==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-FEB-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN/VIRAL PROTEIN INHIBITOR 07-APR-10 3MGN . COMPND 2 MOLECULE: IQN17; . SOURCE 2 SYNTHETIC: YES; . AUTHOR C.P.HILL,F.G.WHITBY,M.KAY,N.FRANCIS . 348 13 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22640.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 292 83.9 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 . 5 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 263 75.6 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+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 5 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 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 R > 0 0 141 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -39.9 5.4 1.5 54.3 2 2 A M H > + 0 0 49 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.858 360.0 49.9 -60.6 -38.7 8.4 -0.8 54.2 3 3 A K H > S+ 0 0 134 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.911 109.0 50.4 -65.2 -45.9 6.1 -3.8 53.6 4 4 A Q H > S+ 0 0 121 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.876 112.7 48.4 -59.9 -40.2 4.2 -2.0 50.7 5 5 A I H X S+ 0 0 3 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.914 110.3 50.8 -62.7 -47.1 7.7 -1.2 49.2 6 6 A E H X S+ 0 0 64 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.875 110.0 49.8 -61.4 -40.7 8.8 -4.8 49.6 7 7 A D H X S+ 0 0 78 -4,-2.6 4,-1.6 2,-0.2 -1,-0.2 0.875 110.6 49.9 -64.4 -40.7 5.6 -6.1 47.9 8 8 A K H X S+ 0 0 86 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.869 109.0 52.1 -65.8 -38.4 6.2 -3.6 45.0 9 9 A I H X S+ 0 0 11 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.894 107.2 53.0 -63.1 -41.3 9.8 -4.8 44.7 10 10 A E H X S+ 0 0 133 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.871 111.1 46.8 -61.2 -39.6 8.5 -8.4 44.5 11 11 A E H X S+ 0 0 123 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.887 113.2 48.5 -69.3 -42.2 6.1 -7.4 41.6 12 12 A I H X S+ 0 0 2 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.931 111.8 48.8 -63.7 -47.4 8.9 -5.5 39.8 13 13 A E H X S+ 0 0 66 -4,-2.9 4,-2.2 2,-0.2 -2,-0.2 0.900 110.5 50.8 -59.7 -44.5 11.4 -8.4 40.1 14 14 A S H X S+ 0 0 80 -4,-1.8 4,-1.7 1,-0.2 -1,-0.2 0.896 112.3 46.8 -59.6 -44.4 8.8 -10.9 38.8 15 15 A K H X S+ 0 0 63 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.870 109.5 54.5 -66.8 -37.6 8.1 -8.7 35.8 16 16 A Q H X S+ 0 0 12 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.903 107.5 50.0 -62.8 -40.6 11.8 -8.2 35.2 17 17 A K H X S+ 0 0 140 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.887 111.6 48.9 -64.2 -39.4 12.2 -12.0 35.1 18 18 A K H X S+ 0 0 122 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.921 112.3 48.0 -63.9 -45.9 9.3 -12.2 32.6 19 19 A I H X S+ 0 0 12 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.895 109.7 52.9 -62.9 -41.3 10.8 -9.4 30.4 20 20 A E H X S+ 0 0 63 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.907 110.8 47.2 -60.4 -43.0 14.3 -11.1 30.5 21 21 A N H X S+ 0 0 79 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.874 111.6 50.2 -67.0 -38.9 12.8 -14.4 29.3 22 22 A E H X S+ 0 0 32 -4,-2.1 4,-2.9 2,-0.2 -2,-0.2 0.883 108.6 52.7 -68.5 -38.3 10.8 -12.6 26.5 23 23 A I H X S+ 0 0 10 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.918 108.8 50.1 -59.6 -43.9 14.0 -10.8 25.4 24 24 A A H X S+ 0 0 