 0 37 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.911 106.2 54.9 -55.1 -45.2 78.1 29.0 127.2 20 27 A S H > S+ 0 0 26 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.916 107.4 50.6 -53.9 -42.6 77.8 32.3 125.3 21 28 A D H > S+ 0 0 16 1,-0.2 4,-1.1 2,-0.2 -2,-0.2 0.913 108.9 51.1 -64.3 -40.3 79.5 34.0 128.3 22 29 A X H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.817 105.4 55.5 -64.4 -36.4 82.3 31.4 128.3 23 30 A V H X S+ 0 0 35 -4,-2.1 4,-3.0 1,-0.2 -1,-0.2 0.936 107.9 48.0 -62.6 -47.5 83.1 31.9 124.7 24 31 A G H < S+ 0 0 24 -4,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.711 110.3 54.3 -67.5 -22.2 83.5 35.7 125.2 25 32 A A H >< S+ 0 0 0 -4,-1.1 3,-1.2 2,-0.2 -2,-0.2 0.948 111.3 42.5 -72.7 -52.1 85.8 34.9 128.2 26 33 A R H 3< S+ 0 0 121 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.913 123.4 40.4 -56.7 -43.6 88.0 32.6 126.1 27 34 A D T 3< S+ 0 0 98 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.214 85.8 136.5 -93.0 14.5 87.9 35.2 123.2 28 35 A R < - 0 0 47 -3,-1.2 2,-0.2 -5,-0.1 -3,-0.1 -0.196 69.7 -92.4 -57.7 150.1 88.2 38.3 125.4 29 36 A P > - 0 0 67 0, 0.0 3,-2.6 0, 0.0 -1,-0.1 -0.516 39.2-121.3 -61.2 133.8 90.6 41.1 124.2 30 37 A K T 3 S+ 0 0 197 1,-0.3 -2,-0.1 -2,-0.2 -3,-0.0 0.749 109.7 62.1 -54.4 -29.1 93.9 40.3 126.0 31 38 A E T 3 S+ 0 0 160 2,-0.1 2,-0.5 0, 0.0 -1,-0.3 0.621 90.4 79.4 -73.9 -14.3 93.9 43.7 127.7 32 39 A I S < S- 0 0 75 -3,-2.6 2,-0.1 3,-0.0 -4,-0.0 -0.862 82.9-134.3 -97.8 127.2 90.7 42.8 129.5 33 40 A T > - 0 0 43 -2,-0.5 4,-2.6 1,-0.1 5,-0.2 -0.367 15.3-116.4 -86.9 157.2 91.3 40.6 132.5 34 41 A W H > S+ 0 0 1 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.932 116.6 49.7 -53.0 -50.8 89.5 37.4 133.5 35 42 A F H > S+ 0 0 11 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.957 114.0 43.3 -49.0 -60.2 88.3 39.1 136.8 36 43 A D H > S+ 0 0 75 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.778 109.3 58.7 -62.3 -33.3 87.0 42.3 135.1 37 44 A Y H X S+ 0 0 40 -4,-2.6 4,-1.4 1,-0.2 -1,-0.2 0.985 113.0 37.1 -59.6 -54.3 85.4 40.3 132.3 38 45 A W H X S+ 0 0 0 -4,-2.0 4,-1.6 1,-0.2 -2,-0.2 0.790 115.0 53.5 -72.6 -31.6 83.2 38.3 134.7 39 46 A X H X S+ 0 0 23 -4,-2.2 4,-1.6 -5,-0.2 -1,-0.2 0.897 106.6 53.4 -70.5 -42.1 82.5 41.2 137.1 40 47 A S H X S+ 0 0 77 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.860 109.0 50.7 -57.1 -36.7 81.4 43.4 134.1 41 48 A L H X S+ 0 0 17 -4,-1.4 4,-2.9 2,-0.2 -2,-0.2 0.875 105.2 54.6 -70.5 -37.4 78.9 40.6 133.2 42 49 A A H X S+ 0 0 0 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.815 107.7 51.1 -67.0 -33.6 77.5 40.3 136.8 43 50 A N H X S+ 0 0 70 -4,-1.6 4,-2.5 2,-0.2 -1,-0.2 0.928 110.8 47.8 -64.8 -48.5 76.7 44.0 136.7 44 51 A E H X S+ 0 0 99 -4,-1.6 4,-2.3 1,-0.2 -2,-0.2 0.927 112.1 50.0 -56.8 -49.5 74.9 43.7 133.4 45 52 A Y H X S+ 0 0 37 -4,-2.9 4,-1.6 1,-0.2 -1,-0.2 0.867 110.1 51.0 -56.6 -40.7 73.0 40.6 134.8 46 53 A E H X S+ 0 0 23 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.893 108.9 50.8 -65.6 -43.6 72.0 42.6 137.9 47 54 A Q H X S+ 0 0 103 -4,-2.5 4,-1.7 1,-0.2 3,-0.4 0.932 109.8 49.0 -59.5 -47.8 70.7 45.6 135.8 48 55 A E H X S+ 0 0 37 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.857 109.4 54.1 -61.6 -34.2 68.5 43.3 133.6 49 56 A A H X S+ 0 0 0 -4,-1.6 4,-2.1 1,-0.2 -1,-0.2 0.816 104.5 53.4 -72.8 -31.0 67.2 41.7 136.7 50 57 A E H X S+ 0 0 117 -4,-1.6 4,-1.9 -3,-0.4 -1,-0.2 0.860 108.3 50.6 -67.7 -39.1 66.1 45.1 138.2 51 58 A R H X S+ 0 0 125 -4,-1.7 4,-0.7 2,-0.2 -2,-0.2 0.848 110.2 51.0 -62.3 -37.4 64.2 45.8 135.0 52 59 A K H ><>S+ 0 0 15 -4,-1.5 5,-2.8 2,-0.2 3,-0.6 0.905 108.6 48.8 -71.1 -44.0 62.5 42.5 135.3 53 60 A V H ><5S+ 0 0 73 -4,-2.1 3,-1.2 1,-0.2 -1,-0.2 0.878 109.3 55.0 -57.3 -43.9 61.4 43.0 139.0 54 61 A A H 3<5S+ 0 0 80 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.732 110.8 45.6 -60.6 -25.7 60.1 46.4 137.9 55 62 A L T <<5S- 0 0 94 -4,-0.7 -1,-0.2 -3,-0.6 -2,-0.2 0.276 118.9-105.8-105.6 6.9 58.0 44.7 135.2 56 63 A G T < 5S+ 0 0 39 -3,-1.2 2,-1.4 1,-0.1 3,-0.3 0.547 79.6 132.4 79.9 7.5 56.6 41.9 137.4 57 64 A H >< + 0 0 13 -5,-2.8 4,-1.9 1,-0.2 3,-0.2 -0.501 19.7 156.9 -88.3 65.2 58.9 39.2 135.8 58 65 A D H > + 0 0 86 -2,-1.4 4,-1.8 1,-0.2 -1,-0.2 0.850 66.3 56.6 -59.0 -38.7 60.0 37.9 139.2 59 66 A L H > S+ 0 0 47 -3,-0.3 4,-1.4 1,-0.2 -1,-0.2 0.887 111.2 41.4 -68.9 -39.6 60.9 34.4 137.8 60 67 A S H > S+ 0 0 0 -3,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.823 109.2 62.2 -70.4 -32.7 63.4 35.8 135.2 61 68 A A H X S+ 0 0 0 -4,-1.9 4,-1.7 1,-0.2 -2,-0.2 0.891 105.0 46.2 -61.1 -41.8 64.7 38.3 137.9 62 69 A G H X S+ 0 0 1 -4,-1.8 4,-2.3 39,-0.3 -1,-0.2 0.908 112.0 50.1 -65.4 -46.2 65.8 35.4 140.1 63 70 A E H X S+ 0 0 88 -4,-1.4 4,-1.6 1,-0.2 -2,-0.2 0.855 112.4 47.4 -63.2 -35.7 67.5 33.6 137.2 64 71 A L H X S+ 0 0 8 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.821 112.2 48.5 -77.9 -32.5 69.4 36.7 136.1 65 72 A L H X S+ 0 0 9 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.834 110.1 53.0 -70.3 -35.3 70.5 37.5 139.7 66 73 A X H X S+ 0 0 3 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.860 109.2 49.8 -64.7 -37.7 71.6 33.9 139.9 67 74 A S H X S+ 0 0 27 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.894 