==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DE NOVO PROTEIN 16-DEC-09 3L35 . COMPND 2 MOLECULE: GP41 N-PEPTIDE; . SOURCE 2 SYNTHETIC: YES; . AUTHOR B.D.WELCH,J.S.REDMAN,S.PAUL,F.G.WHITBY,M.T.WEINSTOCK,J.D.REE . 182 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11340.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 146 80.2 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 131 72.0 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+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 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 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 0 198 0, 0.0 4,-1.5 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -32.1 20.7 3.4 -18.9 2 2 A M H > + 0 0 57 2,-0.2 4,-2.5 1,-0.2 5,-0.1 0.884 360.0 51.3 -77.3 -37.0 18.9 0.1 -18.5 3 3 A K H > S+ 0 0 119 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.916 109.5 51.5 -63.7 -41.0 21.6 -1.6 -16.4 4 4 A Q H > S+ 0 0 111 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.922 110.9 48.6 -60.3 -45.5 21.7 1.4 -14.0 5 5 A I H X S+ 0 0 1 -4,-1.5 4,-2.6 2,-0.2 -2,-0.2 0.926 108.1 53.6 -59.1 -48.3 17.9 1.1 -13.6 6 6 A E H X S+ 0 0 43 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.907 110.4 47.5 -58.2 -39.9 18.1 -2.7 -13.0 7 7 A D H X S+ 0 0 73 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.917 110.3 51.6 -65.9 -43.8 20.6 -2.1 -10.2 8 8 A K H X S+ 0 0 69 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.885 108.5 52.8 -59.4 -39.2 18.5 0.7 -8.7 9 9 A I H X S+ 0 0 1 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.922 106.6 51.3 -64.4 -42.5 15.5 -1.7 -8.7 10 10 A E H X S+ 0 0 136 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.926 110.9 49.2 -60.8 -41.8 17.4 -4.4 -6.8 11 11 A E H X S+ 0 0 129 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.881 109.7 51.4 -65.3 -41.0 18.4 -1.8 -4.2 12 12 A I H X S+ 0 0 2 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.902 109.9 49.6 -61.2 -43.5 14.7 -0.6 -3.9 13 13 A E H X S+ 0 0 51 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.900 110.6 50.9 -64.3 -39.1 13.6 -4.2 -3.4 14 14 A S H X S+ 0 0 66 -4,-2.3 4,-2.0 -5,-0.2 -2,-0.2 0.887 110.2 48.6 -62.5 -41.8 16.3 -4.7 -0.7 15 15 A K H X S+ 0 0 70 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.869 108.1 55.0 -65.3 -37.3 15.2 -1.6 1.1 16 16 A Q H X S+ 0 0 13 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.904 107.9 48.8 -63.9 -41.7 11.6 -2.7 1.0 17 17 A K H X S+ 0 0 121 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.906 109.4 52.0 -65.3 -41.1 12.5 -6.0 2.7 18 18 A K H X S+ 0 0 143 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.913 111.8 47.8 -57.3 -44.1 14.4 -4.2 5.4 19 19 A I H X S+ 0 0 8 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.929 110.5 50.4 -60.4 -51.1 11.3 -2.0 6.0 20 20 A E H X S+ 0 0 37 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.891 112.2 48.2 -57.0 -40.1 9.0 -5.1 6.1 21 21 A N H X S+ 0 0 90 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.889 110.9 50.6 -67.4 -40.0 11.4 -6.7 8.6 22 22 A E H X S+ 0 0 31 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.908 108.7 51.5 -63.4 -41.6 11.5 -3.6 10.7 23 23 A I H X S+ 0 0 3 -4,-2.7 4,-2.8 1,-0.2 5,-0.2 0.909 107.3 53.9 -62.0 -40.2 7.6 -3.4 10.7 24 24 A A H X S+ 0 0 43 -4,-1.9 4,-1.7 -5,-0.2 -1,-0.2 0.921 109.6 47.2 -61.6 -43.0 7.5 -7.0 11.9 25 25 A R H X S+ 0 0 123 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.897 112.0 50.3 -63.7 -44.0 9.8 -6.1 14.8 26 26 A I H X S+ 0 0 7 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.928 109.4 51.3 -58.0 -47.5 7.8 -3.0 15.7 27 27 A K H X S+ 0 0 77 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.855 109.0 50.7 -61.8 -37.3 4.5 -5.0 15.7 28 28 A K H X S+ 0 0 131 -4,-1.7 4,-1.5 -5,-0.2 -1,-0.2 0.897 111.6 46.1 -69.1 -38.7 5.9 -7.6 18.0 29 29 A L H X S+ 0 0 36 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.879 110.9 53.7 -70.1 -38.1 7.1 -5.1 20.5 30 30 A L H X S+ 0 0 4 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.893 103.9 56.1 -64.4 -36.3 3.8 -3.3 20.3 31 31 A Q H X S+ 0 0 113 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.934 108.3 48.9 -59.3 -41.3 2.1 -6.6 21.1 32 32 A L H X S+ 0 0 23 -4,-1.5 4,-2.1 1,-0.2 -2,-0.2 0.907 110.8 48.3 -65.2 -41.8 4.1 -6.8 24.3 33 33 A T H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.892 109.1 53.2 -69.5 -37.6 3.4 -3.2 25.3 34 34 A V H X S+ 0 0 9 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.937 109.9 49.8 -58.5 -44.8 -0.4 -3.8 24.7 35 35 A W H X S+ 0 0 33 -4,-2.1 4,-2.8 -5,-0.2 -2,-0.2 0.909 108.9 51.6 -59.9 -45.0 -0.2 -6.8 27.0 36 36 A G H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.920 111.0 47.5 -61.0 -44.5 1.7 -4.8 29.7 37 37 A I H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.913 112.6 49.2 -60.5 -45.6 -1.0 -2.2 29.7 38 38 A K H X S+ 0 0 98 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.900 112.7 47.9 -60.7 -44.3 -3.8 -4.8 29.8 39 39 A Q H X S+ 0 0 34 -4,-2.8 4,-1.8 2,-0.2 -2,-0.2 0.906 113.2 47.6 -64.1 -42.7 -2.0 -6.5 32.7 40 40 A L H X S+ 0 0 4 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.920 111.1 49.6 -64.6 -44.9 -1.5 -3.3 34.7 41 41 A Q H X S+ 0 0 10 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.924 108.5 53.7 -62.6 -45.0 -5.1 -2.1 34.2 42 42 A A H < S+ 0 0 61 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.902 110.0 48.2 -56.8 -39.8 -6.4 -5.5 35.4 43 43 A R H < S+ 0 0 146 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.932 113.4 46.4 -66.0 -44.1 -4.4 -5.3 38.6 44 44 A I H < 0 0 54 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.873 360.0 360.0 -65.7 -38.8 -5.5 -1.7 39.3 45 45 A L < 0 0 128 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.554 360.0 360.0 -78.9 360.0 -9.1 -2.4 38.7 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 0 159 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -50.0 14.0 -5.7 -20.9 48 2 B M H > + 0 0 17 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.934 360.0 53.3 -62.2 -46.2 12.1 -2.5 -20.4 49 3 B K H > S+ 0 0 133 