==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 19-DEC-05 2FF4 . COMPND 2 MOLECULE: PROBABLE REGULATORY PROTEIN EMBR; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR K.FUTTERER,L.J.ALDERWICK,G.S.BESRA . 766 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33858.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 565 73.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 1.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 106 13.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 1.3 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 . 50 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 73 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 294 38.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.3 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 2 0 0 0 0 2 0 2 4 2 2 0 2 2 0 4 0 0 0 0 0 2 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 8 4 10 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 0 ANTIPARALLEL BRIDGES PER LADDER . 0 2 2 2 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 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 E 0 0 190 0, 0.0 2,-0.3 0, 0.0 79,-0.2 0.000 360.0 360.0 360.0 -39.3 -16.6 -13.5 22.9 2 9 A K - 0 0 97 77,-2.3 2,-0.2 0, 0.0 77,-0.1 -0.942 360.0 -93.9-128.0 149.6 -14.8 -11.8 20.0 3 10 A R - 0 0 137 -2,-0.3 14,-2.3 1,-0.0 2,-0.5 -0.405 35.5-158.6 -65.6 127.0 -15.4 -8.5 18.3 4 11 A L E +A 16 0A 25 12,-0.2 2,-0.3 -2,-0.2 12,-0.2 -0.948 18.7 169.5-107.8 128.7 -17.7 -8.6 15.3 5 12 A D E -A 15 0A 22 10,-2.2 10,-2.7 -2,-0.5 2,-0.3 -0.977 15.8-159.8-141.3 149.8 -17.4 -5.8 12.8 6 13 A F E -Ab 14 103A 0 96,-2.3 98,-1.9 -2,-0.3 2,-0.4 -0.960 2.9-156.3-133.8 149.0 -18.7 -5.1 9.2 7 14 A G E +A 13 0A 2 6,-2.4 6,-2.0 -2,-0.3 3,-0.1 -0.988 24.9 157.7-134.2 128.6 -17.7 -2.7 6.4 8 15 A L + 0 0 0 -2,-0.4 2,-1.8 4,-0.2 135,-1.7 0.543 63.1 85.0-114.4 -21.1 -19.7 -1.2 3.5 9 16 A L S S- 0 0 0 128,-0.2 130,-3.1 133,-0.2 131,-1.1 -0.461 109.4 -1.9 -88.7 65.2 -17.6 1.8 2.7 10 17 A G S S- 0 0 0 -2,-1.8 133,-1.5 129,-0.3 3,-0.1 -0.908 126.9 -9.6 143.0-167.6 -15.2 -0.1 0.4 11 18 A P S S- 0 0 51 0, 0.0 -2,-0.1 0, 0.0 132,-0.1 -0.312 93.7 -84.9 -56.2 143.8 -15.1 -3.8 -0.5 12 19 A L - 0 0 15 -4,-0.1 2,-0.4 130,-0.1 -4,-0.2 -0.264 55.7-166.5 -53.3 131.0 -17.5 -5.8 1.8 13 20 A Q E +A 7 0A 61 -6,-2.0 -6,-2.4 -3,-0.1 2,-0.4 -0.990 24.6 178.4-130.1 132.9 -15.9 -6.7 5.0 14 21 A M E -A 6 0A 3 7,-0.4 7,-3.3 -2,-0.4 2,-0.4 -0.992 20.9-177.0-121.3 121.3 -16.6 -9.0 7.9 15 22 A T E -AC 5 20A 10 -10,-2.7 -10,-2.2 -2,-0.4 2,-0.5 -0.956 17.4-163.7-124.6 