==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER RIBOSOME INHIBITOR 05-JUN-08 3DD9 . COMPND 2 MOLECULE: DEATH ON CURING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE P1; . AUTHOR A.GARCIA-PINO,R.LORIS . 931 16 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 44271.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 675 72.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 33 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 64 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 544 58.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 26 2.8 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 0 1 4 2 6 10 1 5 4 8 6 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A M 0 0 113 0, 0.0 2,-0.6 0, 0.0 80,-0.1 0.000 360.0 360.0 360.0 134.8 6.7 25.4 9.4 2 2 A R - 0 0 150 75,-0.2 2,-0.2 76,-0.1 78,-0.1 -0.867 360.0-156.4 -90.9 121.9 7.3 24.6 5.8 3 3 A H - 0 0 38 -2,-0.6 2,-0.2 1,-0.1 147,-0.0 -0.583 21.9-101.3 -93.2 159.2 8.1 20.9 5.2 4 4 A I - 0 0 4 -2,-0.2 -1,-0.1 146,-0.1 69,-0.0 -0.525 37.5-136.0 -69.8 142.5 10.0 19.2 2.4 5 5 A S >> - 0 0 29 -2,-0.2 4,-1.5 1,-0.1 3,-0.7 -0.745 22.8-108.3 -96.9 155.8 7.7 17.6 -0.2 6 6 A P H 3> S+ 0 0 43 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.857 117.2 59.0 -47.2 -41.7 8.4 14.2 -1.6 7 7 A E H 3> S+ 0 0 123 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.870 104.7 47.5 -60.8 -41.4 9.3 15.7 -5.0 8 8 A E H <> S+ 0 0 37 -3,-0.7 4,-1.7 2,-0.2 -1,-0.2 0.840 113.1 50.5 -68.8 -28.8 12.2 17.8 -3.5 9 9 A L H X S+ 0 0 0 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.944 109.2 48.0 -77.3 -46.0 13.4 14.7 -1.6 10 10 A I H X S+ 0 0 33 -4,-2.6 4,-3.1 1,-0.2 5,-0.2 0.909 112.3 52.2 -55.1 -43.4 13.4 12.4 -4.7 11 11 A A H X S+ 0 0 59 -4,-2.0 4,-2.0 -5,-0.2 5,-0.2 0.868 108.2 49.4 -64.1 -39.6 15.3 15.1 -6.6 12 12 A L H X S+ 0 0 35 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.914 114.9 46.9 -62.2 -38.6 17.9 15.5 -3.9 13 13 A H H X S+ 0 0 7 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.941 112.7 45.8 -71.4 -47.7 18.3 11.7 -4.0 14 14 A D H X S+ 0 0 67 -4,-3.1 4,-2.9 2,-0.2 5,-0.2 0.899 111.5 52.8 -60.3 -45.0 18.5 11.3 -7.8 15 15 A A H X S+ 0 0 59 -4,-2.0 4,-2.1 -5,-0.2 -1,-0.2 0.932 114.2 43.2 -58.2 -45.1 21.0 14.2 -8.2 16 16 A N H X S+ 0 0 11 -4,-1.8 4,-1.2 -5,-0.2 -1,-0.2 0.838 114.6 49.5 -69.3 -32.6 23.2 12.5 -5.6 17 17 A I H < S+ 0 0 89 -4,-2.2 -2,-0.2 3,-0.2 -1,-0.2 0.833 111.5 49.5 -72.4 -34.6 22.6 9.1 -7.2 18 18 A S H < S+ 0 0 101 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.852 111.9 51.2 -75.5 -37.5 23.5 10.5 -10.7 19 19 A R H < 0 0 120 -4,-2.1 -2,-0.2 -5,-0.2 -3,-0.1 0.971 360.0 360.0 -54.5 -72.7 26.6 12.1 -9.3 20 20 A Y < 0 0 143 -4,-1.2 -3,-0.2 0, 0.0 -2,-0.1 0.753 360.0 360.0 -57.5 360.0 28.5 9.3 -7.4 21 ! 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 22 28 A D 0 0 96 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-152.7 37.9 2.2 -2.3 23 29 A P + 0 0 82 0, 0.0 107,-0.1 0, 0.0 0, 0.0 -0.813 360.0 60.5-131.4 37.1 40.2 0.8 -1.5 24 30 A G S > S+ 0 0 27 2,-0.2 4,-1.5 3,-0.1 5,-0.1 0.392 100.9 45.7 105.6-122.7 40.4 3.0 0.2 25 31 A R H > S+ 0 0 48 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.903 115.1 51.4 -59.6 -43.7 37.2 2.6 2.2 26 32 A A H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 5,-0.3 0.871 106.3 53.5 -67.2 -37.2 37.9 -1.1 2.6 27 33 A E H > S+ 0 0 128 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.909 111.7 46.8 -60.9 -42.7 41.5 -0.5 3.8 28 34 A A H X S+ 0 0 64 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.847 110.0 52.1 -72.6 -36.7 40.1 1.8 6.5 29 35 A I H X S+ 0 0 11 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.967 113.2 42.6 -62.6 -55.5 37.3 -0.6 7.6 30 36 A I H X S+ 0 0 6 -4,-2.2 4,-3.5 2,-0.2 5,-0.3 0.878 115.7 50.1 -59.4 -44.1 39.6 -3.6 8.2 31 37 A G H X S+ 0 0 37 -4,-1.9 4,-2.5 -5,-0.3 -1,-0.2 0.928 111.0 49.0 -59.7 -46.5 42.2 -1.4 9.8 32 38 A R H X S+ 0 0 93 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.930 115.5 45.8 -56.0 -45.0 39.4 0.0 12.1 33 39 A V H X S+ 0 0 1 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.953 113.5 45.5 -68.6 -51.1 38.3 -3.5 12.8 34 40 A Q H X S+ 0 0 92 -4,-3.5 4,-1.9 1,-0.2 -1,-0.2 0.859 112.8 54.6 -59.2 -35.0 41.7 -5.0 13.5 35 41 A A H X S+ 0 0 39 -4,-2.5 4,-2.9 -5,-0.3 5,-0.3 0.955 109.3 44.2 -63.7 -53.0 42.5 -2.0 15.6 36 42 A R H X S+ 0 0 124 -4,-2.3 