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.888 105.1 53.8 -54.4 -44.5 8.8 -4.5 -19.8 50 4 B Q H > S+ 0 0 113 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.913 110.0 48.5 -57.7 -43.0 10.5 -6.6 -17.1 51 5 B I H X S+ 0 0 3 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.931 110.7 50.1 -60.8 -47.8 11.6 -3.4 -15.3 52 6 B E H X S+ 0 0 52 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.896 110.0 51.4 -58.4 -42.3 8.0 -2.0 -15.6 53 7 B D H X S+ 0 0 91 -4,-2.9 4,-1.5 2,-0.2 -1,-0.2 0.865 109.9 48.8 -60.9 -41.5 6.7 -5.3 -14.1 54 8 B K H X S+ 0 0 73 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.918 108.8 53.7 -67.4 -41.2 9.1 -5.0 -11.2 55 9 B I H X S+ 0 0 2 -4,-2.6 4,-3.0 1,-0.2 -2,-0.2 0.903 106.2 53.0 -57.1 -43.0 8.1 -1.4 -10.6 56 10 B E H X S+ 0 0 106 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.865 110.2 47.1 -62.4 -36.4 4.4 -2.5 -10.5 57 11 B E H X S+ 0 0 144 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.919 112.9 49.3 -71.3 -43.0 5.2 -5.1 -7.8 58 12 B I H X S+ 0 0 3 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.934 110.9 50.2 -56.2 -49.5 7.2 -2.6 -5.8 59 13 B E H X S+ 0 0 31 -4,-3.0 4,-1.7 1,-0.2 -2,-0.2 0.901 111.4 47.7 -60.9 -41.9 4.4 0.0 -6.0 60 14 B S H X S+ 0 0 70 -4,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.904 112.5 48.8 -63.1 -45.2 1.8 -2.5 -4.8 61 15 B K H X S+ 0 0 76 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.814 107.6 56.1 -64.5 -33.6 4.0 -3.6 -1.9 62 16 B Q H X S+ 0 0 14 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.879 106.6 49.2 -67.5 -39.7 4.6 0.0 -1.0 63 17 B K H X S+ 0 0 121 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.891 110.3 51.3 -64.2 -42.0 0.9 0.7 -0.7 64 18 B K H X S+ 0 0 93 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.914 111.5 48.1 -57.8 -46.6 0.6 -2.5 1.5 65 19 B I H X S+ 0 0 1 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.901 110.2 51.1 -61.3 -44.9 3.4 -1.1 3.7 66 20 B E H X S+ 0 0 57 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.901 110.1 49.2 -64.3 -39.8 1.8 2.3 4.0 67 21 B N H X S+ 0 0 108 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.916 111.5 49.6 -63.2 -43.4 -1.5 0.9 5.1 68 22 B E H X S+ 0 0 31 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.879 109.4 51.4 -62.9 -42.5 0.2 -1.3 7.7 69 23 B I H X S+ 0 0 1 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.894 108.0 52.4 -62.8 -43.2 2.1 1.7 9.0 70 24 B A H X S+ 0 0 49 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.895 110.0 49.0 -58.5 -41.0 -1.1 3.7 9.3 71 25 B R H X S+ 0 0 142 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.907 112.1 48.3 -64.2 -43.6 -2.7 0.8 11.4 72 26 B I H X S+ 0 0 12 -4,-2.3 4,-3.0 2,-0.2 5,-0.2 0.917 108.8 52.9 -64.9 -43.9 0.4 0.6 13.7 73 27 B K H X S+ 0 0 88 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.901 109.8 49.7 -59.3 -39.8 0.4 4.4 14.3 74 28 B K H X S+ 0 0 147 -4,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.931 112.4 45.9 -66.4 -42.2 -3.3 4.2 15.3 75 29 B L H X S+ 0 0 21 