140.5 -14.0 -9.0 10.6 16 23 A I E > S-AC 4 19A 22 3,-2.4 3,-1.6 -2,-0.4 -12,-0.2 -0.987 85.2 -13.5-123.4 119.8 -13.6 -11.0 13.8 17 24 A D T 3 S- 0 0 89 -14,-2.3 -1,-0.1 -2,-0.5 -13,-0.1 0.813 130.7 -55.7 52.2 35.5 -11.1 -9.6 16.3 18 25 A G T 3 S+ 0 0 38 -15,-0.3 -1,-0.3 1,-0.2 -14,-0.1 0.348 113.5 118.2 84.9 -5.3 -9.8 -7.3 13.6 19 26 A T E < -C 16 0A 94 -3,-1.6 -3,-2.4 1,-0.0 -1,-0.2 -0.847 67.9-120.1 -97.8 121.6 -9.1 -10.1 11.2 20 27 A P E -C 15 0A 80 0, 0.0 -5,-0.3 0, 0.0 -7,-0.0 -0.339 22.4-155.6 -57.1 135.9 -11.0 -10.1 7.9 21 28 A V - 0 0 32 -7,-3.3 -7,-0.4 -2,-0.0 2,-0.1 -0.982 21.5-121.4-114.2 117.3 -13.1 -13.3 7.3 22 29 A P - 0 0 103 0, 0.0 -9,-0.1 0, 0.0 -7,-0.0 -0.424 22.5-154.8 -57.5 128.4 -13.8 -14.1 3.6 23 30 A S - 0 0 5 1,-0.3 2,-0.2 -11,-0.2 9,-0.2 0.303 37.3-102.7-100.6 8.3 -17.6 -14.1 3.3 24 31 A G - 0 0 25 4,-0.1 -1,-0.3 5,-0.1 44,-0.0 -0.686 60.1 -15.3 118.8-166.3 -18.2 -16.4 0.3 25 32 A T S > S- 0 0 29 -2,-0.2 4,-2.6 1,-0.1 3,-0.2 -0.258 77.2 -93.5 -68.7 163.7 -19.1 -16.4 -3.4 26 33 A P H > S+ 0 0 8 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.863 126.4 51.1 -52.6 -40.0 -20.5 -13.2 -4.8 27 34 A K H > S+ 0 0 27 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.911 112.1 46.8 -64.9 -41.7 -24.1 -14.3 -4.3 28 35 A Q H > S+ 0 0 11 -3,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.897 112.2 50.2 -64.3 -42.6 -23.4 -15.1 -0.7 29 36 A R H X S+ 0 0 14 -4,-2.6 4,-3.0 1,-0.2 -2,-0.2 0.871 106.1 56.0 -62.7 -38.7 -21.6 -11.8 -0.2 30 37 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.881 105.2 52.8 -60.6 -37.3 -24.6 -9.9 -1.7 31 38 A V H X S+ 0 0 0 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.958 111.3 45.9 -59.8 -50.8 -26.8 -11.6 0.9 32 39 A L H X S+ 0 0 2 -4,-1.9 4,-2.5 2,-0.2 5,-0.2 0.923 111.8 51.3 -58.0 -47.5 -24.5 -10.3 3.7 33 40 A A H X S+ 0 0 0 -4,-3.0 4,-2.9 1,-0.2 5,-0.2 0.925 109.9 49.8 -55.6 -47.9 -24.3 -6.8 2.1 34 41 A M H X S+ 0 0 23 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.884 112.2 48.2 -59.0 -40.5 -28.2 -6.7 2.0 35 42 A L H < S+ 0 0 1 -4,-2.1 61,-0.4 2,-0.2 6,-0.3 0.861 113.5 46.0 -69.3 -38.3 -28.4 -7.7 5.6 36 43 A V H >< S+ 0 0 0 -4,-2.5 3,-1.5 2,-0.2 -2,-0.2 0.885 110.8 53.1 -71.2 -40.5 -25.8 -5.2 6.8 37 44 A I H 3< S+ 0 0 19 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.889 118.6 37.2 -57.4 -40.0 -27.5 -2.4 4.7 38 45 A N T >< S+ 0 0 15 -4,-1.7 3,-2.1 -5,-0.2 -1,-0.3 -0.079 89.6 172.0-104.5 31.3 -30.7 -3.3 6.4 39 46 A R T < + 0 0 32 -3,-1.5 58,-0.2 1,-0.3 -3,-0.1 -0.075 67.6 12.8 -48.9 137.0 -29.1 -4.0 9.8 40 