109.8 51.1 -65.5 -40.5 73.6 34.5 136.7 68 75 A A H X S+ 0 0 0 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.949 108.3 50.9 -60.3 -52.2 75.1 37.6 138.2 69 76 A A H X S+ 0 0 1 -4,-2.6 4,-3.1 1,-0.2 -1,-0.2 0.905 110.7 49.0 -52.0 -48.8 76.2 35.8 141.4 70 77 A L H X S+ 0 0 7 -4,-1.8 4,-2.6 1,-0.2 -1,-0.2 0.827 108.3 52.3 -66.2 -36.5 77.9 33.1 139.3 71 78 A C H X S+ 0 0 3 -4,-1.9 4,-1.4 2,-0.2 -1,-0.2 0.860 113.3 46.5 -63.7 -37.0 79.8 35.5 137.1 72 79 A A H X S+ 0 0 0 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.942 112.6 49.3 -68.8 -51.0 81.0 37.1 140.4 73 80 A Q H X S+ 0 0 1 -4,-3.1 4,-1.6 1,-0.2 -2,-0.2 0.868 114.5 44.3 -48.8 -48.8 81.9 33.7 141.9 74 81 A Y H < S+ 0 0 0 -4,-2.6 4,-0.3 2,-0.2 -1,-0.2 0.703 107.5 58.5 -83.3 -17.6 83.8 32.7 138.8 75 82 A A H < S+ 0 0 0 -4,-1.4 3,-0.2 -5,-0.2 -1,-0.2 0.915 122.1 26.2 -59.3 -44.8 85.6 36.1 138.4 76 83 A Q H >< S+ 0 0 1 -4,-1.7 3,-1.7 1,-0.2 -2,-0.2 0.566 90.3 97.4-105.3 -10.3 87.0 35.6 141.9 77 84 A F T 3< S+ 0 0 2 -4,-1.6 -1,-0.2 1,-0.3 -3,-0.1 0.744 103.0 21.7 -61.9 -28.7 87.2 31.8 142.6 78 85 A L T 3 S+ 0 0 13 -4,-0.3 2,-0.4 -3,-0.2 -1,-0.3 -0.108 98.5 112.4-127.6 37.2 90.9 31.5 141.6 79 86 A W < + 0 0 37 -3,-1.7 -3,-0.0 1,-0.1 -4,-0.0 -0.863 36.3 178.5-110.0 141.5 92.1 35.2 142.1 80 87 A F + 0 0 58 -2,-0.4 -1,-0.1 4,-0.0 5,-0.0 0.493 46.2 88.9-130.5 -3.1 94.5 36.1 144.9 81 88 A D S > S- 0 0 60 1,-0.0 3,-1.4 3,-0.0 4,-0.3 0.002 98.8 -70.8 -81.3-164.4 95.3 39.8 144.8 82 89 A E T 3> S+ 0 0 120 1,-0.3 4,-0.5 2,-0.2 3,-0.5 0.714 127.0 63.5 -68.6 -21.6 93.4 42.6 146.5 83 90 A R H 3> S+ 0 0 60 1,-0.2 4,-2.7 2,-0.2 3,-0.4 0.736 81.1 84.4 -73.0 -22.0 90.3 42.4 144.2 84 91 A R H <> S+ 0 0 18 -3,-1.4 4,-2.4 1,-0.3 -1,-0.2 0.877 89.9 48.0 -46.6 -49.2 89.6 38.9 145.5 85 92 A Q H > S+ 0 0 133 -3,-0.5 4,-2.6 -4,-0.3 -1,-0.3 0.861 110.7 51.1 -63.0 -37.3 87.7 40.2 148.5 86 93 A K H X S+ 0 0 126 -4,-0.5 4,-2.5 -3,-0.4 -2,-0.2 0.914 109.9 50.5 -66.8 -41.9 85.7 42.6 146.4 87 94 A G H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.929 110.8 48.6 -56.9 -47.6 84.8 39.7 144.1 88 95 A Q H X S+ 0 0 25 -4,-2.4 4,-2.2 -5,-0.2 -2,-0.2 0.933 112.1 48.7 -61.7 -47.1 83.7 37.6 147.1 89 96 A A H X S+ 0 0 48 -4,-2.6 4,-2.5 2,-0.2 5,-0.2 0.885 108.4 53.8 -58.5 -44.3 81.6 40.5 148.4 90 97 A R H X S+ 0 0 36 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.931 109.7 47.9 -57.0 -49.1 79.9 41.1 145.0 91 98 A K H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.911 111.2 51.7 -54.9 -48.6 78.9 37.4 144.9 92 99 A V H X S+ 0 0 16 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.922 113.6 42.0 -54.4 -52.7 77.5 37.5 148.4 93 100 A E H X S+ 0 0 76 -4,-2.5 4,-1.0 1,-0.2 -1,-0.2 0.769 112.8 54.0 -72.0 -28.8 75.3 40.6 147.9 94 101 A L H X S+ 0 0 0 -4,-2.0 4,-1.7 -5,-0.2 3,-0.4 0.935 109.6 46.7 -69.6 -45.8 74.1 39.4 144.5 95 102 A Y H X S+ 0 0 1 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.814 103.9 62.5 -66.5 -33.9 72.9 36.1 145.8 96 103 A Q H < S+ 0 0 75 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.851 108.7 42.6 -59.7 -36.8 71.2 37.8 148.8 97 104 A K H < S+ 0 0 90 -4,-1.0 4,-0.5 -3,-0.4 -1,-0.2 0.858 114.2 51.4 -72.8 -40.3 69.0 39.5 146.2 98 105 A A H >X S+ 0 0 0 -4,-1.7 3,-1.4 1,-0.2 4,-0.8 0.875 94.4 74.4 -63.2 -41.5 68.5 36.4 144.2 99 106 A A G >< S+ 0 0 1 -4,-2.6 7,-2.8 1,-0.3 3,-0.7 0.780 94.5 45.2 -54.3 -44.2 67.4 34.2 147.1 100 107 A P G 34 S+ 0 0 90 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.762 113.1 53.9 -72.7 -16.9 63.9 35.4 147.7 101 108 A L G <4 S+ 0 0 38 -3,-1.4 -39,-0.3 -4,-0.5 -2,-0.2 0.569 85.7 108.9 -88.1 -10.9 63.2 35.3 143.9 102 109 A L S << S- 0 0 10 -4,-0.8 -43,-0.0 -3,-0.7 -41,-0.0 -0.182 79.6-102.9 -65.0 157.9 64.2 31.7 143.5 103 110 A S S S+ 0 0 89 1,-0.4 -1,-0.1 -44,-0.1 -2,-0.1 -0.856 121.9 20.2-125.6 99.6 61.7 29.0 142.8 104 111 A P S S- 0 0 33 0, 0.0 -1,-0.4 0, 0.0 -2,-0.1 0.494 115.7-116.8 -78.4 156.3 61.5 27.8 145.5 105 112 A P - 0 0 54 0, 0.0 19,-0.7 0, 0.0 2,-0.7 -0.151 14.5-127.6 -58.1 145.8 62.9 30.7 147.6 106 113 A A E -A 123 0A 5 -7,-2.8 2,-0.4 17,-0.2 17,-0.2 -0.885 29.7-148.0 -93.5 117.3 66.1 30.4 149.5 107 114 A E E -A 122 0A 79 15,-3.7 15,-2.6 -2,-0.7 2,-0.5 -0.739 6.9-127.9 -98.6 134.7 65.3 31.5 153.1 108 115 A R E -A 121 0A 87 -2,-0.4 2,-0.5 13,-0.2 13,-0.2 -0.665 23.1-178.9 -85.4 122.3 67.8 33.3 155.3 109 116 A H E -A 120 0A 45 11,-3.3 11,-2.7 -2,-0.5 2,-1.1 -0.993 21.2-143.6-116.4 122.5 68.5 31.9 158.8 110 117 A E E +A 119 0A 142 -2,-0.5 2,-0.2 9,-0.2 -2,-0.0 -0.706 23.9 178.9 -99.9 96.7 71.0 34.0 160.7 111 118 A L E -A 118 0A 37 7,-1.1 7,-3.4 -2,-1.1 2,-0.4 -0.488 17.1-156.4 -92.0 157.3 73.2 31.9 162.9 112 119 A V E -A 117 0A 99 5,-0.3 2,-0.7 -2,-0.2 3,-0.1 -0.976 4.4-166.6-133.3 119.8 76.1 33.0 165.1 113 120 A V E > S-A 116 0A 22 3,-3.2 3,-0.8 -2,-0.4 72,-0.0 -0.910 76.7 -28.5-112.3 104.3 78.8 30.4 166.0 114 121 A D T 3 S- 0 0 140 -2,-0.7 -1,-0.2 1,-0.2 0, 0.0 0.953 128.4 -41.0 53.5 59.5 80.9 31.7 168.8 115 122 A G T 3 S+ 0 0 69 1,-0.2 -1,-0.2 -3,-0.1 0, 0.0 0.271 118.5 114.8 80.7 -9.1 80.6 35.5 168.0 116 123 A I E < -A 113 0A 26 -3,-0.8 -3,-3.2 2,-0.0 -1,-0.2 -0.850 67.0-128.2-105.5 114.8 80.9 34.6 164.3 117 124 A P E -A 112 0A 54 0, 0.0 -5,-0.3 0, 0.0 58,-0.1 -0.278 24.3-176.2 -54.3 136.8 78.0 35.2 161.9 118 125 A X E -A 111 0A 1 -7,-3.4 -7,-1.1 2,-0.0 -6,-0.1 -0.623 13.0-153.1-139.1 82.5 77.1 32.2 159.8 119 126 A P E -A 110 0A 11 0, 0.0 46,-0.5 0, 0.0 2,-0.4 -0.307 12.5-163.5 -49.3 125.8 74.3 32.9 157.3 120 127 A V E -A 109 0A 0 -11,-2.7 -11,-3.3 44,-0.1 2,-0.5 -0.988 4.1-155.1-119.0 130.4 72.3 29.7 156.4 121 128 A Y E -AB 108 163A 8 42,-2.3 42,-2.1 -2,-0.4 2,-0.4 -0.889 10.1-169.5-107.7 128.0 70.1 29.5 153.4 122 129 A V E -AB 107 162A 2 -15,-2.6 -15,-3.7 -2,-0.5 2,-0.4 -0.966 5.6-164.6-124.3 130.6 67.2 27.0 153.3 123 130 A R E -AB 106 161A 2 38,-2.4 38,-1.7 -2,-0.4 -17,-0.2 -0.950 9.8-154.2-117.9 131.5 65.1 26.0 150.3 124 131 A I - 0 0 35 -19,-0.7 36,-0.1 -2,-0.4 9,-0.1 -0.874 13.8-124.4-111.8 132.0 61.8 24.2 150.8 125 132 A P - 0 0 13 0, 0.0 31,-0.1 0, 0.0 -1,-0.1 -0.078 44.6 -79.2 -60.4 172.6 60.0 21.9 148.2 126 133 A E S S+ 0 0 152 29,-0.3 0, 0.0 -22,-0.0 0, 0.0 -0.218 87.6 9.0 -78.9 162.8 56.4 22.5 147.1 127 134 A G S S- 0 0 59 -2,-0.0 0, 0.0 2,-0.0 0, 0.0 -0.107 105.2 -21.9 65.6-163.8 53.1 21.7 149.0 128 135 A P S S+ 0 0 125 0, 0.0 70,-0.0 0, 0.0 0, 0.0 -0.160 75.6 117.4 -71.5 174.5 52.9 20.5 152.6 129 136 A G - 0 0 51 2,-0.1 2,-0.2 70,-0.0 70,-0.1 -0.376 67.8-123.3-132.2-150.6 55.6 18.8 154.7 130 137 A P - 0 0 74 0, 0.0 69,-0.3 0, 0.0 68,-0.1 0.548 59.1-158.1 -68.9 170.1 57.6 18.0 156.7 131 138 A H E -c 199 0A 19 67,-2.5 69,-2.5 -2,-0.2 28,-0.1 -0.931 19.0-117.3-125.4 137.9 60.5 17.6 154.3 132 139 A P E - 0 0 8 0, 0.0 28,-3.7 0, 0.0 2,-0.4 -0.293 39.5-146.1 -57.6 158.2 63.8 15.6 154.2 133 140 A A E -cd 204 160A 0 70,-2.3 72,-2.0 67,-0.3 2,-0.5 -0.995 14.4-152.9-135.8 145.3 66.8 18.0 153.9 134 141 A V E -cd 205 161A 0 26,-2.7 28,-2.4 -2,-0.4 2,-0.5 -0.968 9.9-152.3-114.3 117.1 70.2 18.0 152.3 135 142 A I E -cd 206 162A 0 70,-2.4 72,-3.1 -2,-0.5 2,-0.5 -0.754 18.0-155.0 -77.7 126.8 73.0 20.1 153.8 136 143 A X E -cd 207 163A 7 26,-2.9 28,-0.6 -2,-0.5 2,-0.5 -0.935 2.6-153.3-113.2 130.9 75.3 21.0 151.0 137 144 A L E -cd 208 164A 4 70,-2.8 72,-2.4 -2,-0.5 75,-0.2 -0.869 5.4-143.9-110.1 130.0 79.0 21.8 151.7 138 145 A G - 0 0 8 26,-0.5 5,-0.2 -2,-0.5 77,-0.2 -0.153 17.3-141.7 -76.8-178.8 81.2 24.0 149.5 139 146 A G - 0 0 0 3,-0.4 -1,-0.1 72,-0.2 71,-0.1 -0.080 50.5 -43.1-120.3-144.0 84.9 23.3 148.9 140 147 A L S S- 0 0 20 1,-0.1 -2,-0.1 29,-0.1 70,-0.1 0.953 139.6 -3.2 -55.4 -50.8 88.1 25.2 148.6 141 148 A E S S+ 0 0 22 28,-0.1 2,-0.1 2,-0.1 -1,-0.1 0.636 108.9 102.4-120.3 -24.9 86.4 27.9 146.4 142 149 A S - 0 0 3 67,-0.1 -3,-0.4 -5,-0.1 2,-0.2 -0.443 52.7-179.8 -57.4 129.5 82.8 26.5 146.0 143 150 A T >> - 0 0 8 -5,-0.2 3,-2.1 -2,-0.1 4,-0.6 -0.740 45.5 -84.2-127.5-179.4 80.6 28.5 148.4 144 151 A K T 34 S+ 0 0 6 1,-0.3 3,-0.4 -2,-0.2 4,-0.1 0.772 124.3 59.7 -58.9 -29.2 76.8 28.5 149.3 145 152 A E T 34 S+ 0 0 2 1,-0.2 3,-0.5 2,-0.1 -1,-0.3 0.656 98.1 62.4 -68.9 -16.6 76.0 30.7 146.3 146 153 A E T X4 S+ 0 0 2 -3,-2.1 3,-0.5 1,-0.2 -1,-0.2 0.793 83.6 70.6 -85.8 -28.4 77.4 28.1 143.8 147 154 A S T 3X + 0 0 20 -4,-0.6 4,-2.8 -3,-0.4 3,-0.4 0.271 54.6 119.6 -85.0 10.0 75.2 25.0 144.3 148 155 A F H 3> S+ 0 0 9 -3,-0.5 4,-2.3 1,-0.2 -1,-0.2 0.810 76.8 50.0 -41.6 -43.0 72.0 26.3 142.7 149 156 A Q H <> S+ 0 0 67 -3,-0.5 4,-1.4 -134,-0.3 -1,-0.2 0.919 112.2 44.3 -70.3 -46.5 72.0 23.5 140.0 150 157 A X H > S+ 0 0 3 -3,-0.4 4,-1.6 2,-0.2 -1,-0.2 0.870 111.9 56.9 -61.9 -38.5 72.5 20.6 142.4 151 158 A E H >X S+ 0 0 1 -4,-2.8 4,-3.0 1,-0.2 3,-0.6 0.969 103.5 51.5 -54.3 -56.2 69.9 22.2 144.7 152 159 A N H 3X S+ 0 0 28 -4,-2.3 4,-1.7 1,-0.3 -1,-0.2 0.805 106.5 54.7 -55.9 -37.4 67.2 22.2 142.0 153 160 A L H 3X S+ 0 0 21 -4,-1.4 4,-0.6 2,-0.2 -1,-0.3 0.885 114.2 39.7 -57.9 -45.9 67.8 18.5 141.2 154 161 A V H <<>S+ 0 0 0 -4,-1.6 5,-1.4 -3,-0.6 3,-0.4 0.882 114.5 52.3 -77.7 -38.1 67.2 17.5 144.9 155 162 A L H ><5S+ 0 0 13 -4,-3.0 3,-0.9 1,-0.2 -29,-0.3 0.784 106.3 55.7 -62.4 -32.9 64.3 20.0 145.4 156 163 A D H 3<5S+ 0 0 99 -4,-1.7 -1,-0.2 -5,-0.3 -2,-0.2 0.749 107.1 52.2 -64.0 -28.7 62.7 18.5 142.3 157 164 A R T 3<5S- 0 0 14 -4,-0.6 -1,-0.2 -3,-0.4 -2,-0.2 0.160 126.8 -95.6-102.2 18.3 63.0 15.2 144.1 158 165 A G T < 5S+ 0 0 27 -3,-0.9 2,-0.4 1,-0.2 -3,-0.2 0.784 82.3 122.5 81.9 33.3 61.3 16.3 147.3 159 166 A X < - 0 0 0 -5,-1.4 -26,-0.2 -8,-0.2 -1,-0.2 -0.989 55.1-130.7-131.8 123.3 64.2 17.2 149.6 160 167 A A E - d 0 133A 0 -28,-3.7 -26,-2.7 -2,-0.4 2,-0.3 -0.166 24.1-144.5 -58.3 161.7 65.0 20.6 151.3 161 168 A T E -Bd 123 134A 1 -38,-1.7 -38,-2.4 -28,-0.2 2,-0.4 -0.986 12.8-168.5-133.4 146.6 68.4 22.1 150.9 162 169 A A E -Bd 122 135A 0 -28,-2.4 -26,-2.9 -2,-0.3 2,-0.3 -0.996 7.4-177.1-137.4 131.1 70.7 24.1 153.3 163 170 A T E +Bd 121 136A 2 -42,-2.1 -42,-2.3 -2,-0.4 2,-0.3 -0.917 9.9 153.5-129.3 151.7 73.8 26.0 152.5 164 171 A F E - d 0 137A 1 -28,-0.6 2,-0.5 -2,-0.3 -26,-0.5 -0.965 40.2-109.3-166.1 165.7 76.4 27.9 154.5 165 172 A D - 0 0 5 -46,-0.5 3,-0.1 -2,-0.3 -22,-0.1 -0.957 36.2-170.6-112.9 118.8 80.1 29.0 154.5 166 173 A G > - 0 0 0 -2,-0.5 3,-2.4 1,-0.2 6,-0.3 -0.173 45.1 -34.5 -96.2-170.1 82.3 27.3 157.1 167 174 A P T 3 S+ 0 0 0 0, 0.0 12,-0.3 0, 0.0 -1,-0.2 -0.192 131.1 8.2 -51.8 130.2 85.9 28.0 158.2 168 175 A