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.907 110.9 53.1 -66.1 -41.1 -2.7 1.3 17.7 76 30 B L H X S+ 0 0 3 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.897 105.1 55.6 -59.5 -40.4 0.4 3.1 19.1 77 31 B Q H X S+ 0 0 111 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.911 106.5 50.9 -59.9 -39.3 -1.8 6.2 19.7 78 32 B L H X S+ 0 0 22 -4,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.880 109.3 50.9 -63.4 -40.0 -4.2 4.0 21.8 79 33 B T H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.894 107.2 52.2 -70.4 -33.9 -1.4 2.7 23.8 80 34 B V H X S+ 0 0 10 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.936 110.9 49.5 -63.0 -43.9 -0.1 6.2 24.6 81 35 B W H X S+ 0 0 33 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.913 108.5 52.2 -60.1 -43.1 -3.6 7.0 25.7 82 36 B G H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.895 109.3 49.6 -62.1 -39.4 -3.7 3.9 28.0 83 37 B I H X S+ 0 0 1 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.919 112.2 48.5 -66.1 -41.3 -0.5 4.8 29.6 84 38 B K H X S+ 0 0 88 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.900 112.0 48.3 -65.0 -40.7 -1.8 8.3 30.2 85 39 B Q H X S+ 0 0 26 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.915 113.6 47.0 -67.6 -42.2 -5.1 7.1 31.7 86 40 B L H X S+ 0 0 1 -4,-2.7 4,-1.6 1,-0.2 -2,-0.2 0.911 111.3 51.2 -66.8 -41.3 -3.3 4.6 34.0 87 41 B Q H X S+ 0 0 12 -4,-2.6 4,-3.1 -5,-0.2 -1,-0.2 0.927 108.3 51.9 -62.1 -41.1 -0.8 7.2 35.2 88 42 B A H < S+ 0 0 60 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.909 108.6 50.5 -64.4 -37.3 -3.6 9.6 36.0 89 43 B R H < S+ 0 0 84 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.803 114.6 45.7 -70.2 -26.8 -5.4 6.9 38.1 90 44 B I H < 0 0 37 -4,-1.6 -2,-0.2 -3,-0.2 -1,-0.2 0.915 360.0 360.0 -77.3 -44.2 -2.1 6.4 39.9 91 45 B L < 0 0 134 -4,-3.1 -2,-0.2 -5,-0.1 -3,-0.2 0.794 360.0 360.0 -80.7 360.0 -1.2 10.1 40.5 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 0 156 0, 0.0 4,-1.9 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -55.5 10.1 5.2 -22.0 94 2 C M H > + 0 0 31 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.911 360.0 48.7 -57.0 -49.3 13.5 5.4 -20.2 95 3 C K H > S+ 0 0 136 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.897 109.0 53.1 -65.0 -39.4 12.9 8.8 -18.7 96 4 C Q H > S+ 0 0 153 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.881 111.9 46.4 -60.7 -39.5 9.5 7.8 -17.4 97 5 C I H X S+ 0 0 8 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.891 110.8 52.1 -66.1 -42.6 11.1 4.8 -15.7 98 6 C E H X S+ 0 0 66 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.887 111.2 47.3 -64.0 -38.3 13.9 6.9 -14.3 99 7 C D H X S+ 0 0 74 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.888 109.8 53.0 -68.3 -42.2 11.4 9.4 -12.8 100 8 C K H X S+ 0 0 65 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.870 107.7 52.2 -59.3 -41.4 9.3 6.6 -11.3 101 9 C I H X S+ 0 0 2 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.936 108.9 48.3 -62.7 -45.1 12.4 5.2 -9.6 102 10 C E H X S+ 0 0 134 