36 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.908 112.5 47.2 -63.2 -40.7 15.8 -14.2 25.1 25 25 A R H X S+ 0 0 162 -4,-2.0 4,-2.2 2,-0.2 5,-0.2 0.925 111.2 51.2 -65.1 -46.5 12.8 -15.6 23.1 26 26 A I H X S+ 0 0 8 -4,-2.9 4,-3.0 1,-0.2 -2,-0.2 0.904 108.5 52.1 -57.3 -43.5 12.8 -12.5 20.8 27 27 A K H X S+ 0 0 83 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.897 108.4 50.3 -63.2 -39.7 16.5 -12.8 20.2 28 28 A K H X S+ 0 0 147 -4,-1.8 4,-1.7 2,-0.2 -1,-0.2 0.910 114.4 43.4 -65.4 -43.7 16.2 -16.5 19.2 29 29 A L H X S+ 0 0 13 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.910 111.8 53.5 -70.1 -37.9 13.4 -15.7 16.7 30 30 A L H X S+ 0 0 3 -4,-3.0 4,-2.3 -5,-0.2 -2,-0.2 0.926 106.7 52.9 -60.8 -40.8 15.1 -12.7 15.4 31 31 A Q H X S+ 0 0 103 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.894 108.0 51.9 -62.5 -38.1 18.2 -14.8 14.7 32 32 A L H X S+ 0 0 34 -4,-1.7 4,-2.7 1,-0.2 -1,-0.2 0.906 107.6 50.9 -63.8 -41.4 16.1 -17.2 12.8 33 33 A T H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.904 108.8 51.8 -67.6 -34.9 14.6 -14.4 10.7 34 34 A V H X S+ 0 0 8 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.934 111.2 47.8 -60.8 -45.8 18.2 -13.2 9.9 35 35 A W H X S+ 0 0 58 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.923 111.2 51.2 -61.1 -41.1 19.1 -16.7 8.8 36 36 A G H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.903 108.8 50.5 -61.7 -46.5 15.9 -16.9 6.7 37 37 A I H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.918 108.2 53.0 -59.4 -40.8 16.7 -13.7 4.9 38 38 A K H X S+ 0 0 95 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.900 110.0 48.5 -61.0 -40.5 20.2 -14.9 4.1 39 39 A Q H X S+ 0 0 86 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.936 112.3 48.0 -65.3 -45.1 18.8 -18.0 2.5 40 40 A L H X S+ 0 0 4 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.919 111.3 50.0 -63.2 -44.7 16.3 -16.1 0.5 41 41 A Q H X S+ 0 0 14 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.917 107.0 54.0 -60.4 -42.7 18.9 -13.6 -0.8 42 42 A A H < S+ 0 0 74 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.892 112.7 44.6 -63.7 -35.2 21.3 -16.3 -1.8 43 43 A R H < S+ 0 0 160 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.944 113.3 48.5 -71.0 -47.7 18.6 -17.9 -3.9 44 44 A I H < 0 0 40 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.895 360.0 360.0 -58.4 -38.8 17.3 -14.6 -5.5 45 45 A L < 0 0 108 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.741 360.0 360.0 -82.6 360.0 20.8 -13.5 -6.4 46 !* 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 47 1 B R > 0 0 154 0, 0.0 4,-1.1 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -40.9 15.3 -3.8 56.6 48 2 B M H > + 0 0 51 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.770 360.0 59.5 -71.0 -29.1 15.5 -0.6 54.6 49 3 B K H > S+ 0 0 134 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.942 103.0 50.2 -62.3 -50.0 19.1 -1.5 53.7 50 4 B Q H > S+ 0 0 139 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.830 113.0 49.4 -56.0 -33.6 18.0 -4.7 52.0 51 5 B I H X S+ 0 0 4 -4,-1.1 4,-2.2 2,-0.2 -2,-0.2 0.938 109.9 47.8 -70.5 -50.4 15.5 -2.6 50.1 52 6 B E H X S+ 0 0 59 -4,-2.7 4,-1.5 1,-0.2 -2,-0.2 0.839 113.3 50.3 -60.1 -35.0 18.0 0.1 49.0 53 7 B D H X S+ 0 0 87 -4,-2.6 4,-1.8 2,-0.2 -1,-0.2 0.868 108.9 50.7 -69.4 -39.8 20.3 -2.8 47.9 54 8 B K H X S+ 0 0 74 -4,-1.6 4,-2.3 -5,-0.2 -2,-0.2 0.856 107.7 53.4 -66.6 -36.8 17.5 -4.5 45.9 55 9 B I H X S+ 0 0 3 -4,-2.2 4,-2.8 2,-0.2 -1,-0.2 0.886 107.0 52.4 -64.1 -40.9 16.7 -1.1 44.2 56 10 B E H X S+ 0 0 106 -4,-1.5 4,-1.8 2,-0.2 -2,-0.2 0.918 111.9 45.7 -57.1 -46.8 20.3 -0.9 43.1 57 11 B E H X S+ 0 0 104 -4,-1.8 4,-1.5 1,-0.2 -2,-0.2 0.856 114.8 47.7 -67.2 -38.3 20.1 -4.4 41.6 58 12 B I H X S+ 0 0 5 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.881 110.0 52.3 -69.1 -41.6 16.8 -3.7 39.9 59 13 B E H X S+ 0 0 66 -4,-2.8 4,-1.5 2,-0.2 -2,-0.2 0.860 112.1 44.7 -65.0 -39.2 18.0 -0.3 38.5 60 14 B S H X S+ 0 0 75 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.847 113.3 51.0 -73.2 -35.4 21.1 -1.9 36.9 61 15 B K H X S+ 0 0 87 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.888 108.6 52.2 -66.2 -40.6 19.1 -4.8 35.6 62 16 B Q H X S+ 0 0 14 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.871 108.5 51.2 -61.9 -38.0 16.6 -2.3 34.1 63 17 B K H X S+ 0 0 135 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.890 109.2 50.2 -65.8 -40.4 19.6 -0.6 32.4 64 18 B K H X S+ 0 0 135 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.923 111.2 49.5 -62.1 -45.1 20.7 -3.9 31.0 65 19 B I H X S+ 0 0 6 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.915 109.3 50.9 -61.1 -47.9 17.2 -4.6 29.6 66 20 B E H X S+ 0 0 74 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.896 110.4 50.0 -56.1 -43.4 17.0 -1.1 28.0 67 21 B N H X S+ 0 0 96 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.896 111.0 48.9 -64.4 -39.8 20.3 -1.7 26.3 68 22 B E H X S+ 0 0 50 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.880 109.8 51.2 -67.2 -39.0 19.2 -5.1 25.0 69 23 B I H X S+ 0 0 12 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.861 107.5 53.5 -68.8 -35.0 15.9 -3.7 23.7 70 24 B A H X S+ 0 0 53 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.892 110.9 46.8 -62.4 -39.7 17.8 -0.9 21.8 71 25 B R H X S+ 0 0 128 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.870 111.1 50.9 -72.8 -38.2 20.0 -3.6 20.1 72 26 B I H X S+ 0 0 5 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.903 108.2 53.6 -63.5 -40.6 17.0 -5.7 19.2 73 27 B K H X S+ 0 0 85 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.908 108.3 49.1 -63.6 -41.9 15.3 -2.7 17.7 74 28 B K H X S+ 0 0 124 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.926 113.2 46.2 -62.1 -44.7 18.3 -2.0 15.5 75 29 B L H X S+ 0 0 5 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.908 111.9 51.5 -66.7 -40.5 18.5 -5.6 14.3 76 30 B L H X S+ 0 0 3 -4,-2.9 4,-2.4 2,-0.2 5,-0.2 0.911 108.0 52.6 -60.2 -40.8 14.7 -5.7 13.7 77 31 B Q H X S+ 0 0 113 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.915 109.4 50.8 -60.6 -39.2 15.1 -2.5 11.6 78 32 B L H X S+ 0 0 5 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.905 109.2 48.9 -64.1 -43.0 17.8 -4.2 9.6 79 33 B T H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.887 110.4 50.8 -68.5 -33.8 15.6 -7.2 8.9 80 34 B V H X S+ 0 0 15 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.934 110.5 50.1 -65.7 -42.6 12.7 -5.1 7.8 81 35 B W H X S+ 0 0 44 -4,-2.2 4,-2.0 -5,-0.2 -2,-0.2 0.931 110.5 50.1 -57.2 -46.6 15.1 -3.2 5.5 82 36 B G H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.934 109.5 50.8 -63.7 -40.1 16.3 -6.6 4.1 83 37 B I H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.899 108.3 52.3 -59.5 -43.9 12.8 -7.8 3.5 84 38 B K H X S+ 0 0 94 