G T 3 S+ 0 0 5 8,-3.1 2,-0.4 1,-0.2 10,-0.2 0.399 110.8 108.5 82.8 -0.2 88.1 29.2 155.4 169 176 A Q S X> S- 0 0 6 -3,-2.4 3,-2.0 7,-0.2 4,-1.1 -0.869 81.6 -57.6-116.1 141.0 85.2 29.6 153.1 170 177 A G G >4 S+ 0 0 13 -2,-0.4 3,-0.5 1,-0.3 4,-0.4 0.063 121.1 7.6 47.1-119.2 83.3 32.5 151.6 171 178 A E G 34 S+ 0 0 50 1,-0.2 3,-0.3 2,-0.1 -1,-0.3 0.667 131.0 54.1 -74.2 -22.7 81.8 34.8 154.2 172 179 A X G X> S+ 0 0 3 -3,-2.0 4,-2.1 -6,-0.3 3,-1.8 0.695 82.6 86.8 -84.7 -20.5 83.5 33.2 157.1 173 180 A F T << S+ 0 0 38 -4,-1.1 -1,-0.2 -3,-0.5 -2,-0.1 0.816 83.9 59.6 -48.3 -41.3 87.1 33.4 155.6 174 181 A E T 34 S+ 0 0 141 -4,-0.4 -1,-0.3 -3,-0.3 -2,-0.1 0.849 117.3 30.5 -49.7 -42.0 87.3 36.9 157.2 175 182 A Y T <4 S+ 0 0 115 -3,-1.8 2,-0.3 1,-0.3 -2,-0.2 0.662 128.9 24.5 -96.9 -22.4 86.8 35.5 160.6 176 183 A K < - 0 0 62 -4,-2.1 -8,-3.1 -10,-0.1 -1,-0.3 -0.886 62.3-146.8-157.4 114.2 88.3 32.0 160.4 177 184 A R - 0 0 100 -2,-0.3 79,-0.2 -10,-0.2 -8,-0.1 -0.191 61.9 -54.1 -66.6 170.5 90.9 30.4 158.2 178 185 A I S S- 0 0 4 77,-2.8 2,-0.3 -10,-0.2 -10,-0.2 -0.146 71.7-161.7 -50.1 142.8 90.5 26.7 157.3 179 186 A A - 0 0 10 -12,-0.3 3,-0.4 -3,-0.1 -1,-0.1 -0.841 32.8-125.3-136.8 167.0 90.1 24.6 160.5 180 187 A G S S+ 0 0 36 -2,-0.3 3,-0.2 1,-0.2 -2,-0.1 0.394 101.4 57.9 -93.7 1.6 90.3 21.1 161.9 181 188 A D >> + 0 0 41 1,-0.1 3,-1.5 2,-0.1 4,-0.5 -0.327 51.6 139.3-130.7 49.4 86.8 21.0 163.4 182 189 A Y H >> + 0 0 3 -3,-0.4 4,-1.9 1,-0.3 3,-1.0 0.825 66.4 74.6 -62.9 -29.5 84.4 21.6 160.5 183 190 A E H 3> S+ 0 0 39 1,-0.3 4,-2.2 2,-0.2 -1,-0.3 0.762 88.0 63.1 -52.5 -29.3 82.1 19.0 162.0 184 191 A K H <> S+ 0 0 93 -3,-1.5 4,-0.9 2,-0.2 -1,-0.3 0.919 104.7 42.5 -60.8 -47.4 81.2 21.6 164.5 185 192 A Y H < - 0 0 29 -4,-2.6 3,-1.2 1,-0.1 5,-0.0 -0.506 69.6-149.5 -71.3 127.4 62.7 23.9 162.2 197 204 A E T 3 S+ 0 0 173 -2,-0.3 -1,-0.1 1,-0.3 4,-0.1 0.677 88.0 70.2 -76.8 -19.3 59.4 22.0 162.1 198 205 A A T 3 S+ 0 0 42 -68,-0.1 -67,-2.5 -69,-0.1 2,-0.3 0.440 91.2 76.2 -76.6 -0.4 59.2 21.9 158.3 199 206 A I E < S-c 131 0A 8 -3,-1.2 2,-0.8 -6,-0.3 5,-0.1 -0.911 85.4-117.1-120.3 142.0 62.1 19.4 158.2 200 207 A R E > - 0 0 76 -69,-2.5 3,-2.6 -2,-0.3 -67,-0.3 -0.669 21.7-155.5 -78.9 111.2 62.2 15.7 158.9 201 208 A N E 3 S+ 0 0 76 -2,-0.8 3,-0.4 1,-0.3 -1,-0.2 0.793 95.6 43.3 -58.7 -30.1 64.7 15.3 162.0 202 209 A D E 3 S+ 0 0 127 1,-0.2 -1,-0.3 24,-0.1 -2,-0.1 0.190 107.8 66.6 -99.9 17.6 65.5 11.7 161.1 203 210 A A E < + 0 0 1 -3,-2.6 -70,-2.3 -72,-0.1 2,-0.6 -0.266 66.0 121.5-131.6 50.9 65.8 12.6 157.4 204 211 A I E +c 133 0A 3 21,-0.5 23,-2.0 -3,-0.4 24,-0.7 -0.934 32.5 176.2-118.1 113.4 68.9 14.9 157.1 205 212 A G E -ce 134 228A 0 -72,-2.0 -70,-2.4 -2,-0.6 2,-0.4 -0.542 22.4-128.9-102.5 172.1 71.8 14.0 154.9 206 213 A V E -ce 135 229A 0 22,-1.5 24,-2.6 -72,-0.2 2,-0.5 -0.995 13.8-169.4-124.7 131.5 75.1 15.8 153.9 207 214 A L E -ce 136 230A 3 -72,-3.1 -70,-2.8 -2,-0.4 2,-0.5 -0.960 10.1-167.6-119.1 110.5 76.4 16.3 150.4 208 215 A G E -ce 137 231A 0 22,-2.6 24,-2.7 -2,-0.5 2,-0.5 -0.890 7.4-151.8-103.4 127.3 80.0 17.6 150.2 209 216 A R E > - e 0 232A 13 -72,-2.4 3,-2.5 -2,-0.5 2,-0.2 -0.856 60.7 -44.3 -99.3 122.5 81.5 19.0 146.9 210 217 A S T >> S+ 0 0 6 22,-3.7 3,-2.1 -2,-0.5 4,-0.8 -0.452 143.1 6.9 62.5-122.2 85.3 18.7 146.4 211 218 A L H >> S+ 0 0 8 1,-0.3 4,-1.8 -2,-0.2 3,-0.6 0.853 128.8 68.6 -52.0 -31.7 86.9 19.7 149.7 212 219 A G H <> S+ 0 0 0 -3,-2.5 4,-2.1 1,-0.2 -1,-0.3 0.799 90.4 60.4 -55.9 -30.7 83.3 19.7 150.8 213 220 A G H <> S+ 0 0 0 -3,-2.1 4,-1.9 19,-0.3 -1,-0.2 0.866 102.2 50.3 -65.4 -41.0 83.4 15.9 150.4 214 221 A N H X S+ 0 0 0 -4,-2.5 4,-1.3 1,-0.2 3,-0.9 0.936 109.2 51.6 -67.5 -48.5 80.7 15.3 159.7 220 227 A A H 3< S+ 0 0 5 -4,-2.0 62,-0.5 1,-0.3 -1,-0.2 0.828 110.6 50.5 -56.6 -34.7 79.1 11.9 159.1 221 228 A A H 3< S+ 0 0 7 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.714 119.1 36.4 -77.9 -22.1 81.8 10.3 161.3 222 229 A C H << S+ 0 0 49 -3,-0.9 -2,-0.2 -4,-0.9 -1,-0.2 0.438 110.0 66.6-107.8 -3.0 81.2 12.9 164.1 223 230 A E >< - 0 0 13 -4,-1.3 3,-1.5 1,-0.1 -1,-0.2 -0.850 50.9-175.5-128.9 97.9 77.4 13.3 163.8 224 231 A P T 3 S+ 0 0 135 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.725 82.2 68.6 -65.7 -16.7 75.1 10.3 164.7 225 232 A R T 3 S+ 0 0 96 -22,-0.0 2,-0.5 2,-0.0 -21,-0.5 0.754 72.9 103.8 -69.8 -25.3 72.1 12.4 163.6 226 233 A L < - 0 0 5 -3,-1.5 -21,-0.2 -7,-0.2 56,-0.2 -0.491 50.8-168.5 -72.4 125.3 73.0 12.4 160.0 227 234 A A + 0 0 31 -23,-2.0 2,-0.3 -2,-0.5 -22,-0.2 0.577 68.8 17.1 -89.9 -8.1 70.9 9.9 157.9 228 235 A A E -e 205 0A 0 -24,-0.7 -22,-1.5 55,-0.2 2,-0.3 -0.986 59.2-160.2-158.7 161.6 73.0 10.1 154.7 229 236 A C E -ef 206 285A 0 55,-1.2 57,-3.3 -2,-0.3 2,-0.4 -0.944 3.5-173.7-157.2 126.3 76.4 11.1 153.2 230 237 A I E -ef 207 286A 0 -24,-2.6 -22,-2.6 -2,-0.3 2,-0.7 -0.987 8.4-164.5-123.9 128.2 77.9 11.9 149.9 231 238 A S E -ef 208 287A 0 55,-2.9 57,-2.5 -2,-0.4 2,-0.8 -0.946 14.5-175.2-104.3 107.4 81.6 12.6 149.1 232 239 A W E S-ef 209 288A 4 -24,-2.7 -22,-3.7 -2,-0.7 -19,-0.3 -0.848 76.5 -22.3-110.7 96.1 81.6 14.2 145.7 233 240 A G S S+ 0 0 1 55,-1.9 -1,-0.2 -2,-0.8 -19,-0.1 0.793 108.3 142.4 71.4 27.9 85.2 14.7 144.5 234 241 A G - 0 0 0 54,-0.3 