==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-JUN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 30-MAR-12 4EGG . COMPND 2 MOLECULE: PUTATIVE ACETYLTRANSFERASE SACOL2570; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS SUBSP. AUREUS; . AUTHOR M.R.SAWAYA,N.P.KING,W.SHEFFLER,D.BAKER,T.O.YEATES . 1127 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 41865.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 877 77.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 260 23.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 72 6.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.5 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 . 172 15.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 71 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 200 17.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 2.1 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 4 2 6 0 0 0 0 0 6 0 0 0 0 0 6 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 40 32 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 12 0 6 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 . 12 0 0 12 0 6 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 0 135 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 146.6 -13.3 70.6 48.3 2 2 A T > - 0 0 80 1,-0.1 4,-2.5 11,-0.0 5,-0.1 -0.232 360.0-101.6 -77.1 175.7 -13.7 66.8 48.5 3 3 A E H > S+ 0 0 33 2,-0.2 4,-2.4 1,-0.2 5,-0.1 0.877 126.3 51.4 -68.5 -34.7 -12.7 64.6 45.5 4 4 A K H > S+ 0 0 62 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.910 111.1 47.4 -64.0 -46.5 -16.4 64.3 44.5 5 5 A E H > S+ 0 0 102 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.931 112.4 50.0 -59.9 -47.1 -16.8 68.1 44.7 6 6 A K H <>S+ 0 0 59 -4,-2.5 5,-2.5 1,-0.2 -2,-0.2 0.887 110.5 50.7 -56.6 -44.5 -13.5 68.5 42.6 7 7 A M H ><5S+ 0 0 2 -4,-2.4 3,-1.0 1,-0.2 121,-0.3 0.903 113.0 44.7 -57.7 -49.5 -15.0 66.0 40.0 8 8 A L H 3<5S+ 0 0 82 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.772 109.0 56.5 -68.4 -28.7 -18.3 68.0 39.8 9 9 A A T 3<5S- 0 0 49 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.286 116.2-114.0 -83.8 4.2 -16.4 71.3 39.5 10 10 A E T < 5S+ 0 0 108 -3,-1.0 2,-0.2 1,-0.2 -3,-0.2 0.845 73.5 134.4 61.3 38.1 -14.5 70.0 36.4 11 11 A K < - 0 0 107 -5,-2.5 117,-0.5 -6,-0.1 2,-0.3 -0.627 68.7 -80.8-108.1 167.3 -11.2 70.1 38.4 12 12 A W + 0 0 109 -2,-0.2 2,-0.3 115,-0.1 115,-0.2 -0.555 60.7 173.3 -69.3 129.0 -8.3 67.4 38.6 13 13 A Y E -A 126 0A 3 113,-2.6 113,-2.3 -2,-0.3 2,-1.5 -0.978 44.8-104.6-141.6 153.3 -9.4 64.8 41.2 14 14 A D E > +A 125 0A 38 -2,-0.3 4,-0.9 111,-0.2 111,-0.2 -0.664 49.0 163.5 -80.5 89.0 -8.3 61.5 42.5 15 15 A A T 4 + 0 0 0 -2,-1.5 -1,-0.2 109,-1.3 110,-0.1 0.828 69.1 45.0 -73.8 -42.9 -10.8 59.3 40.7 16 16 A N T 4 S+ 0 0 35 108,-1.2 -1,-0.1 -3,-0.2 108,-0.1 0.710 123.3 30.9 -79.6 -24.9 -9.2 55.9 41.1 17 17 A F T 4 S+ 0 0 83 107,-0.2 2,-0.5 106,-0.1 -2,-0.2 0.487 81.8 110.7-117.2 -6.3 -8.2 56.1 44.8 18 18 A D X - 0 0 33 -4,-0.9 4,-2.2 1,-0.1 5,-0.2 -0.637 58.4-147.4 -75.0 122.5 -10.8 58.3 46.6 19 19 A Q H > S+ 0 0 123 -2,-0.5 4,-2.2 1,-0.2 -1,-0.1 0.836 94.2 51.8 -57.8 -42.7 -12.8 55.9 48.9 20 20 A T H > S+ 0 0 78 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.926 112.9 44.2 -60.5 -51.2 -16.2 57.8 48.6 21 21 A L H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.888 112.3 52.8 -64.0 -40.1 -16.1 57.8 44.7 22 22 A I H X S+ 0 0 52 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.903 112.0 47.1 -56.5 -47.6 -15.0 54.1 44.7 23 23 A N H X S+ 0 0 85 -4,-2.2 4,-1.3 2,-0.2 -2,-0.2 0.808 110.9 49.8 -69.7 -31.6 -18.0 53.3 46.9 24 24 A E H X S+ 0 0 20 -4,-1.9 