==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 31-OCT-07 3B89 . COMPND 2 MOLECULE: 16S RRNA METHYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR S.ESWARAMOORTHY,S.K.BURLEY,S.SWAMINATHAN,NEW YORK SGX . 240 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11430.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 178 74.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 10.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 20 8.3 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 . 1 0.4 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 . 17 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 80 33.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.2 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 2 2 2 0 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 1 1 1 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 PARALLEL BRIDGES PER LADDER . 1 0 0 0 0 0 1 1 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 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 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 2 A N > 0 0 129 0, 0.0 4,-1.6 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 175.2 23.6 41.2 9.4 2 3 A I H > + 0 0 53 1,-0.2 4,-3.5 2,-0.2 5,-0.2 0.903 360.0 54.8 -63.3 -45.3 22.6 38.6 12.1 3 4 A N H > S+ 0 0 83 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.853 106.9 53.0 -60.6 -32.3 24.0 40.5 15.0 4 5 A D H > S+ 0 0 103 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.922 114.0 42.1 -66.5 -43.7 21.9 43.5 14.1 5 6 A A H X S+ 0 0 15 -4,-1.6 4,-3.0 2,-0.2 5,-0.3 0.902 109.9 55.4 -69.6 -44.8 18.8 41.4 14.0 6 7 A L H X S+ 0 0 13 -4,-3.5 4,-2.6 1,-0.2 5,-0.2 0.952 110.0 49.7 -53.6 -45.7 19.6 39.5 17.1 7 8 A T H < S+ 0 0 98 -4,-2.0 4,-0.4 -5,-0.2 -1,-0.2 0.823 112.1 46.4 -61.6 -37.2 19.9 42.9 18.8 8 9 A S H >X S+ 0 0 65 -4,-1.4 3,-0.9 2,-0.2 4,-0.7 0.936 114.3 46.4 -70.9 -49.7 16.6 44.1 17.4 9 10 A I H >< S+ 0 0 0 -4,-3.0 3,-1.1 1,-0.3 6,-0.4 0.890 109.9 53.5 -60.8 -41.5 14.7 41.0 18.3 10 11 A L T 3< S+ 0 0 45 -4,-2.6 -1,-0.3 -5,-0.3 -2,-0.2 0.658 99.8 65.3 -69.0 -13.9 16.2 40.9 21.8 11 12 A A T <4 S+ 0 0 82 -3,-0.9 -1,-0.3 -4,-0.4 -2,-0.2 0.755 82.2 97.3 -78.3 -26.0 14.9 