2,-0.3 -21,-0.2 -23,-0.2 -0.066 36.5-151.2 -86.2-168.2 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142.4 97.7 19.5 143.3 245 252 A T >> - 0 0 31 1,-0.1 4,-2.1 -2,-0.1 3,-0.6 -0.167 34.9-104.6 -56.5 156.6 97.5 22.0 140.4 246 253 A P H 3> S+ 0 0 93 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 0.896 122.3 48.2 -49.5 -43.5 99.5 25.2 140.9 247 254 A L H 3> S+ 0 0 22 1,-0.2 4,-1.3 2,-0.2 5,-0.1 0.721 107.2 55.0 -75.0 -24.4 96.3 27.2 141.5 248 255 A T H <> S+ 0 0 18 -3,-0.6 4,-2.8 2,-0.2 -1,-0.2 0.902 107.5 49.4 -71.7 -43.4 95.0 24.6 144.1 249 256 A K H X S+ 0 0 41 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.861 110.2 52.4 -61.1 -36.2 98.2 25.0 146.1 250 257 A E H X S+ 0 0 64 -4,-1.5 4,-1.8 -5,-0.2 -1,-0.2 0.836 109.3 49.0 -66.7 -37.1 97.7 28.8 145.9 251 258 A S H X S+ 0 0 2 -4,-1.3 4,-2.7 2,-0.2 5,-0.3 0.891 109.2 51.7 -69.4 -43.2 94.2 28.3 147.2 252 259 A W H X S+ 0 0 3 -4,-2.8 4,-1.4 1,-0.2 -2,-0.2 0.960 111.5 48.1 -53.9 -52.7 95.4 26.1 150.1 253 260 A K H <>S+ 0 0 55 -4,-2.4 5,-1.7 1,-0.2 4,-0.3 0.889 113.9 48.7 -48.8 -46.3 97.9 28.8 150.9 254 261 A Y H ><5S+ 0 0 60 -4,-1.8 3,-1.1 1,-0.2 -2,-0.2 0.905 110.6 45.7 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1,-0.3 -1,-0.3 -35,-0.2 -34,-0.1 0.574 111.1 -94.0 60.5 12.3 84.1 15.9 140.6 324 331 A C G X S+ 0 0 3 -3,-2.5 3,-1.4 1,-0.1 -1,-0.3 0.828 79.2 149.7 53.6 34.4 83.4 14.2 137.3 325 332 A H G X + 0 0 4 -3,-1.3 3,-1.0 1,-0.3 -311,-0.1 0.745 63.3 63.3 -68.0 -26.5 82.5 17.5 135.8 326 333 A N G 3 S+ 0 0 66 1,-0.2 -1,-0.3 -4,-0.1 -2,-0.1 0.474 92.5 66.2 -78.0 -1.8 83.6 16.4 132.4 327 334 A L G X S- 0 0 30 -3,-1.4 3,-0.6 1,-0.3 -1,-0.2 0.301 99.6-131.2-102.8 8.1 81.0 13.7 132.3 328 335 A G T < - 0 0 4 -3,-1.0 4,-0.4 1,-0.2 -1,-0.3 -0.291 51.4 -35.5 72.7-158.1 77.9 16.0 132.2 329 336 A I T 3> S+ 0 0 74 1,-0.2 4,-2.4 2,-0.1 3,-0.4 0.638 109.5 89.2 -77.8 -16.1 74.8 15.8 134.3 330 337 A R H <> S+ 0 0 66 -3,-0.6 4,-2.2 1,-0.3 5,-0.2 0.910 87.3 47.2 -59.7 -50.7 74.5 12.0 134.7 331 338 A P H > S+ 0 0 3 0, 0.0 4,-1.3 0, 0.0 -1,-0.3 0.878 113.3 51.7 -57.2 -33.6 76.7 11.5 137.8 332 339 A R H > S+ 0 0 8 -4,-0.4 4,-2.2 -3,-0.4 -2,-0.2 0.897 108.2 50.0 -67.3 -44.3 74.8 14.4 139.4 333 340 A L H X S+ 0 0 4 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-4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.725 132.3 26.0-100.3 -27.1 65.9 10.1 152.5 344 351 A V T <5S+ 0 0 52 -4,-1.9 -3,-0.2 -5,-0.4 2,-0.1 0.845 109.5 65.2-101.8 -54.3 62.5 10.1 150.7 345 352 A A S - 0 0 139 -2,-0.3 4,-1.6 1,-0.1 3,-0.3 -0.565 13.1-125.8 -88.0 146.1 81.3 24.2 106.0 364 9 B P H > S+ 0 0 74 0, 0.0 4,-1.9 0, 0.0 3,-0.5 0.906 110.4 51.8 -52.0 -51.9 78.8 21.2 106.6 365 10 B E H > S+ 0 0 68 1,-0.2 4,-2.7 2,-0.2 -3,-0.0 0.866 111.7 49.0 -52.4 -39.5 80.4 20.2 109.9 366 11 B D H 4 S+ 0 0 103 -3,-0.3 -1,-0.2 2,-0.2 -4,-0.0 0.756 105.6 54.7 -77.2 -26.3 80.1 23.8 111.2 367 12 B E H < S+ 0 0 33 -4,-1.6 -1,-0.2 -3,-0.5 3,-0.2 0.887 114.8 43.0 -70.3 -34.9 76.5 24.1 110.2 368 13 B X H < S+ 0 0 17 -4,-1.9 2,-2.0 1,-0.2 -2,-0.2 0.907 105.3 62.0 -76.4 -44.3 75.9 21.0 112.3 369 14 B D < + 0 0 13 -4,-2.7 2,-1.1 -5,-0.2 -1,-0.2 -0.516 64.4 159.3 -82.3 69.1 78.0 22.0 115.2 370 15 B N > - 0 0 45 -2,-2.0 4,-2.6 -3,-0.2 5,-0.3 -0.800 20.6-170.1 -91.2 93.5 76.0 25.1 116.1 371 16 B W H > S+ 0 0 43 -2,-1.1 4,-2.7 1,-0.2 5,-0.3 0.918 79.4 48.4 -55.7 -50.2 77.2 25.4 119.7 372 17 B G H > S+ 0 0 12 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.901 114.4 44.1 -53.8 -53.6 74.7 28.0 120.6 373 18 B R H > S+ 0 0 13 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.947 117.3 43.3 -58.8 -56.3 71.6 26.3 119.2 374 19 B L H <>S+ 0 0 0 -4,-2.6 5,-2.8 1,-0.2 4,-0.4 0.884 115.1 48.2 -64.7 -40.4 72.4 22.8 120.5 375 20 B I H ><5S+ 0 0 29 -4,-2.7 3,-1.1 -5,-0.3 -1,-0.2 0.916 112.9 47.6 -66.7 -43.8 73.5 23.9 124.0 376 21 B L H 3<5S+ 0 0 25 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.791 108.0 57.0 -67.5 -26.5 70.4 26.2 124.5 377 22 B D T 3<5S- 0 0 1 -4,-1.6 134,-0.3 -5,-0.2 -1,-0.3 0.577 128.4 -96.9 -80.6 -10.0 68.2 23.4 123.3 378 23 B G T < 5S+ 0 0 39 -3,-1.1 2,-0.3 -4,-0.4 -3,-0.2 0.433 70.9 149.2 109.3 5.3 69.5 21.1 126.0 379 24 B V < - 0 0 8 -5,-2.8 -1,-0.3 -6,-0.2 -2,-0.1 -0.574 55.4-105.8 -72.0 131.2 72.3 19.1 124.2 380 25 B S > - 0 0 29 -2,-0.3 4,-2.0 1,-0.1 3,-0.4 -0.289 14.7-138.2 -66.2 131.8 75.0 18.3 126.7 381 26 B Y H > S+ 0 0 38 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.901 105.0 54.3 -50.5 -46.7 78.2 20.2 126.5 382 27 B S H > S+ 0 0 30 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.847 107.2 49.6 -62.8 -35.6 80.3 17.0 127.0 383 28 B D H > S+ 0 0 19 -3,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.876 108.9 55.3 -65.3 -39.3 78.5 15.2 124.1 384 29 B X H X S+ 0 0 0 -4,-2.0 4,-2.9 2,-0.2 -2,-0.2 0.908 107.6 46.4 -55.3 -52.8 79.2 18.3 122.0 385 30 B V H X S+ 0 0 32 -4,-2.1 4,-2.9 2,-0.2 -1,-0.2 0.862 112.1 52.0 -63.2 -39.1 83.0 18.1 122.7 386 31 B G H < S+ 0 0 25 -4,-1.7 4,-0.3 2,-0.2 -2,-0.2 0.862 109.6 49.7 -64.9 -37.4 82.9 14.4 122.0 387 32 B A H >< S+ 0 0 0 -4,-2.3 3,-1.1 2,-0.2 -2,-0.2 0.963 114.1 45.3 -63.2 -50.4 81.2 15.1 118.7 388 33 B R H 3< S+ 0 0 119 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.900 