4,-2.4 1,-0.2 6,-0.2 0.895 111.5 54.5 -59.6 -40.4 39.5 -2.3 17.9 37 43 A V H <>S+ 0 0 14 -4,-2.3 5,-2.3 -5,-0.2 4,-0.2 0.926 115.8 38.0 -64.4 -40.3 40.0 -6.0 18.3 38 44 A A H ><5S+ 0 0 71 -4,-1.9 3,-1.2 -5,-0.2 -2,-0.2 0.985 121.4 42.1 -69.9 -55.5 43.6 -5.6 19.4 39 45 A Y H 3<5S+ 0 0 197 -4,-2.9 -3,-0.2 1,-0.3 -2,-0.2 0.828 120.2 40.4 -67.6 -35.7 43.2 -2.5 21.6 40 46 A E T 3<5S- 0 0 121 -4,-2.4 -1,-0.3 -5,-0.3 -2,-0.2 0.316 107.9-122.0 -99.6 9.3 40.0 -3.4 23.3 41 47 A E T < 5 - 0 0 165 -3,-1.2 2,-0.8 -4,-0.2 -3,-0.2 0.959 38.4-177.1 56.2 57.3 41.0 -7.1 23.7 42 48 A I < + 0 0 22 -5,-2.3 -1,-0.2 -6,-0.2 -2,-0.1 -0.833 11.5 163.3 -94.4 114.9 38.1 -8.6 21.8 43 49 A T + 0 0 119 -2,-0.8 2,-0.4 5,-0.0 -1,-0.2 0.638 39.3 84.8-110.5 -25.0 38.6 -12.3 22.1 44 50 A D S > S- 0 0 62 1,-0.1 4,-2.1 2,-0.0 3,-0.5 -0.733 70.7-132.1 -96.8 144.3 35.4 -14.1 21.3 45 51 A L H > S+ 0 0 46 -2,-0.4 4,-3.1 1,-0.3 5,-0.1 0.791 103.5 49.1 -56.6 -43.0 34.5 -14.9 17.7 46 52 A F H > S+ 0 0 23 2,-0.2 4,-2.3 1,-0.2 -1,-0.3 0.845 110.4 51.6 -70.1 -35.2 30.9 -13.6 17.7 47 53 A E H > S+ 0 0 26 -3,-0.5 4,-1.4 2,-0.2 -2,-0.2 0.891 114.1 44.5 -67.5 -36.3 31.9 -10.3 19.3 48 54 A V H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 3,-0.3 0.945 111.6 52.7 -72.9 -42.5 34.6 -9.9 16.6 49 55 A S H X S+ 0 0 0 -4,-3.1 4,-1.9 1,-0.3 -2,-0.2 0.910 109.1 50.1 -55.3 -43.9 32.1 -11.0 13.9 50 56 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -1,-0.3 0.832 105.3 57.3 -65.0 -33.5 29.7 -8.4 15.2 51 57 A T H X S+ 0 0 10 -4,-1.4 4,-2.3 -3,-0.3 5,-0.2 0.887 107.0 49.5 -65.2 -39.6 32.5 -5.8 15.0 52 58 A Y H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 5,-0.3 0.906 110.4 49.1 -62.9 -41.5 32.9 -6.6 11.3 53 59 A L H X S+ 0 0 2 -4,-1.9 4,-2.8 2,-0.2 5,-0.2 0.946 114.2 44.9 -68.3 -43.7 29.2 -6.3 10.6 54 60 A V H X S+ 0 0 17 -4,-2.2 4,-2.3 1,-0.2 5,-0.2 0.942 117.5 43.0 -63.9 -50.4 29.0 -2.9 12.3 55 61 A A H X S+ 0 0 11 -4,-2.3 4,-1.5 2,-0.2 -1,-0.2 0.869 118.9 44.1 -63.1 -39.7 32.1 -1.4 10.7 56 62 A T H X S+ 0 0 0 -4,-2.5 4,-2.0 -5,-0.2 5,-0.4 0.924 113.0 51.4 -77.4 -36.7 31.4 -2.8 7.3 57 63 A A H X>S+ 0 0 0 -4,-2.8 4,-2.7 -5,-0.3 5,-0.6 0.944 111.4 47.6 -64.1 -47.5 27.7 -1.7 7.5 58 64 A R H X5S+ 0 0 74 -4,-2.3 4,-0.7 1,-0.2 -1,-0.2 0.839 114.3 45.1 -60.9 -38.8 28.6 1.8 8.5 59 65 A G H <5S+ 0 0 36 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.787 123.1 32.5 -85.1 -25.0 31.2 2.4 5.8 60 66 A Y H ><5S+ 0 0 18 -4,-2.0 3,-0.5 126,-0.2 -2,-0.2 0.858 120.2 46.0 -95.3 -41.6 29.3 0.9 2.9 61 67 A I H 3<5S+ 0 0 8 -4,-2.7 2,-2.0 -5,-0.4 -3,-0.2 0.957 110.2 52.5 -71.2 -48.6 25.7 1.7 3.7 62 68 A F T 3< - 0 0 51 -2,-2.0 4,-2.8 -3,-0.5 5,-0.2 -0.078 59.7 -82.5 -76.8-176.8 28.2 6.1 1.5 64 70 A D H > S+ 0 0 93 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.841 126.6 48.9 -61.9 -42.7 28.6 9.4 -0.2 65 71 A A H > S+ 0 0 10 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.866 113.9 46.4 -68.3 -39.9 25.3 9.5 -2.0 66 72 A N H > S+ 0 0 11 -5,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.944 113.2 49.0 -66.0 -48.7 23.4 8.6 1.1 67 73 A K H X S+ 0 0 71 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.848 112.1 47.5 -58.9 -39.9 25.3 11.1 3.3 68 74 A R H X S+ 0 0 18 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.812 110.0 51.3 -79.1 -32.6 24.8 14.0 0.9 69 75 A T H X S+ 0 0 1 -4,-1.4 4,-1.9 2,-0.2 -2,-0.2 0.932 112.7 47.3 -64.4 -47.4 21.1 13.4 0.4 70 76 A A H X S+ 0 0 0 -4,-2.2 4,-1.5 2,-0.2 -2,-0.2 0.921 115.3 45.0 -59.2 -46.4 20.7 13.3 4.2 71 77 A L H X S+ 0 0 25 -4,-2.3 4,-2.2 1,-0.2 3,-0.5 0.970 112.5 51.8 -63.9 -51.8 22.7 16.5 4.7 72 78 A N H X S+ 0 0 61 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.812 105.7 54.5 -53.2 -33.6 21.0 18.3 1.8 73 79 A S H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.915 109.8 47.3 -74.3 -33.4 17.5 17.5 3.2 74 80 A A H X S+ 0 0 0 -4,-1.5 4,-1.3 -3,-0.5 -2,-0.2 0.906 116.1 43.6 -65.8 -47.9 18.4 19.1 6.5 75 81 A L H X S+ 0 0 23 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.881 112.2 53.5 -66.4 -41.6 19.9 22.2 4.9 76 82 A L H X S+ 0 0 20 -4,-2.6 4,-2.6 -5,-0.2 5,-0.2 0.936 105.9 53.4 -59.5 -47.8 17.0 22.4 2.4 77 83 A F H < S+ 0 0 0 -4,-2.2 4,-0.5 -5,-0.2 -1,-0.2 0.881 111.4 45.7 -54.7 -40.6 14.4 22.4 5.2 78 84 A L H ><>S+ 0 0 0 -4,-1.3 5,-2.3 2,-0.2 3,-1.5 0.953 110.0 53.3 -71.1 -48.8 16.2 25.3 6.9 79 85 A R H ><5S+ 0 0 145 -4,-2.8 3,-2.1 1,-0.3 -2,-0.2 0.943 107.1 53.0 -42.7 -57.1 16.6 27.3 3.7 80 86 A R T 3<5S+ 0 0 96 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.646 107.0 53.5 -57.5 -18.3 12.8 26.9 3.2 81 87 A N T < 5S- 0 0 39 -3,-1.5 -1,-0.3 -4,-0.5 -2,-0.2 0.106 125.1 -98.9-109.9 22.1 12.2 28.3 6.7 82 88 A G T < 5S+ 0 0 69 -3,-2.1 2,-0.4 1,-0.2 -3,-0.2 0.587 76.5 138.6 80.6 15.4 14.2 31.4 6.1 83 89 A V < - 0 0 26 -5,-2.3 2,-0.4 -6,-0.1 -1,-0.2 -0.763 52.2-127.2 -93.7 136.0 17.5 30.3 7.8 84 90 A Q - 0 0 170 -2,-0.4 2,-0.3 32,-0.3 -5,-0.0 -0.675 31.8-172.1 -82.5 128.2 20.8 31.2 6.0 85 91 A V + 0 0 36 -2,-0.4 2,-0.3 -10,-0.0 31,-0.0 -0.853 10.7 175.6-121.2 157.7 23.0 28.2 5.5 86 92 A F - 0 0 114 -2,-0.3 2,-0.3 2,-0.0 29,-0.0 -0.962 41.0 -87.2-151.4 160.4 26.6 27.8 4.3 87 93 A D - 0 0 140 -2,-0.3 3,-0.0 2,-0.0 -2,-0.0 -0.574 45.0-179.1 -74.8 137.8 29.0 24.9 4.0 88 94 A S > - 0 0 14 -2,-0.3 3,-2.2 1,-0.0 4,-0.3 -0.995 34.9-126.1-138.5 138.5 31.0 24.2 7.1 89 95 A P T 3 S+ 0 0 125 0, 0.0 3,-0.5 0, 0.0 4,-0.5 0.632 105.2 67.9 -59.3 -22.2 33.7 21.5 7.5 90 96 A E T 3> S+ 0 0 83 1,-0.2 4,-1.3 2,-0.1 3,-0.2 0.717 83.4 76.2 -62.5 -27.3 31.9 20.1 10.6 91 97 A L H <> S+ 0 0 0 -3,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.806 84.6 58.6 -67.3 -32.5 29.0 18.9 8.5 92 98 A A H > S+ 0 0 66 -3,-0.5 4,-1.2 -4,-0.3 3,-0.3 0.938 112.9 37.7 -62.9 -50.3 30.6 15.8 6.9 93 99 A D H > S+ 0 0 126 -4,-0.5 4,-1.9 1,-0.2 -1,-0.2 0.751 110.7 63.6 -69.8 -24.4 31.4 14.0 10.2 94 100 A L H X S+ 0 0 10 -4,-1.3 4,-1.9 1,-0.2 -1,-0.2 0.894 101.4 50.3 -69.7 -35.1 28.1 15.3 11.7 95 101 A T H X S+ 0 0 3 -4,-1.5 4,-3.0 -3,-0.3 -2,-0.2 0.922 112.4 42.4 -73.1 -48.0 26.1 13.3 9.2 96 102 A V H X S+ 0 0 37 -4,-1.2 4,-2.8 2,-0.2 6,-0.3 0.942 113.6 53.9 -64.0 -49.5 27.7 9.9 9.6 97 103 A G H X>S+ 0 0 8 -4,-1.9 5,-1.7 2,-0.2 6,-1.5 0.902 115.0 40.7 -42.8 -48.5 27.8 10.3 13.3 98 104 A A H <5S+ 0 0 1 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.905 112.8 53.1 -77.2 -41.9 24.0 11.0 13.3 99 105 A A H <5S+ 0 0 2 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.881 114.9 43.0 -53.1 -42.8 23.2 8.3 10.7 100 106 A T H <5S- 0 0 12 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.702 114.1-111.2 -85.9 -22.1 25.0 5.7 12.9 101 107 A G T <5S+ 0 0 42 -4,-1.4 -3,-0.2 2,-0.3 -4,-0.1 0.503 86.7 113.2 106.3 5.5 23.7 6.8 16.3 102 108 A E S > - 0 0 64 -2,-0.6 4,-1.8 1,-0.1 3,-0.5 -0.272 24.8-106.9 -71.6 159.7 22.1 12.0 19.2 105 111 A V H 3> S+ 0 0 56 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.853 119.5 56.0 -54.8 -38.5 19.5 14.0 17.4 106 112 A S H 3> S+ 0 0 64 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.860 105.2 50.7 -64.8 -37.7 19.7 16.7 20.1 107 113 A S H <> S+ 0 0 54 -3,-0.5 4,-2.6 2,-0.2 -1,-0.2 0.891 110.1 50.1 -67.9 -38.7 23.5 17.2 19.6 108 114 A V H X S+ 0 0 0 -4,-1.8 4,-2.8 2,-0.2 5,-0.2 0.941 110.7 49.7 -60.4 -48.6 23.0 17.6 15.8 109 115 A A H X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.915 111.0 49.8 -58.2 -40.8 20.3 20.2 16.4 110 116 A D H X S+ 0 0 77 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.933 111.0 49.0 -68.2 -41.2 22.6 22.0 18.8 111 117 A T H X S+ 0 0 17 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.928 113.3 46.9 -60.1 -45.4 25.5 21.9 16.3 112 118 A L H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 5,-0.5 0.905 112.0 51.0 -63.7 -41.2 23.2 23.2 13.5 113 119 A R H X S+ 0 0 96 -4,-2.9 4,-1.3 -5,-0.2 -1,-0.2 0.856 108.2 53.0 -60.8 -38.5 21.8 26.0 15.9 114 120 A R H < S+ 0 0 141 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.948 115.4 39.2 -65.1 -46.3 25.4 27.1 16.8 115 121 A L H < S+ 0 0 38 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.882 133.1 16.1 -67.2 -47.6 26.4 27.5 13.1 116 122 A Y H < S+ 0 0 20 -4,-2.3 -32,-0.3 -5,-0.2 -3,-0.2 0.571 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8.8 209 95 B P T > S+ 0 0 114 0, 0.0 3,-0.6 0, 0.0 4,-0.5 0.790 105.1 65.0 -71.2 -28.1 15.5 -14.7 9.0 210 96 B E T 3> S+ 0 0 89 1,-0.2 4,-0.9 2,-0.1 3,-0.3 0.742 84.9 77.1 -62.3 -26.5 17.0 -12.6 11.7 211 97 B L H <> S+ 0 0 2 -3,-0.9 4,-1.4 1,-0.2 -1,-0.2 0.754 83.9 55.2 -68.4 -30.7 19.9 -11.5 9.7 212 98 B A H <> S+ 0 0 46 -3,-0.6 4,-1.3 -4,-0.3 -1,-0.2 0.916 112.5 43.1 -67.6 -43.7 18.4 -8.7 7.4 213 99 B D H > S+ 0 0 130 -4,-0.5 4,-1.8 -3,-0.3 -1,-0.2 0.716 108.0 64.6 -73.6 -19.4 17.1 -6.7 10.3 214 100 B L H X S+ 0 0 8 -4,-0.9 4,-1.8 2,-0.2 -1,-0.2 0.903 100.9 47.8 -68.8 -42.4 20.3 -7.3 12.1 215 101 B T H X S+ 0 0 1 -4,-1.4 4,-2.9 2,-0.2 -2,-0.2 0.934 114.3 43.0 -67.0 -50.9 22.4 -5.4 9.5 216 102 B V H X S+ 0 0 40 -4,-1.3 4,-2.4 1,-0.2 6,-0.2 0.943 116.3 48.7 -60.6 -54.4 20.3 -2.3 9.3 217 103 B G H <>S+ 0 0 7 -4,-1.8 6,-2.7 1,-0.2 5,-0.6 0.812 112.5 50.0 -57.0 -32.7 19.8 -2.2 13.1 218 104 B A H ><5S+ 0 0 0 -4,-1.8 3,-0.8 4,-0.2 -2,-0.2 0.924 111.3 48.1 -69.1 -45.7 23.6 -2.7 13.4 219 105 B A H 3<5S+ 0 0 0 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.854 114.1 46.0 -60.3 -37.8 24.3 0.2 11.0 220 106 B T T 3<5S- 0 0 8 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.440 107.3-119.4 -91.6 -3.0 21.9 2.6 12.7 221 107 B G T < 5S+ 0 0 37 -3,-0.8 -3,-0.1 -4,-0.5 -4,-0.1 0.460 85.5 114.5 77.8 1.0 23.0 1.9 16.3 222 108 B E S - 0 0 60 -2,-0.6 4,-2.7 1,-0.1 3,-0.4 -0.369 21.0-110.7 -71.2 153.4 24.2 -2.7 19.9 225 111 B V H > S+ 0 0 47 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.898 119.0 51.7 -40.2 -56.3 27.4 -4.7 19.0 226 112 B S H > S+ 0 0 80 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.803 109.4 48.6 -60.4 -36.4 26.8 -7.0 22.0 227 113 B S H > S+ 0 0 58 -3,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.882 111.2 51.0 -69.4 -39.4 23.3 -7.7 21.0 228 114 B V H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 3,-0.3 0.953 111.5 47.3 -58.2 -48.2 24.5 -8.4 17.4 229 115 B A H X S+ 0 0 2 -4,-3.0 4,-3.1 1,-0.2 -1,-0.2 0.869 109.9 54.9 -60.3 -36.0 27.1 -10.8 18.9 230 116 B D H X S+ 0 0 93 -4,-1.6 4,-1.8 1,-0.2 -1,-0.2 0.845 106.9 48.8 -69.8 -37.0 24.4 -12.4 21.0 231 117 B T H X S+ 0 0 44 -4,-1.9 4,-1.9 -3,-0.3 -1,-0.2 0.871 114.8 44.8 -71.4 -36.7 22.2 -13.1 18.1 232 118 B L H X>S+ 0 0 3 -4,-2.0 4,-2.7 2,-0.2 5,-0.6 0.920 111.5 52.1 -73.0 -43.3 25.1 -14.7 16.1 233 119 B R H X5S+ 0 0 92 -4,-3.1 4,-1.9 3,-0.2 -2,-0.2 0.903 112.0 48.0 -55.1 -41.4 26.3 -16.7 19.1 234 120 B R H <5S+ 0 0 87 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.895 117.2 40.4 -71.2 -41.1 22.7 -18.1 19.6 235 121 B L H <5S+ 0 0 38 -4,-1.9 -2,-0.2 -5,-0.1 -1,-0.2 0.856 133.7 17.0 -69.0 -39.9 22.2 -19.0 16.0 236 122 B Y H <5S+ 0 0 21 -4,-2.7 -32,-0.3 -5,-0.2 -3,-0.2 0.713 99.2 97.1-115.3 -23.8 25.7 -20.5 15.3 237 123 B G << 0 0 28 -4,-1.9 -34,-0.0 -5,-0.6 -4,-0.0 -0.156 360.0 360.0 -74.9 164.4 27.5 -21.2 18.5 238 124 B S 0 0 160 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.862 360.0 360.0 -78.4 360.0 27.8 -24.5 20.4 239 !* 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 0.0 240 1 C M 0 0 100 0, 0.0 2,-0.5 0, 0.0 80,-0.1 0.000 360.0 360.0 360.0 115.1 -18.5 24.8 -16.9 241 2 C R - 0 0 148 75,-0.2 2,-0.2 78,-0.1 78,-0.1 -0.747 360.0-149.6 -87.3 128.2 -18.3 24.0 -20.5 242 3 C H - 0 0 42 -2,-0.5 2,-0.2 1,-0.1 147,-0.0 -0.529 21.8-100.0 -93.6 161.4 -17.4 20.4 -21.3 243 4 C I - 0 0 3 -2,-0.2 -1,-0.1 146,-0.1 69,-0.0 -0.536 37.5-126.7 -73.9 142.2 -15.5 19.0 -24.3 244 5 C S > - 0 0 37 -2,-0.2 4,-2.0 1,-0.1 3,-0.5 -0.633 17.1-118.4 -88.6 152.6 -17.6 17.4 -27.0 245 6 C P H > S+ 0 0 51 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.882 116.7 58.9 -49.4 -35.5 -17.0 13.9 -28.3 246 7 C E H > S+ 0 0 89 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.859 104.5 47.4 -69.3 -39.1 -16.4 15.6 -31.7 247 8 C E H > S+ 0 0 39 -3,-0.5 4,-2.5 2,-0.2 -1,-0.2 0.902 111.4 52.2 -66.1 -40.6 -13.6 17.7 -30.3 248 9 C L H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.925 109.3 48.2 -63.3 -45.1 -12.0 14.6 -28.6 249 10 C I H X S+ 0 0 38 -4,-2.7 4,-2.7 2,-0.2 5,-0.2 0.910 110.7 52.1 -62.9 -42.1 -12.1 12.6 -31.8 250 11 C A H X S+ 0 0 59 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.932 110.2 47.6 -61.0 -47.5 -10.5 15.5 -33.8 251 12 C L H X S+ 0 0 35 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.913 112.4 50.8 -57.2 -42.2 -7.7 15.8 -31.2 252 13 C H H X S+ 0 0 7 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.945 111.0 46.5 -65.8 -45.0 -7.1 12.0 -31.4 253 14 C D H X S+ 0 0 73 -4,-2.7 4,-3.1 2,-0.2 5,-0.3 0.880 109.1 55.2 -60.8 -43.8 -6.9 11.9 -35.2 254 15 C A H X S+ 0 0 53 -4,-2.2 4,-3.0 1,-0.2 -1,-0.2 0.939 111.2 44.2 -55.9 -47.7 -4.5 14.8 -35.4 255 16 C N H X S+ 0 0 4 -4,-2.0 4,-1.1 -5,-0.2 -1,-0.2 0.780 113.0 52.0 -71.1 -24.2 -2.1 13.1 -33.0 256 17 C I H < S+ 0 0 74 -4,-1.5 3,-0.3 2,-0.2 -2,-0.2 0.949 114.1 42.7 -72.0 -51.2 -2.6 9.8 -34.9 257 18 C S H < S+ 0 0 103 -4,-3.1 -2,-0.2 1,-0.2 -3,-0.2 0.946 112.7 54.8 -53.9 -51.7 -1.8 11.5 -38.3 258 19 C R H < S+ 0 0 151 -4,-3.0 -1,-0.2 -5,-0.3 -2,-0.2 0.796 116.8 29.5 -57.9 -32.0 1.1 13.4 -36.7 259 20 C Y < 0 0 97 -4,-1.1 -3,-0.0 -3,-0.3 -4,-0.0 -0.169 360.0 360.0-112.0-156.3 2.8 10.4 -35.3 260 21 C G 0 0 125 -2,-0.1 44,-0.2 -5,-0.0 43,-0.2 -0.862 360.0 360.0-163.2 360.0 3.3 6.7 -36.1 261 ! 