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.907 112.3 50.6 -62.7 -40.9 13.3 8.6 -8.1 103 11 C E H X S+ 0 0 117 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.904 110.6 48.7 -61.0 -44.8 9.6 8.8 -6.9 104 12 C I H X S+ 0 0 3 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.894 110.4 50.7 -63.4 -43.1 9.8 5.3 -5.4 105 13 C E H X S+ 0 0 43 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.907 110.1 51.0 -61.7 -41.0 13.0 6.1 -3.6 106 14 C S H X S+ 0 0 65 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.913 110.2 48.4 -60.4 -49.2 11.4 9.3 -2.2 107 15 C K H X S+ 0 0 91 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.886 110.0 53.0 -59.5 -41.5 8.4 7.4 -0.9 108 16 C Q H X S+ 0 0 10 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.892 107.5 50.5 -62.9 -39.3 10.7 4.8 0.7 109 17 C K H X S+ 0 0 108 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.914 108.6 52.3 -67.1 -37.7 12.7 7.5 2.5 110 18 C K H X S+ 0 0 132 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.918 110.8 48.3 -60.5 -42.2 9.4 8.9 3.8 111 19 C I H X S+ 0 0 4 -4,-2.2 4,-2.8 2,-0.2 -1,-0.2 0.896 108.8 52.6 -63.6 -43.7 8.4 5.5 5.1 112 20 C E H X S+ 0 0 52 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.921 110.9 47.8 -60.8 -41.9 11.8 5.0 6.8 113 21 C N H X S+ 0 0 87 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.912 111.4 50.1 -66.5 -39.3 11.4 8.4 8.5 114 22 C E H X S+ 0 0 46 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.905 110.5 49.7 -61.3 -46.8 7.8 7.4 9.7 115 23 C I H X S+ 0 0 11 -4,-2.8 4,-2.7 2,-0.2 -1,-0.2 0.903 108.7 53.2 -60.0 -42.4 9.1 4.1 11.0 116 24 C A H X S+ 0 0 53 -4,-2.2 4,-2.0 -5,-0.2 -2,-0.2 0.913 109.9 48.0 -59.6 -41.2 11.9 5.9 12.9 117 25 C R H X S+ 0 0 148 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.938 111.6 49.9 -66.3 -44.1 9.3 8.2 14.5 118 26 C I H X S+ 0 0 10 -4,-2.7 4,-2.9 1,-0.2 -2,-0.2 0.918 109.5 51.0 -61.4 -43.6 7.1 5.3 15.4 119 27 C K H X S+ 0 0 75 -4,-2.7 4,-2.9 1,-0.2 -1,-0.2 0.918 109.2 51.0 -61.3 -43.8 10.0 3.4 17.0 120 28 C K H X S+ 0 0 144 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.922 113.5 44.4 -56.1 -48.3 11.0 6.4 19.2 121 29 C L H X S+ 0 0 20 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.913 111.5 53.0 -70.2 -39.9 7.4 6.8 20.4 122 30 C L H X S+ 0 0 4 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.931 107.0 53.2 -61.2 -41.5 7.1 3.1 21.1 123 31 C Q H X S+ 0 0 117 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.899 106.1 52.9 -59.7 -38.7 10.3 3.2 23.1 124 32 C L H X S+ 0 0 25 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.900 107.8 52.2 -60.2 -39.8 8.8 6.1 25.3 125 33 C T H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.889 106.7 52.3 -67.9 -34.9 5.7 3.9 25.9 126 34 C V H X S+ 0 0 18 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.935 109.2 49.9 -64.3 -44.4 8.0 1.0 27.0 127 35 C W H X S+ 0 0 52 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.950 111.9 49.6 -54.0 -46.8 9.7 3.4 29.5 128 36 C G H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.902 