44.5 22.3 12 13 A S S 4 S+ 0 0 14 -6,-0.4 3,-2.5 -3,-0.1 -2,-0.2 0.524 86.3 105.9-116.7 -5.9 11.8 38.0 23.3 16 17 A R T 3< S+ 0 0 145 -4,-1.9 -3,-0.1 1,-0.3 -2,-0.1 0.739 82.4 53.5 -46.5 -30.6 14.2 39.9 25.6 17 18 A A T 3 S+ 0 0 8 -4,-0.3 116,-3.0 -3,-0.1 117,-0.3 0.185 86.2 116.6 -94.3 19.8 14.6 37.0 28.0 18 19 A L B < S-A 132 0A 9 -3,-2.5 114,-0.2 114,-0.2 113,-0.1 -0.680 79.2-100.0 -93.1 140.8 15.5 34.5 25.2 19 20 A C >> - 0 0 0 112,-1.4 4,-1.5 -2,-0.3 3,-1.1 -0.355 31.7-139.5 -55.2 116.6 18.9 32.7 25.0 20 21 A P H 3> S+ 0 0 50 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.806 99.2 60.9 -51.5 -32.1 20.7 34.8 22.4 21 22 A D H 3> S+ 0 0 67 1,-0.2 4,-3.6 2,-0.2 5,-0.2 0.882 102.4 51.8 -62.5 -39.8 22.2 31.7 20.8 22 23 A T H <> S+ 0 0 0 -3,-1.1 4,-2.7 2,-0.2 5,-0.2 0.928 109.9 47.7 -62.6 -48.6 18.7 30.4 20.0 23 24 A V H X S+ 0 0 0 -4,-1.5 4,-1.7 2,-0.2 -1,-0.2 0.880 116.4 45.0 -61.2 -39.5 17.7 33.6 18.3 24 25 A R H X S+ 0 0 85 -4,-2.1 4,-3.3 2,-0.2 5,-0.3 0.956 110.8 52.3 -69.2 -52.1 20.9 33.6 16.3 25 26 A R H X S+ 0 0 26 -4,-3.6 4,-1.8 1,-0.3 -2,-0.2 0.932 114.7 43.3 -48.3 -51.1 20.7 30.0 15.4 26 27 A I H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 -1,-0.3 0.830 111.3 53.9 -67.5 -32.0 17.2 30.6 14.1 27 28 A L H X S+ 0 0 7 -4,-1.7 4,-1.0 -5,-0.2 -2,-0.2 0.978 108.1 51.0 -64.7 -50.4 18.1 33.7 12.4 28 29 A T H X S+ 0 0 68 -4,-3.3 4,-1.7 1,-0.2 3,-0.3 0.845 111.8 46.4 -53.1 -41.8 20.9 31.9 10.5 29 30 A E H X S+ 0 0 49 -4,-1.8 4,-1.2 -5,-0.3 -1,-0.2 0.859 109.1 53.1 -73.2 -35.7 18.6 29.2 9.3 30 31 A E H < S+ 0 0 7 -4,-2.0 5,-0.3 -3,-0.2 6,-0.2 0.625 108.8 55.0 -75.0 -10.7 15.9 31.5 8.2 31 32 A W H >X S+ 0 0 94 -4,-1.0 3,-3.1 -3,-0.3 4,-1.8 0.956 105.2 45.5 -84.0 -59.5 18.5 33.3 6.1 32 33 A G H 3< S+ 0 0 54 -4,-1.7 -2,-0.2 1,-0.3 -3,-0.1 0.768 113.8 52.9 -54.5 -28.2 20.0 30.4 4.0 33 34 A R T 3< S+ 0 0 160 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.446 130.3 12.0 -85.5 -2.1 16.5 29.3 3.3 34 35 A H T <4 - 0 0 81 -3,-3.1 -2,-0.2 -5,-0.1 -3,-0.2 0.587 59.6-153.6-136.3 -58.7 15.5 32.8 2.1 35 36 A K < - 0 0 126 -4,-1.8 -3,-0.1 -5,-0.3 -4,-0.1 0.171 60.7-150.1 84.1 -13.8 18.2 35.5 1.5 36 37 A S - 0 0 27 -5,-0.3 4,-0.1 -6,-0.2 -5,-0.0 