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 0.0 262 29 C P 0 0 166 0, 0.0 107,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-112.7 16.0 2.7 -28.7 263 30 C G > + 0 0 32 2,-0.1 4,-1.4 3,-0.0 5,-0.1 -0.096 360.0 98.1-152.2 22.6 17.2 2.5 -25.2 264 31 C R H > S+ 0 0 46 2,-0.2 4,-2.2 1,-0.1 5,-0.2 0.881 84.2 57.0 -76.1 -36.5 13.8 2.6 -23.6 265 32 C A H > S+ 0 0 4 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.895 101.8 55.4 -58.4 -42.4 14.3 -1.1 -23.5 266 33 C E H > S+ 0 0 131 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.964 110.6 43.0 -52.2 -54.8 17.4 -0.5 -21.5 267 34 C A H X S+ 0 0 53 -4,-1.4 4,-1.6 2,-0.2 -1,-0.2 0.763 113.6 52.9 -68.0 -30.1 15.7 1.5 -18.9 268 35 C I H X S+ 0 0 8 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.966 113.4 41.2 -67.2 -54.6 12.7 -0.8 -18.7 269 36 C I H X S+ 0 0 3 -4,-2.8 4,-3.0 1,-0.2 6,-0.3 0.903 112.5 56.0 -59.9 -41.6 14.9 -3.9 -18.2 270 37 C G H <>S+ 0 0 45 -4,-2.8 5,-0.7 -5,-0.3 -1,-0.2 0.925 107.5 49.3 -55.6 -47.3 17.1 -2.0 -15.7 271 38 C R H <5S+ 0 0 163 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.845 119.2 37.8 -58.3 -40.4 14.0 -1.1 -13.7 272 39 C V H X5S+ 0 0 7 -4,-1.7 4,-1.3 3,-0.2 -2,-0.2 0.971 101.9 75.4 -77.5 -59.1 12.8 -4.8 -13.6 273 40 C Q T <5S- 0 0 85 -4,-3.0 2,-4.5 1,-0.2 -134,-0.0 -0.374 131.2 -30.8 -56.4 125.4 16.2 -6.6 -13.3 274 41 C A T 45S+ 0 0 24 1,-0.2 -1,-0.2 3,-0.1 3,-0.2 0.203 118.0 100.8 49.4 -24.3 17.4 -6.2 -9.7 275 42 C R T 4> - 0 0 61 1,-0.2 4,-2.2 2,-0.0 3,-1.0 -0.724 67.9-149.5 -85.4 111.0 8.6 -16.5 -7.6 284 51 C L H 3> S+ 0 0 42 -2,-0.8 4,-3.0 1,-0.3 5,-0.2 0.793 95.9 54.7 -51.9 -38.6 8.5 -16.6 -11.4 285 52 C F H 3> S+ 0 0 21 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.890 107.3 48.7 -66.2 -37.5 4.9 -15.3 -11.5 286 53 C E H <> S+ 0 0 31 -3,-1.0 4,-1.5 2,-0.2 -2,-0.2 0.902 114.6 48.4 -68.1 -36.6 5.8 -12.2 -9.3 287 54 C V H >X S+ 0 0 4 -4,-2.2 4,-2.1 2,-0.2 3,-0.9 0.987 110.3 48.0 -61.6 -61.3 8.8 -11.6 -11.7 288 55 C S H 3X S+ 0 0 0 -4,-3.0 4,-2.0 1,-0.3 -1,-0.2 0.861 111.1 53.8 -47.2 -41.3 6.7 -12.0 -14.9 289 56 C A H 3X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -1,-0.3 0.835 104.8 54.1 -61.9 -37.6 4.2 -9.6 -13.3 290 57 C T H S+ 0 0 0 -4,-2.2 4,-2.3 -5,-0.4 5,-0.5 0.971 114.4 42.1 -58.4 -52.5 3.2 -1.7 -20.1 297 64 C R H <5S+ 0 0 86 -4,-2.7 4,-0.3 1,-0.2 -1,-0.2 0.811 116.1 51.7 -62.8 -32.6 4.0 1.6 -18.4 298 65 C G H <5S+ 0 0 44 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.818 126.2 16.5 -73.1 -31.9 7.0 2.0 -20.6 299 66 C Y H <5S+ 0 0 25 -4,-2.2 -3,-0.2 -3,-0.3 -2,-0.2 0.807 107.6 68.7-113.9 -42.2 5.3 1.4 -23.9 300 67 C I T <5S+ 0 0 6 -4,-2.3 2,-2.7 -5,-0.4 121,-0.2 0.891 87.0 68.4 -61.0 -42.1 1.5 1.7 -23.8 301 68 C F S - 0 0 46 -2,-2.7 4,-2.7 1,-0.1 5,-0.2 0.053 40.7 -92.9 -69.8 177.6 2.6 6.3 -26.6 303 70 C D H > S+ 0 0 91 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.859 124.6 46.8 -69.5 -37.8 3.3 9.8 -28.0 304 71 C A H > S+ 0 0 4 -44,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.881 113.9 50.3 -67.9 -38.7 -0.1 10.3 -29.6 305 72 C N H > S+ 0 0 7 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.974 112.1 47.3 -59.5 -55.8 -1.8 9.0 -26.5 306 73 C K H X S+ 0 0 43 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.894 114.8 45.9 -48.4 -50.0 0.2 11.4 -24.3 307 74 C R H X S+ 0 0 20 -4,-2.0 4,-2.9 1,-0.2 -1,-0.2 0.832 112.0 49.6 -72.9 -36.5 -0.5 14.4 -26.5 308 75 C T H X S+ 0 0 1 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.862 113.2 48.4 -65.3 -38.2 -4.2 13.8 -26.9 309 76 C A H X S+ 0 0 0 -4,-2.1 4,-1.5 2,-0.2 -2,-0.2 0.912 114.9 43.7 -72.0 -45.2 -4.5 13.4 -23.1 310 77 C L H X S+ 0 0 24 -4,-2.6 4,-1.8 -5,-0.2 5,-0.2 0.956 114.0 51.7 -63.2 -49.3 -2.6 16.6 -22.5 311 78 C N H X S+ 0 0 61 -4,-2.9 4,-2.9 1,-0.2 5,-0.2 0.854 105.7 54.2 -57.7 -33.6 -4.5 18.4 -25.2 312 79 C S H X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.933 109.6 47.9 -72.4 -36.3 -7.9 17.4 -23.9 313 80 C A H X S+ 0 0 0 -4,-1.5 4,-1.3 2,-0.2 -1,-0.2 0.838 115.4 44.5 -61.6 -42.7 -7.1 18.8 -20.4 314 81 C L H X S+ 0 0 20 