107.7 51.4 -64.6 -43.9 6.3 4.5 30.7 129 37 C I H X S+ 0 0 1 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.918 110.9 50.1 -57.1 -43.2 4.9 0.9 31.2 130 38 C K H X S+ 0 0 89 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.903 110.5 49.0 -65.7 -39.3 8.0 0.1 33.3 131 39 C Q H X S+ 0 0 54 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.900 112.4 48.3 -62.7 -43.7 7.6 3.2 35.4 132 40 C L H X S+ 0 0 6 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.908 111.0 50.0 -65.6 -41.3 4.0 2.4 36.1 133 41 C Q H X S+ 0 0 5 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.912 109.2 52.2 -65.8 -40.8 4.7 -1.2 37.0 134 42 C A H < S+ 0 0 58 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.922 108.9 50.1 -62.6 -40.1 7.4 -0.1 39.4 135 43 C R H < S+ 0 0 157 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.935 112.9 46.1 -63.0 -45.5 5.1 2.3 41.1 136 44 C I H < 0 0 37 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.889 360.0 360.0 -63.6 -41.6 2.4 -0.4 41.5 137 45 C L < 0 0 108 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.700 360.0 360.0 -75.2 360.0 4.9 -3.0 42.7 138 !* 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 0.0 139 1 H X 0 0 167 0, 0.0 2,-0.2 0, 0.0 -100,-0.0 0.000 360.0 360.0 360.0-124.3 -3.4 -12.9 31.1 140 2 H G + 0 0 61 3,-0.0 2,-0.3 4,-0.0 3,-0.0 -0.557 360.0 48.0 -69.2 137.7 -1.0 -15.5 29.5 141 3 H X > + 0 0 87 -2,-0.2 3,-2.3 1,-0.1 4,-0.2 -0.959 42.8 116.8 133.0-149.8 2.3 -14.1 28.3 142 4 H X G > S- 0 0 0 -2,-0.3 3,-1.8 1,-0.3 6,-0.4 0.820 112.0 -68.6 59.7 27.6 4.9 -11.8 30.0 143 5 H X G 3 S- 0 0 55 1,-0.3 -1,-0.3 9,-0.1 6,-0.1 0.645 90.9 -64.1 63.3 12.8 7.4 -14.7 29.8 144 6 H X G < S- 0 0 108 -3,-2.3 2,-0.4 1,-0.1 -1,-0.3 0.512 96.6 -65.9 86.4 8.0 5.3 -16.5 32.3 145 7 H X X + 0 0 63 -3,-1.8 3,-1.5 -4,-0.2 7,-0.2 -0.972 68.4 147.6 124.6-126.2 5.9 -14.0 35.1 146 8 H X G > S- 0 0 113 -2,-0.4 3,-1.6 1,-0.3 4,-0.3 0.882 101.6 -57.9 56.3 39.4 9.1 -13.1 36.8 147 9 H X G 3 S- 0 0 73 1,-0.3 -1,-0.3 2,-0.1 3,-0.2 0.665 109.6 -45.6 66.3 15.1 8.1 -9.4 37.2 148 10 H X G <> S- 0 0 0 -3,-1.5 4,-2.5 -6,-0.4 -1,-0.3 0.119 77.1-107.2 113.0 -14.7 7.7 -9.1 33.4 149 11 H X H <> S- 0 0 66 -3,-1.6 4,-2.3 1,-0.2 -1,-0.1 0.886 76.4 -57.9 61.7 38.5 10.9 -10.9 32.4 150 12 H X H 4 S- 0 0 48 -4,-0.3 -1,-0.2 1,-0.2 4,-0.2 0.879 111.3 -41.6 56.9 42.6 12.4 -7.5 31.4 151 13 H X H >4 S- 0 0 0 -3,-0.2 3,-1.8 2,-0.2 -2,-0.2 0.920 110.9 -56.4 77.7 44.5 9.5 -7.0 28.9 152 14 H X H 3< S- 0 0 34 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.937 105.1 -55.0 43.3 46.8 9.6 -10.8 27.7 153 15 H X T 3< 0 0 147 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.534 360.0 360.0 74.8 13.2 13.3 -10.1 26.8 154 16 H X < 0 0 112 -3,-1.8 -1,-0.3 -4,-0.2 -2,-0.2 0.552 360.0 360.0 79.8 360.0 12.4 -7.2 24.6 155 !