0.641 31.4 -92.7 40.1 170.4 15.1 37.4 2.3 37 38 A P S S- 0 0 115 0, 0.0 -1,-0.2 0, 0.0 3,-0.0 0.310 85.0 -93.8 -88.0 -0.5 13.3 40.7 1.6 38 39 A K S > S+ 0 0 146 -7,-0.1 2,-3.3 1,-0.0 3,-0.9 -0.439 113.6 104.6 111.6 -42.9 15.3 41.2 4.7 39 40 A Q T 3 + 0 0 131 1,-0.3 4,-0.4 2,-0.1 -3,-0.1 -0.337 28.7 122.8 -72.0 67.7 12.4 40.4 6.8 40 41 A T T 3> + 0 0 5 -2,-3.3 4,-3.0 2,-0.2 -1,-0.3 0.558 64.9 78.3 -88.9 -27.5 13.7 36.9 7.6 41 42 A V H <> S+ 0 0 28 -3,-0.9 4,-3.0 1,-0.2 -1,-0.1 0.784 87.7 54.2 -51.6 -31.4 13.2 38.5 11.0 42 43 A E H > S+ 0 0 79 2,-0.2 4,-2.7 3,-0.2 -1,-0.2 0.926 108.0 45.7 -72.7 -45.7 9.5 37.7 10.5 43 44 A A H > S+ 0 0 24 -4,-0.4 4,-0.8 2,-0.2 -2,-0.2 0.924 118.8 44.4 -61.7 -44.0 10.0 34.0 9.9 44 45 A A H >X S+ 0 0 0 -4,-3.0 4,-1.9 2,-0.2 3,-1.0 0.954 111.0 53.5 -65.0 -51.3 12.4 33.9 12.8 45 46 A R H 3X S+ 0 0 68 -4,-3.0 4,-0.7 1,-0.3 3,-0.2 0.899 113.1 42.1 -51.8 -46.9 10.1 36.0 15.0 46 47 A T H 3X S+ 0 0 103 -4,-2.7 4,-0.6 1,-0.2 -1,-0.3 0.623 112.2 56.4 -78.3 -10.2 7.1 33.7 14.5 47 48 A R H << S+ 0 0 46 -3,-1.0 -1,-0.2 -4,-0.8 -2,-0.2 0.740 105.4 51.8 -85.3 -27.8 9.4 30.7 14.8 48 49 A L H >< S+ 0 0 2 -4,-1.9 3,-0.5 -3,-0.2 4,-0.4 0.639 94.4 73.2 -82.2 -17.8 10.5 32.0 18.2 49 50 A H H >< S+ 0 0 103 -4,-0.7 3,-0.5 1,-0.2 5,-0.3 0.962 112.1 24.8 -61.1 -53.0 6.9 32.3 19.4 50 51 A G T 3< S+ 0 0 56 -4,-0.6 -1,-0.2 1,-0.2 3,-0.2 0.132 101.6 88.0 -99.6 19.6 6.4 28.6 19.8 51 52 A I T < S+ 0 0 32 -3,-0.5 2,-0.3 1,-0.3 -1,-0.2 0.561 95.9 40.0 -88.7 -8.8 10.1 27.9 20.3 52 53 A C S < S- 0 0 22 -3,-0.5 2,-2.9 -4,-0.4 -1,-0.3 -0.842 122.9 -60.8-152.7 107.1 9.5 28.4 24.0 53 54 A G 0 0 56 -2,-0.3 -3,-0.1 -3,-0.2 4,-0.1 -0.291 360.0 360.0 62.3 -63.9 6.6 27.4 26.2 54 55 A A 0 0 81 -2,-2.9 -1,-0.1 -5,-0.3 -4,-0.1 -0.454 360.0 360.0 70.0 360.0 3.8 29.3 24.3 55 ! 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 56 57 A V 0 0 43 0, 0.0 -2,-0.2 0, 0.0 24,-0.1 0.000 360.0 360.0 360.0 96.9 5.8 31.0 28.8 57 58 A T >> - 0 0 73 1,-0.1 4,-2.0 -4,-0.1 3,-1.2 -0.855 360.0-120.1-111.1 145.7 4.4 34.5 29.3 58 59 A P H 3> S+ 0 0 74 0, 0.0 4,-3.1 0, 0.0 5,-0.3 0.855 115.3 65.0 -52.7 -29.1 5.8 37.0 31.8 59 60 A E H 3> S+ 0 0 129 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.889 