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.893 111.2 53.6 -74.9 -42.9 -5.8 22.1 -21.9 315 82 C L H X S+ 0 0 17 -4,-2.9 4,-2.9 2,-0.2 5,-0.2 0.936 105.2 53.9 -55.0 -48.7 -8.7 22.4 -24.3 316 83 C F H X S+ 0 0 0 -4,-2.2 4,-0.7 -5,-0.2 -1,-0.2 0.923 112.4 44.9 -54.1 -42.7 -11.2 22.0 -21.4 317 84 C L H <>S+ 0 0 0 -4,-1.3 5,-2.5 2,-0.2 3,-0.4 0.867 111.8 51.3 -69.5 -40.0 -9.4 24.9 -19.7 318 85 C R H ><5S+ 0 0 155 -4,-2.7 3,-1.8 1,-0.2 -2,-0.2 0.924 107.2 54.1 -61.5 -42.9 -9.2 27.1 -22.8 319 86 C R H 3<5S+ 0 0 102 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.732 109.7 48.9 -62.8 -23.0 -12.9 26.6 -23.3 320 87 C N T 3<5S- 0 0 41 -4,-0.7 -1,-0.3 -3,-0.4 -2,-0.2 0.112 126.2 -94.8-108.6 17.4 -13.5 27.8 -19.8 321 88 C G T < 5S+ 0 0 70 -3,-1.8 2,-0.4 1,-0.3 -3,-0.2 0.496 76.8 133.8 93.2 7.7 -11.4 31.0 -20.1 322 89 C V < - 0 0 23 -5,-2.5 2,-0.4 -8,-0.1 -1,-0.3 -0.748 54.0-127.4 -90.0 133.0 -8.0 30.0 -18.7 323 90 C Q - 0 0 169 -2,-0.4 2,-0.3 32,-0.3 -5,-0.0 -0.664 31.9-170.7 -73.9 130.8 -4.9 31.0 -20.6 324 91 C V + 0 0 35 -2,-0.4 2,-0.3 -10,-0.0 31,-0.0 -0.862 8.8 177.3-120.1 157.7 -2.7 27.9 -21.2 325 92 C F - 0 0 114 -2,-0.3 2,-0.2 2,-0.0 29,-0.0 -0.973 39.2 -85.4-151.9 161.2 0.9 27.6 -22.5 326 93 C D + 0 0 144 -2,-0.3 3,-0.0 3,-0.0 0, 0.0 -0.481 46.5 178.0 -69.3 138.3 3.4 24.9 -23.1 327 94 C S > - 0 0 15 -2,-0.2 3,-1.1 1,-0.1 4,-0.3 -0.990 36.0-128.1-139.5 146.5 5.5 24.1 -20.1 328 95 C P T >> S+ 0 0 116 0, 0.0 3,-0.8 0, 0.0 4,-0.5 0.766 104.9 66.0 -66.5 -26.9 8.2 21.4 -19.8 329 96 C E H >> S+ 0 0 83 1,-0.2 4,-1.8 2,-0.1 3,-0.6 0.825 85.9 74.5 -55.8 -34.6 6.6 19.9 -16.6 330 97 C L H <> S+ 0 0 1 -3,-1.1 4,-1.8 1,-0.2 -1,-0.2 0.751 86.3 58.3 -60.0 -32.7 3.6 18.8 -18.7 331 98 C A H <> S+ 0 0 48 -3,-0.8 4,-1.2 -4,-0.3 -1,-0.2 0.904 111.8 39.0 -66.7 -44.2 5.2 15.8 -20.5 332 99 C D H S+ 0 0 10 -4,-1.9 5,-1.7 1,-0.2 6,-1.6 0.883 113.7 46.5 -62.1 -40.3 2.8 9.7 -14.3 337 104 C A H ><5S+ 0 0 1 -4,-1.9 3,-0.7 -5,-0.2 -1,-0.2 0.916 109.1 54.7 -66.8 -44.5 -0.9 10.5 -14.1 338 105 C A H 3<5S+ 0 0 0 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.883 112.8 42.2 -56.5 -40.5 -1.8 7.9 -16.7 339 106 C T H 3<5S- 0 0 7 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.566 115.2-114.6 -86.7 -11.8 0.0 5.1 -14.8 340 107 C G T <<5S+ 0 0 40 -3,-0.7 -3,-0.2 -4,-0.7 -4,-0.1 0.519 83.8 120.3 88.5 7.3 -1.3 6.3 -11.5 341 108 C E S - 0 0 70 -2,-0.5 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4,-2.8 0, 0.0 5,-0.2 0.824 117.4 53.7 -42.8 -44.2 28.0 -36.0 -41.3 487 7 E E H > S+ 0 0 136 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.876 108.1 48.7 -66.4 -40.1 31.3 -34.0 -41.1 488 8 E E H > S+ 0 0 53 -3,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.868 112.9 49.4 -66.0 -38.1 29.8 -31.4 -38.7 489 9 E L H X S+ 0 0 0 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.942 112.6 43.9 -68.9 -48.6 28.3 -34.3 -36.6 490 10 E I H X S+ 0 0 72 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.901 114.4 54.9 -63.3 -34.5 31.6 -36.2 -36.3 491 11 E A H < S+ 0 0 51 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.899 108.0 44.6 -64.6 -45.4 33.3 -32.9 -35.7 492 12 E L H < S+ 0 0 27 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.754 109.4 59.4 -74.2 -21.8 31.1 -31.8 -32.7 493 13 E H H < S+ 0 0 52 -4,-1.6 2,-1.6 1,-0.2 -2,-0.2 0.986 98.1 58.2 -65.7 -60.3 31.5 -35.3 -31.3 494 14 E D < 0 0 106 -4,-2.3 -1,-0.2 -5,-0.1 -4,-0.0 -0.612 360.0 360.0 -70.4 93.4 35.3 -35.0 -31.1 495 15 E A 0 0 118 -2,-1.6 0, 0.0 -3,-0.1 0, 0.0 -0.535 360.0 360.0 155.1 360.0 35.1 -31.9 -28.8 496 ! 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 0.0 497 30 E G 0 0 79 0, 0.0 2,-0.3 0, 0.0 245,-0.0 0.000 360.0 360.0 360.0 148.1 29.9 -43.7 -10.3 498 31 E R - 0 0 166 2,-0.0 2,-0.1 104,-0.0 4,-0.0 -0.974 360.0-167.1-143.8 148.7 27.8 -46.8 -9.9 499 32 E A S S+ 0 0 0 -2,-0.3 102,-0.2 99,-0.1 103,-0.1 -0.718 76.9 96.3-116.3 72.2 25.6 -49.6 -11.1 500 33 E E S > S+ 0 0 46 2,-0.1 4,-2.2 3,-0.1 -1,-0.1 0.374 83.0 56.3-118.5 -25.4 24.5 -50.5 -7.6 501 34 E A H > S+ 0 0 73 2,-0.2 4,-4.1 3,-0.2 5,-0.2 0.812 102.0 55.0 -68.4 -35.6 21.5 -48.4 -8.3 502 35 E I H > S+ 0 0 10 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.968 110.6 44.4 -66.4 -46.6 20.7 -50.5 -11.4 503 36 E I H > S+ 0 0 8 2,-0.2 4,-3.3 1,-0.2 5,-0.3 0.951 115.6 49.9 -56.3 -49.9 20.7 -53.7 -9.3 504 37 E G H X S+ 0 0 36 