* 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 0.0 156 1 K X 0 0 160 0, 0.0 2,-0.2 0, 0.0 -71,-0.0 0.000 360.0 360.0 360.0-126.9 -9.4 11.4 29.4 157 2 K G + 0 0 58 3,-0.0 2,-0.3 4,-0.0 3,-0.0 -0.556 360.0 52.5 -73.1 144.5 -11.8 11.1 26.4 158 3 K X > + 0 0 86 -2,-0.2 3,-2.5 1,-0.1 4,-0.4 -0.954 42.0 119.0 130.9-145.6 -11.1 8.1 24.1 159 4 K X G > S- 0 0 1 -2,-0.3 3,-1.8 1,-0.3 6,-0.4 0.838 112.6 -66.6 58.0 29.4 -10.7 4.4 25.1 160 5 K X G 3 S- 0 0 51 1,-0.3 -1,-0.3 9,-0.1 6,-0.1 0.654 90.8 -65.4 65.0 12.7 -13.8 3.6 22.9 161 6 K X G < S- 0 0 107 -3,-2.5 2,-0.4 4,-0.1 -1,-0.3 0.668 95.0 -69.3 78.6 20.2 -15.9 5.7 25.4 162 7 K X X + 0 0 57 -3,-1.8 3,-1.7 -4,-0.4 4,-0.5 -0.844 69.1 144.9 112.1-134.1 -15.3 3.3 28.3 163 8 K X G > S- 0 0 110 -2,-0.4 3,-1.4 1,-0.3 4,-0.3 0.908 103.9 -56.2 50.7 43.9 -16.5 -0.3 28.8 164 9 K X G 3 S- 0 0 80 1,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.534 111.5 -43.5 74.1 8.0 -13.3 -1.2 30.6 165 10 K X G X> S- 0 0 1 -3,-1.7 4,-2.3 -6,-0.4 3,-1.1 0.273 76.8-103.5 118.3 -10.5 -11.2 -0.1 27.5 166 11 K X H <> S- 0 0 72 -3,-1.4 4,-2.5 -4,-0.5 5,-0.2 0.867 77.0 -63.3 61.1 32.7 -13.3 -1.6 24.7 167 12 K X H 3> S- 0 0 55 -4,-0.3 4,-0.6 1,-0.2 -1,-0.3 0.815 109.7 -38.6 55.6 38.9 -10.6 -4.3 24.5 168 13 K X H <4 S- 0 0 0 -3,-1.1 3,-0.4 2,-0.2 -1,-0.2 0.837 111.8 -56.6 80.3 45.9 -8.1 -1.7 23.5 169 14 K X H < S- 0 0 25 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.935 106.8 -51.8 47.9 45.8 -10.4 0.4 21.3 170 15 K X H < 0 0 146 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.812 360.0 360.0 80.0 9.3 -11.2 -2.7 19.2 171 16 K X < 0 0 109 -4,-0.6 -1,-0.2 -3,-0.4 -2,-0.2 0.726 360.0 360.0 81.5 360.0 -7.4 -3.5 18.6 172 !* 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 0.0 173 2 L G 0 0 78 0, 0.0 2,-0.3 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 164.0 15.6 8.2 35.2 174 3 L X > + 0 0 101 1,-0.1 3,-2.3 0, 0.0 4,-0.3 -0.880 360.0 117.3 117.0-150.6 14.3 9.6 31.8 175 4 L X G > S- 0 0 2 -2,-0.3 3,-1.8 1,-0.3 6,-0.3 0.850 113.4 -64.6 61.3 27.6 10.8 10.9 31.2 176 5 L X G 3 S- 0 0 56 1,-0.3 -1,-0.3 9,-0.1 6,-0.1 0.567 92.8 -66.1 69.3 3.7 12.2 14.4 30.4 177 6 L X G < S- 0 0 108 -3,-2.3 2,-0.5 1,-0.1 -1,-0.3 0.568 93.0 -69.5 89.6 14.0 13.3 14.5 34.1 178 7 L X X + 0 0 72 -3,-1.8 3,-1.7 -4,-0.3 4,-0.4 -0.916 65.2 149.0 121.9-127.6 9.8 14.5 35.5 179 8 L X G > S- 0 0 108 -2,-0.5 3,-1.3 1,-0.3 4,-0.3 0.889 103.3 -55.4 53.6 38.9 7.1 17.2 35.5 180 9 L X G 3 S- 0 0 81 1,-0.3 -1,-0.3 2,-0.1 4,-0.1 0.570 111.6 -43.6 76.7 9.0 4.4 14.4 35.5 181 10 L X G X> S- 0 0 8 -3,-1.7 4,-2.2 -6,-0.3 3,-0.6 0.293 78.6-104.6 114.8 -9.0 5.9 12.8 32.4 182 11 L X H <> S- 0 0 73 -3,-1.3 4,-2.3 -4,-0.4 5,-0.2 0.867 75.7 -61.9 58.4 34.1 6.6 16.0 30.4 183 12 L X H 3> S- 0 0 48 -4,-0.3 4,-1.1 1,-0.2 -1,-0.2 0.895 110.5 -39.7 59.0 36.0 3.5 15.1 28.2 184 13 L X H <4 S- 0 0 0 -3,-0.6 -1,-0.2 2,-0.2 -2,-0.2 0.874 110.4 -57.2 79.1 46.7 5.3 12.0 27.2 185 14 L X H < S- 0 0 35 -4,-2.2 -2,-0.2 -10,-0.2 -1,-0.2 0.845 106.1 -53.9 42.9 42.5 8.8 13.6 26.9 186 15 L X H < 0 0 160 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.880 360.0 360.0 74.3 28.2 7.2 16.0 24.4 187 16 L X < 0 0 97 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.660 360.0 360.0 72.3 360.0 5.9 13.2 22.2