120.6 38.7 -58.9 -44.0 83.8 17.7 117.8 389 34 B D T 3< S+ 0 0 99 -4,-2.9 -1,-0.2 -5,-0.1 -2,-0.2 0.226 88.1 132.2 -95.9 14.7 86.7 15.5 118.9 390 35 B R < - 0 0 44 -3,-1.1 -3,-0.1 -4,-0.3 6,-0.1 -0.217 69.4 -85.6 -63.6 153.9 85.3 12.2 117.5 391 36 B P > - 0 0 67 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 -0.266 36.5-120.3 -60.9 150.5 87.5 9.9 115.4 392 37 B K T 3 S+ 0 0 213 1,-0.3 -2,-0.1 -3,-0.1 -3,-0.0 0.734 110.6 58.1 -70.8 -21.4 87.5 10.8 111.7 393 38 B E T 3 S+ 0 0 150 2,-0.1 2,-0.6 1,-0.0 -1,-0.3 0.549 90.8 84.2 -83.6 -9.0 86.1 7.5 110.6 394 39 B I S < S- 0 0 57 -3,-1.4 2,-0.1 4,-0.0 -4,-0.0 -0.871 77.8-138.5 -95.9 119.7 83.0 8.0 112.8 395 40 B T > - 0 0 44 -2,-0.6 4,-2.4 1,-0.1 5,-0.2 -0.339 19.6-115.4 -70.2 157.1 80.3 10.0 111.0 396 41 B W H > S+ 0 0 3 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.883 116.7 54.6 -53.5 -43.2 78.2 12.7 112.8 397 42 B F H > S+ 0 0 4 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.944 110.9 41.9 -61.0 -53.8 75.1 10.6 112.2 398 43 B D H > S+ 0 0 67 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.864 111.3 56.6 -60.4 -40.8 76.5 7.5 113.9 399 44 B Y H X S+ 0 0 40 -4,-2.4 4,-1.5 1,-0.2 -1,-0.2 0.941 113.1 38.7 -59.7 -48.7 78.1 9.4 116.8 400 45 B W H X S+ 0 0 0 -4,-2.0 4,-1.4 1,-0.2 -1,-0.2 0.708 113.7 55.3 -76.5 -22.4 74.9 11.0 117.9 401 46 B X H X S+ 0 0 25 -4,-1.4 4,-1.6 -5,-0.2 -1,-0.2 0.850 105.2 51.9 -80.9 -37.2 72.8 7.9 117.2 402 47 B S H X S+ 0 0 66 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.889 109.2 51.1 -62.6 -42.7 75.0 5.8 119.5 403 48 B L H X S+ 0 0 15 -4,-1.5 4,-3.1 2,-0.2 5,-0.2 0.880 105.4 55.9 -59.5 -40.6 74.5 8.4 122.2 404 49 B A H X S+ 0 0 0 -4,-1.4 4,-1.1 2,-0.2 -1,-0.2 0.881 109.1 47.5 -59.8 -38.7 70.7 8.2 121.7 405 50 B N H >X S+ 0 0 75 -4,-1.6 4,-1.8 2,-0.2 3,-0.5 0.959 111.3 50.9 -63.1 -53.1 71.1 4.5 122.3 406 51 B E H >X S+ 0 0 114 -4,-2.7 4,-1.8 1,-0.2 3,-0.6 0.920 110.3 47.9 -47.2 -57.1 73.2 5.1 125.4 407 52 B Y H 3X S+ 0 0 32 -4,-3.1 4,-1.9 1,-0.2 -1,-0.2 0.752 109.5 55.6 -59.8 -26.5 70.7 7.6 126.9 408 53 B E H <>S+ 0 0 4 -4,-2.3 5,-2.6 2,-0.2 3,-0.8 0.948 108.8 49.2 -59.9 -51.7 66.1 4.6 135.9 415 60 B V H ><5S+ 0 0 67 -4,-2.7 3,-1.6 1,-0.3 -1,-0.2 0.909 108.0 55.9 -51.1 -47.2 62.5 3.6 135.3 416 61 B A H 3<5S+ 0 0 82 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.804 111.0 44.2 -53.9 -34.8 63.4 0.1 136.7 417 62 B L T <<5S- 0 0 99 -4,-1.3 -1,-0.3 -3,-0.8 -2,-0.2 0.395 122.4-104.9 -94.5 0.1 64.6 1.8 139.9 418 63 B G T < 5S+ 0 0 42 -3,-1.6 2,-0.7 -4,-0.5 -3,-0.2 0.767 76.0 137.0 79.4 27.9 61.6 4.2 140.2 419 64 B H >< + 0 0 9 -5,-2.6 4,-2.3 1,-0.2 5,-0.2 -0.569 15.1 158.9-101.7 68.1 63.5 7.3 139.0 420 65 B D H > + 0 0 90 -2,-0.7 4,-2.2 1,-0.2 5,-0.2 0.904 69.9 53.3 -59.2 -46.2 60.8 8.7 136.7 421 66 B L H > S+ 0 0 54 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.938 113.1 42.9 -54.8 -51.5 62.1 12.3 136.7 422 67 B S H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.880 111.8 55.7 -61.0 -39.8 65.7 11.3 135.7 423 68 B A H X S+ 0 0 0 -4,-2.3 4,-1.4 2,-0.2 -1,-0.2 0.817 106.4 50.4 -65.4 -34.7 64.2 8.8 133.1 424 69 B G H X S+ 0 0 2 -4,-2.2 4,-2.0 39,-0.4 -1,-0.2 0.904 112.2 47.7 -65.3 -43.8 62.3 11.7 131.4 425 70 B E H X S+ 0 0 86 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.823 112.0 48.7 -66.2 -34.9 65.4 13.8 131.3 426 71 B L H X S+ 0 0 2 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.804 110.9 50.7 -77.5 -30.5 67.5 11.0 129.8 427 72 B L H X S+ 0 0 8 -4,-1.4 4,-2.6 -5,-0.2 -2,-0.2 0.859 109.1 51.1 -73.6 -35.7 64.9 10.2 127.2 428 73 B X H X S+ 0 0 3 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.930 110.3 50.3 -60.4 -47.8 64.8 13.9 126.2 429 74 B S H X S+ 0 0 27 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.883 111.3 48.2 -55.8 -43.1 68.6 13.8 125.9 430 75 B A H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.932 111.9 48.5 -65.2 -45.8 68.3 10.6 123.7 431 76 B A H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.836 111.3 51.0 -63.4 -33.7 65.6 12.3 121.5 432 77 B L H X S+ 0 0 5 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.835 107.5 52.5 -73.2 -33.9 67.8 15.4 121.2 433 78 B C H X S+ 0 0 3 -4,-1.8 4,-1.2 2,-0.2 -2,-0.2 0.879 112.8 45.3 -64.4 -40.6 70.8 13.2 120.1 434 79 B A H >X S+ 0 0 0 -4,-2.1 4,-1.7 2,-0.2 3,-0.6 0.968 111.2 53.0 -64.9 -51.6 68.5 11.6 117.4 435 80 B Q H 3X S+ 0 0 0 -4,-2.8 4,-1.3 1,-0.3 3,-0.2 0.908 114.4 42.1 -47.3 -51.3 67.2 15.1 116.4 436 81 B Y H 3< S+ 0 0 0 -4,-2.2 4,-0.3 1,-0.2 -1,-0.3 0.646 106.6 60.6 -81.1 -15.2 70.7 16.4 115.9 437 82 B A H << S+ 0 0 0 -4,-1.2 -1,-0.2 -3,-0.6 -2,-0.2 0.904 121.5 24.3 -66.7 -38.6 72.1 13.3 114.2 438 83 B Q H >< S+ 0 0 1 -4,-1.7 3,-2.0 -3,-0.2 -2,-0.2 0.533 90.4 98.2-107.5 -9.5 69.7 13.7 111.4 439 84 B F T 3< S+ 0 0 2 -4,-1.3 -1,-0.1 1,-0.3 -3,-0.1 0.775 102.4 24.5 -64.0 -28.5 68.6 17.3 111.2 440 85 B L T 3 S+ 0 0 11 -4,-0.3 2,-0.4 -3,-0.2 -1,-0.3 -0.113 99.5 112.6-124.0 33.8 71.0 18.2 108.4 441 86 B W < + 0 0 37 -3,-2.0 -3,-0.0 1,-0.1 8,-0.0 -0.898 36.8 177.9-110.1 135.3 71.4 14.7 106.9 442 87 B F + 0 0 62 -2,-0.4 -1,-0.1 4,-0.1 2,-0.1 0.371 45.3 90.9-125.4 4.2 70.0 13.9 103.4 443 88 B D S > S- 0 0 56 1,-0.0 3,-1.9 3,-0.0 4,-0.4 -0.227 97.2 -71.4 -92.5-170.3 