104.3 41.4 -58.6 -44.1 2.3 36.9 33.3 60 61 A S H <> S+ 0 0 31 -3,-1.2 4,-1.4 2,-0.2 -1,-0.2 0.850 113.8 55.7 -73.0 -34.7 2.8 33.2 34.2 61 62 A L H X S+ 0 0 25 -4,-2.0 4,-2.3 2,-0.2 3,-0.4 0.942 107.6 44.9 -64.6 -51.2 6.3 33.9 35.4 62 63 A K H X S+ 0 0 129 -4,-3.1 4,-1.7 1,-0.3 5,-0.3 0.959 111.5 55.9 -57.4 -47.7 5.5 36.7 37.9 63 64 A A H X S+ 0 0 39 -4,-1.6 4,-2.0 -5,-0.3 -1,-0.3 0.806 109.8 47.4 -52.3 -34.4 2.7 34.5 39.1 64 65 A A H X S+ 0 0 1 -4,-1.4 4,-3.8 -3,-0.4 5,-0.2 0.969 108.4 48.6 -73.9 -57.8 5.2 31.7 39.7 65 66 A A H X S+ 0 0 40 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.725 117.3 47.0 -56.5 -22.8 8.0 33.7 41.6 66 67 A A H X S+ 0 0 53 -4,-1.7 4,-1.0 -5,-0.3 -1,-0.2 0.910 111.7 47.1 -82.8 -51.0 5.1 35.0 43.7 67 68 A A H ><>S+ 0 0 11 -4,-2.0 5,-1.2 -5,-0.3 3,-0.6 0.909 116.0 49.3 -54.2 -42.0 3.5 31.7 44.3 68 69 A L H ><5S+ 0 0 4 -4,-3.8 3,-2.2 1,-0.2 -1,-0.2 0.909 103.7 55.9 -65.6 -45.9 7.0 30.4 45.1 69 70 A S H 3<5S+ 0 0 82 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.644 103.5 58.3 -64.3 -13.6 7.8 33.2 47.5 70 71 A A T <<5S- 0 0 83 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.229 120.9-107.7 -98.9 11.1 4.7 32.2 49.5 71 72 A G T < 5S+ 0 0 49 -3,-2.2 2,-2.1 1,-0.2 3,-0.2 0.237 82.1 129.2 83.1 -14.6 6.0 28.7 50.0 72 73 A D >< + 0 0 70 -5,-1.2 4,-1.7 1,-0.2 -1,-0.2 -0.489 20.9 160.5 -77.2 78.7 3.4 27.3 47.5 73 74 A V H > + 0 0 5 -2,-2.1 4,-2.3 2,-0.2 5,-0.2 0.919 68.8 59.6 -64.9 -44.9 5.8 25.3 45.4 74 75 A K H > S+ 0 0 87 -3,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.934 108.0 44.0 -48.6 -56.3 3.0 23.1 43.9 75 76 A K H > S+ 0 0 112 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.896 107.8 58.9 -58.4 -42.4 1.2 26.1 42.5 76 77 A A H >< S+ 0 0 0 -4,-1.7 3,-0.6 1,-0.3 -1,-0.2 0.920 109.3 45.4 -52.6 -43.8 4.5 27.5 41.2 77 78 A L H >< S+ 0 0 2 -4,-2.3 3,-1.2 1,-0.2 -1,-0.3 0.780 104.9 62.0 -70.2 -27.6 4.8 24.3 39.2 78 79 A S H 3< S+ 0 0 37 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.763 95.0 62.9 -69.6 -24.5 1.2 24.6 38.1 79 80 A L T << S+ 0 0 51 -4,-1.4 2,-0.5 -3,-0.6 -1,-0.2 0.425 91.6 73.9 -81.1 -1.0 2.0 27.8 36.3 80 81 A H S <> S- 0 0 35 -3,-1.2 4,-2.5 1,-0.2 