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.946 110.5 48.9 -46.3 -58.1 18.7 -51.7 -6.7 505 38 E R H X S+ 0 0 59 -4,-4.1 4,-0.9 1,-0.2 -2,-0.2 0.865 114.8 45.2 -57.4 -39.5 16.2 -50.5 -9.4 506 39 E V H >X S+ 0 0 0 -4,-2.9 4,-2.0 2,-0.2 3,-0.9 0.959 111.8 50.0 -69.0 -50.4 15.8 -54.1 -10.8 507 40 E Q H 3X S+ 0 0 95 -4,-3.3 4,-1.2 1,-0.3 -2,-0.2 0.869 110.9 51.1 -57.4 -37.2 15.4 -55.8 -7.4 508 41 E A H 3X S+ 0 0 56 -4,-2.3 4,-2.3 -5,-0.3 -1,-0.3 0.725 107.2 52.9 -74.6 -24.6 12.8 -53.2 -6.4 509 42 E R H S+ 0 0 20 -4,-2.0 5,-1.7 2,-0.2 4,-0.3 0.740 115.5 50.4 -75.2 -21.7 10.6 -57.6 -9.1 511 44 E A H <5S+ 0 0 57 -4,-1.2 3,-0.3 -5,-0.3 -2,-0.2 0.939 115.9 40.7 -73.8 -52.7 9.6 -56.8 -5.5 512 45 E Y H <5S+ 0 0 218 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.933 122.7 37.0 -59.2 -55.3 6.9 -54.3 -6.6 513 46 E E T <5S- 0 0 158 -4,-2.9 -1,-0.2 -5,-0.1 -3,-0.2 0.450 105.4-123.2 -87.2 1.0 5.4 -56.2 -9.5 514 47 E E T 5 - 0 0 60 -4,-0.3 2,-0.5 -3,-0.3 -3,-0.2 0.967 41.1-171.4 58.7 58.9 5.8 -59.6 -7.8 515 48 E I < + 0 0 30 -5,-1.7 -1,-0.2 1,-0.2 -2,-0.0 -0.741 29.1 156.2 -95.4 122.3 7.9 -61.1 -10.6 516 49 E T + 0 0 126 -2,-0.5 2,-0.4 5,-0.0 -1,-0.2 0.611 44.8 103.3-108.0 -24.6 8.8 -64.8 -10.6 517 50 E D >> - 0 0 39 1,-0.2 4,-2.0 2,-0.1 3,-0.6 -0.541 62.0-149.8 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47.9 -64.2 -47.0 16.6 -52.4 -19.9 528 61 E A H X S+ 0 0 22 -4,-2.6 4,-0.9 1,-0.2 -1,-0.2 0.833 109.8 53.0 -70.9 -30.5 17.8 -51.2 -16.5 529 62 E T H X S+ 0 0 1 -4,-2.6 4,-1.2 -5,-0.2 3,-0.3 0.927 111.3 44.9 -69.7 -44.6 21.5 -51.8 -17.4 530 63 E A H < S+ 0 0 0 -4,-1.7 3,-0.3 -5,-0.3 -2,-0.2 0.871 119.8 41.0 -67.2 -29.3 21.3 -49.8 -20.6 531 64 E R H < S+ 0 0 83 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.613 111.9 67.7 -85.5 -21.0 19.4 -46.9 -19.0 532 65 E G H < S+ 0 0 32 -4,-0.9 -1,-0.3 -3,-0.3 -2,-0.3 0.350 89.1 47.9 122.1-103.0 21.4 -47.5 -16.7 533 66 E Y S < S+ 0 0 43 -4,-1.2 2,-0.6 -3,-0.3 -2,-0.1 -0.334 72.6 138.7-101.0 48.2 24.9 -46.6 -17.9 534 67 E I - 0 0 35 -2,-0.2 2,-0.3 117,-0.1 117,-0.1 -0.866 32.9-173.8 -90.3 120.5 23.7 -43.2 -19.2 535 68 E F - 0 0 24 -2,-0.6 2,-1.9 115,-0.1 5,-0.4 -0.815 39.1-112.5-118.1 151.6 26.4 -40.7 -18.3 536 69 E N S S+ 0 0 86 209,-0.4 211,-0.2 -2,-0.3 2,-0.2 -0.575 81.0 115.0 -77.4 73.4 26.8 -36.9 -18.5 537 70 E D S > S- 0 0 46 -2,-1.9 4,-2.2 208,-0.1 5,-0.2 -0.441 83.7 -62.1-126.1-164.3 29.6 -37.4 -21.1 538 71 E A H > S+ 0 0 52 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.908 125.3 54.4 -53.0 -51.2 30.5 -36.8 -24.8 539 72 E N H > S+ 0 0 27 1,-0.2 4,-1.9 2,-0.2 111,-0.2 0.891 111.6 43.1 -57.5 -45.8 27.7 -39.0 -26.2 540 73 E K H > S+ 0 0 15 -5,-0.4 4,-1.9 1,-0.2 -1,-0.2 0.950 113.7 51.1 -65.3 -50.6 24.9 -37.3 -24.3 541 74 E R H X S+ 0 0 44 -4,-2.2 4,-3.2 1,-0.2 -2,-0.2 0.840 108.5 54.1 -56.3 -36.4 26.3 -33.8 -25.0 542 75 E T H X S+ 0 0 3 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.912 105.5 52.0 -63.0 -47.4 26.5 -34.7 -28.8 543 76 E A H X S+ 0 0 0 -4,-1.9 4,-1.0 -5,-0.2 -2,-0.2 0.947 116.1 41.2 -53.9 -46.8 22.9 -35.7 -28.9 544 77 E L H >X S+ 0 0 20 -4,-1.9 4,-1.5 1,-0.2 3,-0.8 0.953 113.8 50.9 -72.4 -49.0 21.9 -32.4 -27.4 545 78 E N H 3X S+ 0 0 73 -4,-3.2 4,-3.0 1,-0.2 5,-0.3 0.822 102.6 60.5 -54.6 -35.8 24.3 -30.3 -29.4 546 79 E S H 3X S+ 0 0 0 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.878 107.4 45.9 -65.2 -31.8 23.2 -31.7 -32.7 547 80 E A H <>S+ 0 0 0 -4,-1.6 5,-2.2 1,-0.2 3,-1.3 0.940 111.6 50.2 -54.5 -53.4 18.4 -24.7 -34.7 552 85 E R H ><5S+ 0 0 150 -4,-2.8 3,-1.7 1,-0.3 -1,-0.2 0.844 105.9 56.9 -49.9 -41.2 21.4 -22.2 -34.8 553 86 E R H 3<5S+ 0 0 121 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.716 107.1 49.6 -70.1 -19.2 21.9 -23.1 -38.5 554 87 E N T <<5S- 0 0 38 -3,-1.3 -1,-0.3 -4,-0.9 -2,-0.2 -0.040 126.3-100.3-108.5 26.3 18.4 -22.1 -39.1 555 88 E G T < 5S+ 0 0 69 -3,-1.7 2,-0.4 1,-0.2 -3,-0.2 0.534 72.3 144.9 74.5 11.7 18.7 -18.7 -37.3 556 89 E V < - 0 0 26 -5,-2.2 2,-0.3 -6,-0.2 -1,-0.2 -0.687 51.9-123.9 -82.8 130.6 17.1 -19.6 -34.0 557 90 E Q - 0 0 165 -2,-0.4 2,-0.3 32,-0.3 -1,-0.0 -0.600 36.0-171.3 -69.8 128.8 18.6 -18.0 -30.9 558 91 E V + 0 0 43 -2,-0.3 2,-0.3 -6,-0.0 31,-0.0 -0.849 11.3 174.8-121.2 156.5 19.6 -20.8 -28.6 559 92 E F - 0 0 23 -2,-0.3 2,-0.2 2,-0.0 29,-0.0 -0.963 40.1 -89.0-154.3 157.5 20.8 -20.8 -25.0 560 93 E D - 0 0 141 -2,-0.3 3,-0.0 3,-0.0 -2,-0.0 -0.467 45.1-171.5 -67.6 