70.8 10.2 102.6 444 89 B E T 3 S+ 0 0 151 1,-0.3 4,-0.3 2,-0.2 3,-0.2 0.626 127.8 61.0 -57.2 -18.7 68.8 7.0 103.1 445 90 B R T >> S+ 0 0 68 1,-0.2 4,-2.0 2,-0.2 3,-1.0 0.718 80.2 81.1 -82.0 -24.2 69.5 7.1 106.9 446 91 B R H <> S+ 0 0 16 -3,-1.9 4,-2.6 1,-0.3 5,-0.2 0.892 90.5 55.7 -45.3 -49.0 67.7 10.5 107.4 447 92 B Q H 3> S+ 0 0 126 -4,-0.4 4,-2.1 1,-0.2 -1,-0.3 0.846 107.1 48.8 -51.4 -42.0 64.4 8.6 107.5 448 93 B K H <> S+ 0 0 113 -3,-1.0 4,-1.8 -4,-0.3 -1,-0.2 0.863 110.8 49.2 -74.8 -35.4 65.7 6.3 110.3 449 94 B G H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.892 111.4 49.3 -66.5 -44.2 66.9 9.2 112.4 450 95 B Q H X S+ 0 0 28 -4,-2.6 4,-1.9 -5,-0.2 -2,-0.2 0.927 114.2 46.0 -57.9 -48.0 63.7 11.1 112.1 451 96 B A H X S+ 0 0 61 -4,-2.1 4,-2.0 -5,-0.2 -2,-0.2 0.793 112.2 51.5 -66.4 -32.0 61.8 7.9 113.0 452 97 B R H X S+ 0 0 33 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.899 107.5 51.6 -73.1 -43.1 64.2 7.3 115.9 453 98 B K H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.934 111.4 48.9 -53.3 -48.4 63.7 10.8 117.3 454 99 B V H X S+ 0 0 11 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.902 109.8 50.3 -61.7 -47.2 59.9 10.2 117.2 455 100 B E H X S+ 0 0 82 -4,-2.0 4,-0.9 1,-0.2 -1,-0.2 0.886 112.5 48.6 -54.3 -43.2 60.1 6.8 119.0 456 101 B L H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 3,-0.4 0.886 110.0 48.4 -71.8 -42.2 62.2 8.4 121.7 457 102 B Y H X S+ 0 0 2 -4,-2.3 4,-3.1 1,-0.2 -1,-0.2 0.882 103.9 62.1 -66.5 -36.5 60.0 11.4 122.4 458 103 B Q H < S+ 0 0 78 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.815 111.0 39.5 -55.0 -36.4 57.0 9.2 122.5 459 104 B K H < S+ 0 0 84 -4,-0.9 4,-0.4 -3,-0.4 -1,-0.2 0.821 115.4 52.5 -81.3 -36.8 58.6 7.4 125.5 460 105 B A H >X S+ 0 0 0 -4,-2.0 3,-2.2 -33,-0.2 4,-0.7 0.923 94.5 72.2 -62.8 -46.0 59.9 10.7 127.0 461 106 B A G >< S+ 0 0 0 -4,-3.1 7,-2.6 1,-0.3 3,-0.6 0.739 96.4 45.4 -48.6 -46.6 56.6 12.5 127.0 462 107 B P G 34 S+ 0 0 89 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.639 114.0 51.7 -74.7 -9.9 54.8 10.7 129.8 463 108 B L G <4 S+ 0 0 34 -3,-2.2 -39,-0.4 -4,-0.4 2,-0.3 0.445 88.6 99.0-101.6 -4.3 57.9 11.0 132.0 464 109 B L S << S- 0 0 9 -4,-0.7 -43,-0.1 -3,-0.6 4,-0.1 -0.637 82.3-106.0 -82.1 140.7 58.4 14.7 131.5 465 110 B S S S+ 0 0 79 -2,-0.3 -2,-0.0 1,-0.2 20,-0.0 -0.962 115.7 26.7-113.0 118.8 57.1 17.0 134.3 466 111 B P S S- 0 0 34 0, 0.0 -1,-0.2 0, 0.0 -3,-0.1 0.622 114.7-120.0 -73.0 157.9 54.6 18.3 133.4 467 112 B P - 0 0 67 0, 0.0 2,-0.7 0, 0.0 19,-0.5 -0.207 10.7-125.0 -68.7 153.4 53.7 15.5 131.0 468 113 B A E -I 485 0B 6 -7,-2.6 2,-0.3 17,-0.1 17,-0.2 -0.895 28.9-152.0 -96.8 112.3 53.3 15.9 127.2 469 114 B E E -I 484 0B 117 15,-3.5 15,-2.6 -2,-0.7 2,-0.5 -0.673 7.4-132.2 -89.6 138.9 49.9 14.5 126.3 470 115 B R E -I 483 0B 99 -2,-0.3 2,-0.5 13,-0.2 13,-0.2 -0.762 20.7-177.2 -91.3 128.7 49.2 13.1 122.9 471 116 B H E -I 482 0B 30 11,-2.3 11,-2.8 -2,-0.5 2,-1.6 -0.985 20.0-145.2-122.3 116.0 46.1 14.2 121.0 472 117 B E E +I 481 0B 139 -2,-0.5 -2,-0.0 9,-0.2 2,-0.0 -0.591 27.5 178.4 -90.6 79.5 45.8 12.4 117.7 473 118 B L E -I 480 0B 37 -2,-1.6 7,-3.2 7,-1.3 2,-0.4 -0.267 20.4-146.5 -70.6 160.7 44.3 15.0 115.3 474 119 B V E -I 479 0B 99 5,-0.3 2,-0.5 76,-0.1 3,-0.3 -0.924 14.2-171.1-136.0 108.5 43.6 14.4 111.6 475 120 B V E > S-I 478 0B 13 3,-2.6 3,-0.8 -2,-0.4 72,-0.1 -0.901 74.1 -13.8-106.8 127.5 44.0 17.4 109.3 476 121 B D T 3 S- 0 0 97 -2,-0.5 -1,-0.2 1,-0.3 0, 0.0 0.866 132.0 -54.1 54.8 37.5 42.8 17.3 105.6 477 122 B G T 3 S+ 0 0 65 -3,-0.3 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62.2 34.3 56.5 1100 33 D R H 3< S+ 0 0 120 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.830 118.7 38.0 -58.2 -35.4 64.1 32.7 53.6 1101 34 D D T 3< S+ 0 0 99 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.075 86.6 130.2-106.6 20.3 64.3 36.0 51.7 1102 35 D R S < S- 0 0 45 -3,-1.4 -3,-0.1 1,-0.1 6,-0.0 -0.397 73.1 -82.4 -70.3 155.7 64.8 38.3 54.7 1103 36 D P > - 0 0 77 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 -0.229 43.6-113.9 -56.4 148.4 67.7 40.9 54.6 1104 37 D K T 3 S+ 0 0 198 1,-0.3 -2,-0.1 -3,-0.1 -3,-0.0 0.744 111.5 57.9 -65.1 -25.3 71.0 39.3 55.5 1105 38 D E T 3 S+ 0 0 148 2,-0.1 2,-0.4 0, 0.0 -1,-0.3 0.609 85.2 94.3 -80.9 -10.9 71.5 41.3 58.7 1106 39 D I S < S- 0 0 66 -3,-1.8 2,-0.1 4,-0.0 -4,-0.1 -0.678 72.1-135.4 -85.9 126.0 68.2 40.2 60.3 1107 40 D T > - 0 0 66 -2,-0.4 4,-2.6 1,-0.1 5,-0.2 -0.460 16.7-118.4 -75.7 158.9 68.5 37.1 62.6 1108 41 D W H > S+ 0 0 17 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.929 114.8 48.8 -56.4 -51.2 66.1 34.2 62.5 1109 42 D F H > S+ 0 0 26 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.897 114.0 46.2 -54.9 -49.1 64.9 34.8 66.1 1110 43 D D H > S+ 0 0 82 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.907 109.6 53.5 -64.9 -44.4 64.4 38.5 65.5 1111 44 D Y H X S+ 0 0 40 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.936 115.1 40.4 -53.0 -49.5 62.5 37.9 62.2 1112 45 D W H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.852 114.3 51.4 -73.2 -36.4 60.0 35.5 63.9 1113 46 D X H X S+ 0 0 27 -4,-2.4 4,-1.9 -5,-0.2 -1,-0.2 0.856 109.8 50.5 -67.0 -35.8 59.6 37.5 67.1 1114 47 D S H X S+ 0 0 72 