47 A N T 3 S+ 0 0 68 56,-3.2 -1,-0.3 1,-0.2 57,-0.1 0.554 113.8 92.5 67.0 12.6 -31.7 -4.5 12.6 41 48 A R S < S- 0 0 109 -3,-2.1 55,-0.5 -6,-0.3 -1,-0.2 -0.977 82.5-106.7-128.5 146.4 -34.5 -4.8 10.1 42 49 A P E -D 95 0B 60 0, 0.0 2,-0.5 0, 0.0 53,-0.2 -0.479 25.9-155.6 -68.8 139.6 -35.9 -8.0 8.4 43 50 A V E -D 94 0B 7 51,-2.7 51,-2.4 -2,-0.1 47,-0.1 -0.991 20.2-127.6-115.0 120.4 -35.0 -8.5 4.7 44 51 A G E > -D 93 0B 26 -2,-0.5 4,-1.9 49,-0.3 49,-0.2 -0.278 12.5-123.1 -66.0 150.0 -37.5 -10.7 2.8 45 52 A V H > S+ 0 0 30 47,-0.6 4,-2.4 1,-0.2 5,-0.2 0.873 114.8 55.4 -57.8 -39.8 -36.4 -13.7 0.8 46 53 A D H > S+ 0 0 109 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.896 107.1 50.0 -61.0 -40.9 -38.1 -12.2 -2.3 47 54 A A H > S+ 0 0 43 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.860 110.3 50.1 -64.2 -38.6 -36.0 -9.0 -1.8 48 55 A L H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 5,-0.2 0.929 109.1 51.3 -65.6 -44.7 -32.8 -11.2 -1.5 49 56 A I H X S+ 0 0 15 -4,-2.4 4,-2.7 1,-0.2 5,-0.3 0.921 111.2 47.7 -58.6 -47.6 -33.6 -13.1 -4.7 50 57 A T H X S+ 0 0 32 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.914 112.3 49.7 -59.6 -45.8 -34.2 -9.8 -6.7 51 58 A A H < S+ 0 0 12 -4,-2.0 100,-0.4 1,-0.2 -2,-0.2 0.886 118.2 38.7 -61.6 -40.7 -30.9 -8.3 -5.4 52 59 A L H < S+ 0 0 3 -4,-2.3 -2,-0.2 1,-0.1 -1,-0.2 0.880 136.4 12.9 -78.9 -42.3 -28.9 -11.4 -6.2 53 60 A W H >< S- 0 0 18 -4,-2.7 3,-3.0 -5,-0.2 -3,-0.2 0.312 76.0-177.9-121.1 8.0 -30.3 -12.5 -9.6 54 61 A E T 3< S+ 0 0 76 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.1 0.009 78.9 8.1 21.3 -92.6 -32.5 -9.5 -10.6 55 62 A E T 3 S+ 0 0 62 1,-0.2 -1,-0.3 676,-0.1 -5,-0.1 0.645 134.2 40.8 -85.2 -18.9 -34.0 -10.8 -13.9 56 63 A W < + 0 0 105 -3,-3.0 -1,-0.2 -6,-0.1 -2,-0.1 -0.512 62.5 176.2-136.7 67.8 -33.0 -14.5 -13.9 57 64 A P - 0 0 66 0, 0.0 555,-0.1 0, 0.0 2,-0.0 -0.470 35.2-115.2 -70.5 143.8 -33.1 -16.4 -10.7 58 65 A P > - 0 0 25 0, 0.0 3,-1.7 0, 0.0 4,-0.2 -0.350 29.2-106.7 -70.9 161.4 -32.2 -20.2 -10.9 59 66 A S T 3 S+ 0 0 141 1,-0.3 3,-0.3 554,-0.1 554,-0.0 0.766 121.2 49.0 -63.8 -25.3 -35.0 -22.6 -10.2 60 67 A G T 3> S+ 0 0 33 1,-0.2 4,-2.1 549,-0.2 -1,-0.3 -0.031 72.1 126.5 -99.6 29.7 -33.3 -23.5 -6.8 61 68 A A H <> S+ 0 0 5 -3,-1.7 4,-2.1 1,-0.2 -1,-0.2 0.859 72.2 50.7 -54.6 -42.6 -32.8 -19.9 -5.7 62 69 A R H > S+ 0 0 136 -3,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.887 108.4 50.7 -67.2 -41.0 -34.6 -20.4 -2.4 63 70 A A H > S+ 0 0 62 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.902 110.2 52.3 -59.5 -41.0 -32.4 -23.5 -1.5 64 71 A S H X S+ 0 0 6 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.913 107.0 51.6 -60.5 -44.7 -29.4 -21.4 -2.3 65 72 A I H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.930 109.2 50.3 -58.2 -48.3 -30.6 -18.6 0.0 66 73 A H H X S+ 0 0 102 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.888 112.0 48.5 -55.0 -42.9 -31.0 -21.1 2.8 67 74 A S H X S+ 0 0 46 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.900 110.0 51.0 -64.0 -43.6 -27.4 -22.4 2.1 68 75 A Y H X S+ 0 0 2 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.902 111.2 48.2 -61.2 -42.4 -26.0 -18.8 2.1 69 76 A V H X S+ 0 0 3 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.909 112.6 48.1 -63.1 -45.4 -27.7 -18.1 5.5 70 77 A S H X S+ 0 0 55 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.915 113.8 47.6 -59.9 -46.7 -26.3 -21.4 6.9 71 78 A N H X S+ 0 0 56 -4,-2.8 4,-1.7 2,-0.2 -2,-0.2 0.914 112.2 48.5 -59.5 -47.7 -22.8 -20.6 5.6 72 79 A L H X S+ 0 0 1 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.858 108.4 54.9 -64.6 -36.4 -22.9 -17.0 6.9 73 80 A R H X S+ 0 0 33 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.881 105.1 53.0 -63.0 -40.0 -24.0 -18.3 10.3 74 81 A K H < S+ 0 0 153 -4,-1.8 4,-0.4 2,-0.2 -2,-0.2 0.889 111.0 47.1 -61.0 -42.1 -21.0 -20.7 10.5 75 82 A L H >< S+ 0 0 48 -4,-1.7 3,-1.4 1,-0.2 -2,-0.2 0.930 112.0 49.2 -64.1 -47.0 -18.7 -17.7 9.8 76 83 A L H ><>S+ 0 0 2 -4,-2.6 3,-2.0 1,-0.3 5,-0.6 0.815 99.0 68.2 -62.6 -33.3 -20.5 -15.6 12.5 77 84 A G G ><5S+ 0 0 30 -4,-2.2 3,-1.5 1,-0.3 -1,-0.3 0.677 83.5 74.6 -59.3 -20.0 -20.2 -18.5 15.0 78 85 A G G < 5S+ 0 0 37 -3,-1.4 -1,-0.3 -4,-0.4 -2,-0.2 0.668 85.3 63.3 -66.3 -19.5 -16.4 -17.8 14.9 79 86 A A G < 5S- 0 0 0 -3,-2.0 -77,-2.3 -4,-0.2 -1,-0.3 0.334 117.3-113.3 -86.6 4.7 -17.0 -14.7 17.0 80 87 A G T < 5S+ 0 0 40 -3,-1.5 2,-0.2 1,-0.2 -3,-0.1 0.638 77.6 116.6 76.3 17.1 -18.3 -16.9 19.8 81 88 A I S > - 0 0 90 -2,-0.2 4,-2.3 1,-0.2 3,-1.2 -0.808 35.0-161.5 -86.0 108.5 -25.3 -17.5 18.9 83 90 A P H 3> S+ 0 0 30 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.768 89.4 59.1 -62.0 -29.7 -25.5 -17.2 15.1 84 91 A R H 34 S+ 0 0 169 2,-0.2 5,-0.3 1,-0.2 -2,-0.0 0.705 110.7 42.7 -72.7 -22.6 -29.2 -17.9 15.2 85 92 A V H <4 S+ 0 0 92 -3,-1.2 3,-0.5 3,-0.1 12,-0.2 0.883 117.9 43.8 -82.6 -47.5 -29.7 -14.9 17.4 86 93 A V H < S+ 0 0 18 -4,-2.3 11,-2.9 1,-0.3 2,-0.6 0.895 128.6 28.5 -66.9 -44.9 -27.3 -12.6 15.4 87 94 A L E < S-E 96 0B 1 -4,-2.7 -1,-0.3 9,-0.2 2,-0.2 -0.832 93.6-174.2-116.4 87.6 -28.7 -13.6 12.0 88 95 A A E -E 95 0B 14 