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.911 110.1 48.6 -60.6 -40.3 12.0 -4.7 1.6 85 39 B Q H X S+ 0 0 62 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.926 112.1 48.6 -66.7 -43.0 15.0 -5.1 -0.6 86 40 B L H X S+ 0 0 4 -4,-2.5 4,-2.1 1,-0.2 5,-0.2 0.938 113.7 46.0 -64.1 -44.1 14.1 -8.8 -1.4 87 41 B Q H X S+ 0 0 14 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.922 110.7 52.4 -65.6 -40.4 10.6 -8.0 -2.2 88 42 B A H < S+ 0 0 72 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.884 109.6 51.5 -62.4 -38.0 11.5 -5.0 -4.4 89 43 B R H < S+ 0 0 142 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.905 113.5 41.2 -67.0 -42.7 13.9 -7.2 -6.3 90 44 B I H < 0 0 53 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.823 360.0 360.0 -79.0 -26.3 11.4 -10.0 -7.1 91 45 B L < 0 0 123 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.816 360.0 360.0 -90.8 360.0 8.5 -7.7 -7.8 92 !* 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 93 1 C R > 0 0 125 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -72.2 14.9 7.0 53.4 94 2 C M H > + 0 0 59 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.849 360.0 43.7 -68.3 -37.1 11.4 5.5 53.0 95 3 C K H > S+ 0 0 134 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.851 112.7 53.6 -74.1 -36.7 10.0 8.4 50.9 96 4 C Q H > S+ 0 0 104 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.883 111.4 46.1 -59.4 -43.3 13.3 8.3 48.9 97 5 C I H X S+ 0 0 2 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.906 109.9 53.8 -65.0 -44.9 12.7 4.6 48.3 98 6 C E H X S+ 0 0 59 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.834 108.8 49.2 -61.1 -36.5 9.1 5.2 47.4 99 7 C D H X S+ 0 0 75 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.882 109.8 50.4 -70.7 -40.8 10.0 7.7 44.7 100 8 C K H X S+ 0 0 76 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.867 109.5 52.1 -65.4 -37.4 12.7 5.5 43.2 101 9 C I H X S+ 0 0 3 -4,-2.2 4,-3.0 2,-0.2 -1,-0.2 0.906 108.1 50.8 -64.1 -43.4 10.1 2.6 43.0 102 10 C E H X S+ 0 0 130 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.904 111.9 47.4 -60.3 -43.8 7.6 4.9 41.2 103 11 C E H X S+ 0 0 112 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.887 112.8 49.5 -63.7 -41.3 10.3 5.9 38.7 104 12 C I H X S+ 0 0 3 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.939 109.6 51.2 -61.8 -49.2 11.2 2.2 38.2 105 13 C E H X S+ 0 0 56 -4,-3.0 4,-1.9 1,-0.2 -2,-0.2 0.841 109.4 50.3 -57.6 -38.7 7.6 1.2 37.7 106 14 C S H X S+ 0 0 49 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.888 111.5 47.2 -70.1 -40.2 7.1 3.9 35.0 107 15 C K H X S+ 0 0 83 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.879 109.7 55.6 -66.3 -38.2 10.3 2.7 33.1 108 16 C Q H X S+ 0 0 13 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.902 106.3 49.9 -59.5 -43.5 9.0 -0.9 33.4 109 17 C K H X S+ 0 0 107 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.924 109.7 50.8 -61.8 -44.3 5.7 0.0 31.8 110 18 C K H X S+ 0 0 132 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.883 111.3 49.0 -59.7 -40.5 7.6 1.8 28.9 111 19 C I H X S+ 0 0 11 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.917 109.5 51.1 -64.6 -45.5 9.7 -1.4 28.5 112 20 C E H X S+ 0 0 52 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.916 111.0 49.5 -60.2 -42.7 6.7 -3.6 28.5 113 21 C N H X S+ 0 0 87 -4,-2.5 4,-2.1 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