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.900 109.0 52.0 -67.2 -39.7 58.9 40.7 65.0 1115 48 D L H X S+ 0 0 15 -4,-1.7 4,-2.3 -5,-0.2 -2,-0.2 0.893 106.7 53.4 -62.7 -41.8 56.3 38.7 63.1 1116 49 D A H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.898 110.5 47.1 -55.5 -45.7 54.7 37.6 66.4 1117 50 D N H X S+ 0 0 64 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.894 112.0 50.3 -60.6 -45.1 54.4 41.3 67.5 1118 51 D E H X S+ 0 0 83 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.855 111.5 47.0 -60.9 -47.2 53.0 42.3 64.2 1119 52 D Y H X S+ 0 0 7 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.891 113.1 50.8 -62.9 -42.0 50.3 39.6 64.3 1120 53 D E H X S+ 0 0 27 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.921 109.0 49.4 -63.4 -43.7 49.5 40.5 67.9 1121 54 D Q H X S+ 0 0 100 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.933 111.6 49.0 -64.4 -43.8 49.1 44.2 67.1 1122 55 D E H X S+ 0 0 40 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.912 111.1 50.9 -57.0 -45.4 46.7 43.4 64.2 1123 56 D A H X S+ 0 0 0 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.887 106.3 54.6 -60.1 -43.2 44.7 41.0 66.4 1124 57 D E H X S+ 0 0 91 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.910 112.1 44.2 -56.2 -42.3 44.4 43.8 69.1 1125 58 D R H X S+ 0 0 144 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.912 110.3 54.5 -66.9 -43.6 43.0 46.1 66.5 1126 59 D K H <>S+ 0 0 13 -4,-2.7 5,-2.9 1,-0.2 3,-0.4 0.932 107.5 51.2 -55.1 -46.6 40.7 43.3 65.1 1127 60 D V H ><5S+ 0 0 67 -4,-2.8 3,-1.5 1,-0.2 -1,-0.2 0.899 107.4 52.2 -55.4 -45.3 39.3 42.8 68.6 1128 61 D A H 3<5S+ 0 0 88 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.828 111.3 49.3 -66.3 -26.4 38.6 46.5 68.9 1129 62 D L T 3<5S- 0 0 96 -4,-1.6 -1,-0.3 -3,-0.4 -2,-0.2 0.379 120.0-108.2 -92.7 4.7 36.7 46.3 65.6 1130 63 D G T < 5S+ 0 0 37 -3,-1.5 2,-1.0 -4,-0.3 -3,-0.2 0.675 78.0 132.4 79.6 21.6 34.6 43.2 66.6 1131 64 D H >< + 0 0 12 -5,-2.9 4,-2.2 1,-0.2 5,-0.1 -0.551 20.2 156.1-103.8 64.6 36.5 40.8 64.3 1132 65 D D H > + 0 0 82 -2,-1.0 4,-2.2 2,-0.2 -1,-0.2 0.825 66.4 52.0 -65.3 -38.5 37.0 38.2 67.0 1133 66 D L H > S+ 0 0 50 -3,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.953 113.1 45.1 -65.5 -51.9 37.4 35.1 64.8 1134 67 D S H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.882 110.9 56.0 -55.5 -37.8 40.1 36.8 62.8 1135 68 D A H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.905 107.0 47.5 -68.0 -40.9 41.7 38.0 66.0 1136 69 D G H X S+ 0 0 0 -4,-2.2 4,-1.9 39,-0.3 -1,-0.2 0.891 111.8 51.5 -65.1 -40.0 42.0 34.5 67.4 1137 70 D E H X S+ 0 0 92 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.850 110.5 47.2 -62.7 -39.3 43.5 33.2 64.1 1138 71 D L H X S+ 0 0 4 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.851 110.7 52.7 -69.5 -37.1 46.2 36.0 64.0 1139 72 D L H X S+ 0 0 5 -4,-2.0 4,-2.2 -5,-0.2 -2,-0.2 0.857 107.6 50.8 -67.7 -34.9 47.0 35.3 67.7 1140 73 D X H X S+ 0 0 8 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.923 110.0 50.5 -63.3 -46.2 47.5 31.6 66.9 1141 74 D S H X S+ 0 0 25 -4,-1.9 4,-1.7 1,-0.2 -2,-0.2 0.937 111.3 50.2 -50.2 -54.5 49.8 32.7 64.0 1142 75 D A H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.872 108.1 51.2 -50.8 -48.0 51.7 34.9 66.5 1143 76 D A H X S+ 0 0 1 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.866 110.9 47.4 -67.6 -34.0 52.1 32.1 69.0 1144 77 D L H X S+ 0 0 18 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.762 108.3 56.3 -79.4 -25.0 53.5 29.7 66.4 1145 78 D C H X S+ 0 0 2 -4,-1.7 4,-1.8 -5,-0.2 -2,-0.2 0.896 106.7 50.0 -61.0 -46.0 55.9 32.5 65.2 1146 79 D A H X S+ 0 0 0 -4,-2.3 4,-0.5 1,-0.2 -2,-0.2 0.891 112.0 48.0 -62.4 -41.3 57.2 32.8 68.7 1147 80 D Q H >< S+ 0 0 18 -4,-1.6 3,-1.1 1,-0.2 4,-0.3 0.915 111.2 49.1 -61.1 -47.7 57.8 29.0 68.9 1148 81 D Y H >< S+ 0 0 15 -4,-1.8 3,-0.8 1,-0.3 4,-0.2 0.791 100.1 68.0 -67.9 -29.3 59.5 28.8 65.5 1149 82 D A H 3< S+ 0 0 0 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.740 111.9 30.0 -54.5 -31.5 61.8 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6.1 58.3-122.0 56.1 12.3 69.5 1285 218 D L H >> S+ 0 0 7 1,-0.2 4,-2.1 2,-0.2 3,-0.9 0.859 129.5 65.7 -51.6 -35.3 57.2 12.0 73.1 1286 219 D G H <> S+ 0 0 0 -3,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.770 92.5 62.8 -62.5 -20.8 53.5 12.5 73.9 1287 220 D G H <> S+ 0 0 0 -3,-1.5 4,-1.7 19,-0.3 -1,-0.2 0.866 103.2 46.4 -67.1 -37.5 53.0 9.2 72.2 1288 221 D N H X S+ 0 0 0 -4,-2.5 4,-0.8 2,-0.2 3,-0.6 0.939 113.5 44.2 -63.8 -49.6 48.8 7.0 80.6 1294 227 D A H 3< S+ 0 0 5 -4,-2.5 3,-0.5 1,-0.2 62,-0.5 0.860 109.7 56.7 -60.1 -43.2 46.5 4.3 79.1 1295 228 D A H 3< S+ 0 0 5 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.760 119.7 32.0 -54.9 -27.4 48.6 1.5 80.7 1296 229 D C H << S+ 0 0 45 -4,-0.9 -2,-0.2 -3,-0.6 -1,-0.2 0.395 111.5 62.0-117.8 -1.7 47.9 3.1 84.0 1297 230 D E >< - 0 0 15 -4,-0.8 3,-1.7 -3,-0.5 -1,-0.2 -0.852 52.9-174.8-133.7 92.6 44.5 4.8 83.7 1298 231 D P T 3 S+ 0 0 113 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.722 78.4 73.1 -67.3 -17.9 41.7 2.3 83.1 1299 232 D R T 3 S+ 0 0 99 2,-0.0 -21,-0.5 -22,-0.0 2,-0.2 0.717 74.7 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