7,-2.1 7,-2.4 -2,-0.6 2,-0.8 -0.585 24.8-123.6 -92.4 146.5 -32.2 -14.6 13.0 89 96 A A E -E 94 0B 56 -5,-0.3 5,-0.2 -2,-0.2 -1,-0.0 -0.803 27.1-168.6 -90.9 110.0 -34.9 -16.1 10.8 90 97 A A - 0 0 21 3,-2.3 -47,-0.0 -2,-0.8 0, 0.0 -0.734 33.1-129.0 -84.0 141.8 -38.0 -14.0 10.6 91 98 A P S S+ 0 0 138 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.880 119.6 54.0 -47.9 -41.4 -41.1 -15.5 9.0 92 99 A P S S- 0 0 92 0, 0.0 -47,-0.6 0, 0.0 2,-0.2 0.956 131.9 -83.1 -50.9 -56.3 -40.8 -12.1 7.2 93 100 A G E -D 44 0B 2 -49,-0.2 -3,-2.3 -48,-0.1 2,-0.3 -0.646 68.6 -34.7-174.4-122.6 -37.2 -12.9 6.1 94 101 A Y E -DE 43 89B 26 -51,-2.4 -51,-2.7 -5,-0.2 2,-0.4 -0.974 44.1-161.7-129.7 147.0 -33.8 -12.6 7.8 95 102 A R E -DE 42 88B 85 -7,-2.4 -7,-2.1 -2,-0.3 2,-0.7 -0.983 10.4-152.3-133.5 123.1 -32.5 -10.0 10.2 96 103 A L E - E 0 87B 0 -55,-0.5 -56,-3.2 -2,-0.4 2,-0.9 -0.849 15.8-158.0 -90.4 113.0 -28.9 -9.2 11.1 97 104 A S + 0 0 46 -11,-2.9 -58,-0.1 -2,-0.7 -61,-0.0 -0.834 33.2 140.7 -97.7 101.4 -29.0 -7.8 14.7 98 105 A I - 0 0 6 -2,-0.9 5,-0.1 -62,-0.1 -2,-0.0 -0.991 55.8-101.4-137.0 142.6 -25.8 -5.7 15.2 99 106 A P > - 0 0 83 0, 0.0 3,-1.7 0, 0.0 7,-0.1 -0.381 34.0-121.5 -58.4 143.7 -25.1 -2.4 17.0 100 107 A D G > S+ 0 0 80 1,-0.3 3,-1.5 2,-0.2 6,-0.3 0.867 110.0 60.2 -53.6 -41.7 -24.9 0.5 14.6 101 108 A N G 3 S+ 0 0 109 1,-0.3 -1,-0.3 5,-0.2 6,-0.1 0.439 91.1 69.4 -73.5 0.4 -21.3 1.4 15.7 102 109 A T G < S+ 0 0 27 -3,-1.7 -96,-2.3 -97,-0.1 2,-0.4 0.220 91.8 72.6 -97.9 13.1 -20.1 -2.1 14.7 103 110 A C B <> S-b 6 0A 0 -3,-1.5 4,-2.1 -98,-0.2 -96,-0.2 -0.974 82.0-134.1-124.2 136.2 -20.6 -1.0 11.0 104 111 A D H > S+ 0 0 4 -98,-1.9 4,-2.2 -2,-0.4 -97,-0.1 0.915 110.5 48.6 -59.0 -40.9 -18.3 1.5 9.2 105 112 A L H > S+ 0 0 3 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.891 107.8 55.5 -62.5 -41.6 -21.4 3.3 7.8 106 113 A G H > S+ 0 0 2 -6,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.882 110.0 45.6 -56.2 -42.8 -22.9 3.4 11.3 107 114 A R H X S+ 0 0 58 -4,-2.1 4,-2.5 -7,-0.3 5,-0.2 0.876 110.6 53.7 -67.7 -40.3 -19.8 5.1 12.6 108 115 A F H X S+ 0 0 0 -4,-2.2 4,-2.5 -5,-0.2 5,-0.2 0.943 110.7 47.1 -56.8 -49.3 -19.8 7.5 9.7 109 116 A V H X S+ 0 0 22 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.926 113.1 48.5 -58.3 -47.5 -23.4 8.5 10.5 110 117 A A H X S+ 0 0 56 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.885 114.1 44.6 -63.7 -43.0 -22.7 8.9 14.2 111 118 A E H X S+ 0 0 61 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.912 112.1 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