5,-0.1 -0.971 78.2-140.4-114.1 130.2 4.4 26.1 34.0 81 82 A A H > S+ 0 0 68 -2,-0.5 4,-1.4 2,-0.2 -1,-0.2 0.945 96.2 42.5 -51.9 -64.7 2.9 24.0 31.2 82 83 A S H > S+ 0 0 36 1,-0.2 4,-0.8 2,-0.2 3,-0.4 0.910 120.8 42.0 -52.7 -49.5 5.2 21.0 31.1 83 84 A T H 4 S+ 0 0 6 1,-0.2 3,-0.3 2,-0.2 4,-0.3 0.840 106.9 64.7 -68.4 -33.9 5.5 20.7 34.9 84 85 A K H < S+ 0 0 124 -4,-2.5 4,-0.3 1,-0.2 3,-0.3 0.814 104.5 43.3 -60.7 -33.4 1.8 21.3 35.3 85 86 A E H < S+ 0 0 77 -4,-1.4 4,-0.3 -3,-0.4 -1,-0.2 0.701 112.6 50.6 -88.6 -17.5 0.7 18.1 33.6 86 87 A R S < S+ 0 0 14 -4,-0.8 -1,-0.2 -3,-0.3 -2,-0.2 0.330 90.9 92.9 -95.5 5.4 3.4 15.9 35.2 87 88 A L S > S+ 0 0 30 -3,-0.3 3,-1.3 -4,-0.3 4,-0.3 0.893 76.6 51.5 -66.8 -48.4 2.2 17.3 38.5 88 89 A A T 3 S+ 0 0 97 -4,-0.3 3,-0.3 1,-0.3 4,-0.2 0.911 122.0 31.3 -60.0 -47.1 -0.4 14.8 39.5 89 90 A E T 3> S+ 0 0 90 -4,-0.3 4,-1.6 1,-0.2 -1,-0.3 -0.111 87.9 119.0-103.3 36.9 1.8 11.7 39.1 90 91 A L H <> S+ 0 0 11 -3,-1.3 4,-1.9 2,-0.2 -1,-0.2 0.930 74.4 43.6 -67.8 -47.9 4.9 13.7 40.0 91 92 A D H > S+ 0 0 87 -4,-0.3 4,-1.9 -3,-0.3 5,-0.2 0.886 112.3 52.3 -67.3 -39.0 6.0 11.7 43.0 92 93 A T H > S+ 0 0 67 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.915 109.0 54.6 -60.8 -41.0 5.3 8.3 41.3 93 94 A L H X S+ 0 0 2 -4,-1.6 4,-1.8 1,-0.2 -2,-0.2 0.915 110.0 42.3 -60.0 -48.0 7.5 9.6 38.5 94 95 A Y H X S+ 0 0 1 -4,-1.9 4,-3.1 2,-0.2 -1,-0.2 0.760 109.8 57.3 -75.0 -22.3 10.5 10.4 40.7 95 96 A D H X S+ 0 0 84 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.929 108.0 49.3 -69.1 -42.4 10.2 7.2 42.7 96 97 A F H < S+ 0 0 14 -4,-2.1 4,-0.3 -5,-0.2 -2,-0.2 0.915 116.4 42.7 -59.6 -43.9 10.5 5.4 39.4 97 98 A I H < S+ 0 0 11 -4,-1.8 4,-0.4 1,-0.2 3,-0.3 0.924 122.8 34.4 -70.7 -47.2 13.5 7.5 38.5 98 99 A F H < S+ 0 0 12 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.525 86.7 106.2 -87.8 -7.0 15.4 7.4 41.9 99 100 A S S < S+ 0 0 86 -4,-1.8 -1,-0.2 -5,-0.2 3,-0.2 0.838 91.0 28.6 -38.0 -55.3 14.2 3.9 42.8 100 101 A A S S+ 0 0 84 -4,-0.3 2,-0.4 -3,-0.3 -1,-0.2 0.957 136.4 7.0 -76.2 -55.1 17.7 2.3 42.2 101 102 A E - 0 0 113 -4,-0.4 -1,-0.3 2,-0.0 -2,-0.1 -0.979 61.4-147.6-137.9 125.1 20.0 5.2 42.9 102 103 A T - 0 0 103 -2,-0.4 2,-0.1 -3,-0.2 -4,-0.1 -0.825 28.4-133.2 -92.8 121.0 19.3 8.7 44.3 103 104 A P - 0 0 14 0, 0.0 21,-0.4 0, 0.0 3,-0.2 -0.350 16.0-158.0 -74.1 149.1 21.7 11.3 42.7 104 105 A R S S+ 0 0 144 1,-0.3 21,-3.0 19,-0.1 2,-0.5 0.830 89.5 31.0 -91.2 -42.3 23.7 13.9 44.6 105 106 A R E S-b 125 0B 38 19,-0.2 62,-2.2 18,-0.1 63,-1.7 -0.968 72.6-171.8-124.7 121.4 24.1 16.1 41.5 106 107 A V E -bc 126 168B 0 19,-2.3 21,-2.5 -2,-0.5 2,-0.8 -0.883 17.0-147.3-112.6 141.2 21.5 16.2 38.6 107 108 A L E -bc 127 169B 0 61,-3.0 63,-2.4 -2,-0.4 2,-1.1 -0.871 15.1-162.3-108.0 98.7 21.8 17.9 35.2 108 109 A D E > -bc 128 170B 2 19,-2.0 21,-1.9 -2,-0.8 3,-1.0 -0.712 8.6-156.3 -85.8 98.4 18.3 19.1 34.3 109 110 A I E 3 S-b 129 0B 1 61,-1.9 63,-0.5 -2,-1.1 21,-0.1 -0.621 79.7 -0.8 -79.6 126.5 18.4 19.7 30.5 110 111 A A T 3 S- 0 0 32 19,-1.0 -1,-0.3 -2,-0.4 20,-0.2 0.938 91.5-179.6 57.3 45.8 15.7 22.2 29.3 111 112 A C X + 0 0 6 18,-1.7 3,-1.1 -3,-1.0 2,-0.2 0.807 5.5 178.6 -46.9 -49.6 14.8 22.2 33.0 112 113 A G T 3 S- 0 0 2 1,-0.2 -1,-0.2 17,-0.2 -2,-0.1 -0.518 70.9 -34.6 72.6-144.0 11.9 24.6 32.9 113 114 A L T > S+ 0 0 6 1,-0.2 3,-2.3 -2,-0.2 4,-0.5 0.574 114.1 103.4 -87.7 -8.2 10.4 25.0 36.4 114 115 A N T X> + 0 0 2 -3,-1.1 4,-1.5 1,-0.3 3,-1.2 0.786 60.1 75.9 -43.1 -41.6 11.1 21.3 37.2 115 116 A P H 3> S+ 0 0 0 0, 0.0 4,-1.7 0, 0.0 -1,-0.3 0.853 89.0 60.7 -43.8 -36.6 14.2 22.2 39.4 116 117 A L H <> S+ 0 0 0 -3,-2.3 4,-1.8 1,-0.3 3,-0.5 0.937 101.5 51.7 -56.3 -46.5 11.7 23.2 42.1 117 118 A A H <4 S+ 0 0 6 -3,-1.2 -1,-0.3 -4,-0.5 -3,-0.1 0.839 106.8 55.6 -58.8 -32.8 10.3 19.7 42.1 118 119 A L H ><>S+ 0 0 0 -4,-1.5 5,-1.7 -3,-0.2 3,-1.3 0.848 101.8 55.8 -69.8 -33.9 13.9 18.5 42.5 119 120 A Y H ><5S+ 0 0 75 -4,-1.7 3,-3.3 -3,-0.5 -2,-0.2 0.985 104.5 52.6 -59.8 -55.7 14.4 20.6 45.6 120 121 A E T 3<5S+ 0 0 104 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.411 102.0 62.2 -61.8 4.5 11.4 19.0 47.3 121 122 A R T < 5S- 0 0 64 -3,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.390 114.7-116.9-107.6 -1.5 13.1 15.7 46.5 122 123 A G T < 5 + 0 0 68 -3,-3.3 2,-0.4 1,-0.3 -3,-0.2 0.756 53.8 165.0 73.0 24.3 16.0 16.6 48.7 123 124 A I < - 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