137.6 21.6 -23.3 -22.3 561 94 E S > - 0 0 6 -2,-0.2 3,-1.5 1,-0.1 4,-0.3 -0.987 32.9-128.1-132.9 143.7 18.6 -24.3 -20.1 562 95 E P T > S+ 0 0 127 0, 0.0 3,-0.8 0, 0.0 4,-0.4 0.839 107.8 62.6 -55.3 -32.2 18.4 -26.4 -17.0 563 96 E E T 3> S+ 0 0 63 1,-0.2 4,-1.2 2,-0.1 3,-0.0 0.619 83.8 79.4 -68.6 -15.9 15.7 -28.5 -18.6 564 97 E L H <> S+ 0 0 3 -3,-1.5 4,-1.8 1,-0.2 -1,-0.2 0.795 83.7 58.3 -69.1 -31.1 18.0 -29.8 -21.4 565 98 E A H <> S+ 0 0 46 -3,-0.8 4,-1.3 -4,-0.3 -1,-0.2 0.949 110.4 40.7 -66.5 -50.9 19.8 -32.5 -19.5 566 99 E D H > S+ 0 0 73 -4,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.743 110.1 63.0 -69.6 -26.8 16.7 -34.5 -18.5 567 100 E L H X S+ 0 0 10 -4,-1.2 4,-2.4 2,-0.2 -1,-0.2 0.921 101.2 49.0 -61.8 -49.2 15.3 -33.9 -22.0 568 101 E T H X S+ 0 0 0 -4,-1.8 4,-2.9 2,-0.2 -2,-0.2 0.925 112.9 46.3 -61.3 -48.2 18.1 -35.8 -23.8 569 102 E V H X S+ 0 0 41 -4,-1.3 4,-2.1 1,-0.2 6,-0.2 0.938 113.8 48.5 -61.2 -48.6 17.9 -38.9 -21.6 570 103 E G H <>S+ 0 0 7 -4,-2.0 6,-2.1 1,-0.2 5,-0.7 0.863 113.0 48.4 -62.1 -37.5 14.1 -39.0 -21.8 571 104 E A H ><5S+ 0 0 1 -4,-2.4 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-2,-0.2 0.880 116.1 42.6 -63.9 -37.1 39.8 -41.0 -12.5 739 39 G V H X S+ 0 0 0 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.942 112.9 50.4 -68.5 -52.4 39.6 -37.3 -11.5 740 40 G Q H X S+ 0 0 55 -4,-3.8 4,-1.1 1,-0.2 -2,-0.2 0.790 109.5 53.8 -62.9 -28.9 38.6 -36.0 -14.9 741 41 G A H X S+ 0 0 38 -4,-2.0 4,-3.8 -5,-0.2 5,-0.2 0.931 107.6 48.0 -64.5 -51.6 35.8 -38.6 -15.1 742 42 G R H X S+ 0 0 24 -4,-1.4 4,-2.1 1,-0.2 6,-0.5 0.894 110.8 50.6 -62.9 -41.8 34.2 -37.6 -11.7 743 43 G V H < S+ 0 0 18 -4,-2.1 5,-0.4 2,-0.2 4,-0.4 0.850 119.8 37.6 -63.0 -35.5 34.2 -33.8 -12.5 744 44 G A H < S+ 0 0 34 -4,-1.1 3,-0.4 -5,-0.2 -2,-0.2 0.908 120.2 45.7 -80.2 -45.8 32.5 -34.6 -15.9 745 45 G Y H < S+ 0 0 123 -4,-3.8 -209,-0.4 1,-0.2 -2,-0.2 0.722 120.0 38.3 -69.3 -25.3 30.3 -37.4 -14.6 746 46 G E S < S- 0 0 130 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.363 102.1-119.9-115.9 2.2 29.1 -35.6 -11.5 747 47 G E + 0 0 54 -3,-0.4 -3,-0.1 -4,-0.4 2,-0.1 0.696 47.1 176.0 68.7 20.4 28.7 -32.0 -12.8 748 48 G I + 0 0 37 -6,-0.5 -1,-0.2 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109.3 47.0 -71.1 -42.8 49.7 -58.9 9.2 780 80 G A H X S+ 0 0 0 -4,-1.6 4,-1.4 2,-0.2 -1,-0.2 0.880 116.5 44.4 -57.5 -43.5 46.2 -60.3 8.3 781 81 G L H X S+ 0 0 22 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.815 111.3 54.3 -74.9 -33.1 47.8 -63.6 7.0 782 82 G L H X S+ 0 0 16 -4,-2.1 4,-2.4 -5,-0.3 -2,-0.2 0.899 105.0 53.2 -67.4 -44.4 50.1 -63.8 9.9 783 83 G F H X S+ 0 0 0 -4,-2.2 4,-0.9 1,-0.2 -2,-0.2 0.915 109.3 49.5 -56.6 -44.4 47.2 -63.6 12.4 784 84 G L H <>S+ 0 0 0 -4,-1.4 5,-2.3 2,-0.2 3,-0.5 0.911 110.4 49.3 -63.4 -44.0 45.4 -66.5 10.6 785 85 G R H ><5S+ 0 0 145 -4,-1.8 3,-2.1 1,-0.2 -1,-0.2 0.931 105.1 57.3 -61.4 -45.9 48.5 -68.8 10.6 786 86 G R H 3<5S+ 0 0 103 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.830 109.7 48.8 -54.2 -25.5 49.0 -68.1 14.3 787 87 G N T 3<5S- 0 0 39 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.179 125.2 -95.6-106.9 15.9 45.4 -69.5 14.7 788 88 G G T < 5S+ 0 0 69 -3,-2.1 2,-0.4 1,-0.3 -3,-0.2 0.480 78.7 132.0 94.5 2.7 45.7 -72.6 12.6 789 89 G V < - 0 0 25 -5,-2.3 2,-0.4 -6,-0.1 -1,-0.3 -0.754 53.5-130.4 -89.8 134.1 44.4 -71.5 9.2 790 90 G Q - 0 0 170 -2,-0.4 2,-0.3 32,-0.3 -5,-0.0 -0.671 30.7-173.8 -81.9 131.4 46.4 -72.4 6.1 791 91 G V + 0 0 36 -2,-0.4 2,-0.3 -10,-0.1 31,-0.0 -0.784 9.9 176.6-124.9 167.8 47.1 -69.5 3.9 792 92 G F - 0 0 109 -2,-0.3 2,-0.0 2,-0.0 29,-0.0 -0.961 40.5 -82.0-164.6 152.5 48.6 -69.0 0.5 793 93 G D + 0 0 150 -2,-0.3 3,-0.0 3,-0.0 0, 0.0 -0.340 48.4 177.0 -55.0 140.0 49.3 -66.3 -2.1 794 94 G S > - 0 0 24 1,-0.1 3,-1.0 -2,-0.0 4,-0.3 -0.971 38.6-122.1-147.0 145.8 46.3 -65.6 -4.3 795 95 G P T > S+ 0 0 123 0, 0.0 3,-0.6 0, 0.0 4,-0.5 0.762 105.7 66.5 -56.8 -34.3 45.8 -63.0 -7.1 796 96 G E T 3> S+ 0 0 100 1,-0.2 4,-1.8 2,-0.1 3,-0.3 0.809 85.4 73.8 -55.1 -33.2 42.8 -61.4 -5.3 797 97 G L H <> S+ 0 0 2 -3,-1.0 4,-2.2 1,-0.2 -1,-0.2 0.791 84.9 59.2 -65.6 -34.9 44.8 -60.2 -2.4 798 98 G A H <> S+ 0 0 72 -3,-0.6 4,-1.4 -4,-0.3 -1,-0.2 0.957 113.7 36.8 -55.8 -55.4 46.7 -57.2 -4.0 799 99 G D H > S+ 0 0 125 -4,-0.5 4,-2.1 -3,-0.3 -1,-0.2 0.791 112.8 60.6 -70.4 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