4,-1.5 2,-0.2 -1,-0.2 0.796 110.9 50.8 -76.4 -32.9 -20.5 55.4 44.8 25 25 A R H X S+ 0 0 46 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.872 105.1 57.1 -67.9 -36.6 -19.2 53.5 41.7 26 26 A L H X S+ 0 0 55 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.899 104.1 52.7 -60.2 -42.7 -19.7 50.2 43.5 27 27 A R H X S+ 0 0 106 -4,-1.3 4,-2.1 1,-0.2 -1,-0.2 0.920 110.8 46.8 -59.5 -48.0 -23.5 51.2 44.0 28 28 A A H X S+ 0 0 1 -4,-1.5 4,-2.4 42,-0.4 -1,-0.2 0.865 113.2 48.8 -62.8 -39.8 -23.8 51.8 40.2 29 29 A K H X S+ 0 0 35 -4,-2.3 4,-2.3 41,-0.2 -2,-0.2 0.859 110.2 51.6 -69.1 -34.3 -22.0 48.5 39.4 30 30 A V H X S+ 0 0 46 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.914 113.4 43.8 -66.4 -45.1 -24.2 46.5 41.8 31 31 A I H X S+ 0 0 33 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.927 115.3 49.0 -66.3 -43.8 -27.4 48.0 40.2 32 32 A C H X S+ 0 0 3 -4,-2.4 4,-2.6 1,-0.2 35,-0.2 0.881 110.7 51.5 -61.9 -42.2 -26.0 47.4 36.7 33 33 A F H X S+ 0 0 30 -4,-2.3 4,-0.8 2,-0.2 -2,-0.2 0.935 110.5 47.4 -60.3 -45.8 -25.1 43.8 37.7 34 34 A A H < S+ 0 0 42 -4,-2.2 3,-0.4 1,-0.2 -2,-0.2 0.890 115.3 46.2 -63.9 -40.9 -28.7 43.2 38.9 35 35 A L H >< S+ 0 0 1 -4,-2.2 3,-1.3 1,-0.2 -1,-0.2 0.853 109.4 53.6 -68.3 -39.6 -30.1 44.7 35.7 36 36 A N H 3< S+ 0 0 29 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.598 111.9 46.1 -71.7 -14.4 -27.7 42.7 33.4 37 37 A H T 3< S+ 0 0 58 -4,-0.8 2,-0.5 -3,-0.4 -1,-0.2 0.135 88.4 107.8-112.3 13.8 -28.8 39.5 35.1 38 38 A T S < S- 0 0 20 -3,-1.3 27,-0.1 -5,-0.1 -3,-0.0 -0.828 78.2-114.8 -94.1 127.1 -32.6 40.3 34.9 39 39 A N > - 0 0 60 -2,-0.5 3,-1.9 1,-0.1 7,-0.2 -0.347 22.3-121.4 -57.7 138.7 -34.5 38.2 32.3 40 40 A P T 3 S+ 0 0 15 0, 0.0 -1,-0.1 0, 0.0 368,-0.1 0.731 112.4 65.7 -57.1 -22.8 -35.9 40.4 29.5 41 41 A V T 3 S+ 0 0 92 1,-0.2 2,-2.1 363,-0.1 3,-0.2 0.777 79.5 85.6 -66.8 -29.6 -39.4 39.2 30.4 42 42 A A <> + 0 0 34 -3,-1.9 4,-2.4 1,-0.2 -1,-0.2 -0.415 54.0 161.2 -79.5 68.0 -39.1 41.0 33.9 43 43 A T H > + 0 0 107 -2,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.852 69.8 44.0 -54.5 -51.3 -40.4 44.4 32.6 44 44 A M H > S+ 0 0 127 -3,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.884 113.2 51.4 -69.3 -40.2 -41.4 46.0 35.9 45 45 A M H > S+ 0 0 102 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.919 110.5 49.6 -61.6 -43.3 -38.2 44.8 37.7 46 46 A R H X S+ 0 0 32 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.929 110.8 50.5 -59.6 -44.1 -36.0 46.3 34.8 47 47 A K H X S+ 0 0 62 -4,-2.0 4,-2.4 1,-0.2 11,-0.2 0.896 110.5 48.8 -58.7 -47.9 -38.0 49.6 35.1 48 48 A V H X S+ 0 0 75 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.904 113.9 46.6 -60.3 -46.1 -37.4 49.6 38.9 49 49 A L H X S+ 0 0 26 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.867 112.2 48.9 -63.3 -43.5 -33.6 48.9 38.4 50 50 A I H X S+ 0 0 10 -4,-2.5 4,-2.2 2,-0.2 5,-0.2 0.922 114.5 47.1 -61.6 -47.4 -33.2 51.6 35.6 51 51 A D H X>S+ 0 0 29 -4,-2.4 5,-1.4 1,-0.2 4,-1.0 0.877 111.7 49.7 -65.0 -39.0 -35.1 54.1 37.9 52 52 A A H <5S+ 0 0 50 -4,-2.3 -1,-0.2 3,-0.2 -2,-0.2 0.879 112.8 49.2 -66.7 -35.6 -32.9 53.2 41.0 53 53 A L H <5S+ 0 0 4 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.936 118.6 34.9 -66.9 -55.1 -29.7 53.6 38.8 54 54 A F H <5S- 0 0 8 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.537 103.2-131.0 -78.3 -9.6 -30.5 57.0 37.3 55 55 A Q T <5S+ 0 0 116 -4,-1.0 2,-0.3 1,-0.2 -3,-0.2 0.863 75.3 92.4 55.0 43.9 -32.2 58.1 40.6 56 56 A T S S+ 0 0 0 17,-0.3 3,-1.6 1,-0.1 -19,-0.1 -0.384 84.8 73.8 82.5 -55.2 -25.8 56.6 37.3 73 73 A W T 3 S+ 0 0 37 -2,-1.5 -1,-0.1 1,-0.3 -19,-0.1 0.586 88.4 63.2 -65.4 -11.3 -27.0 59.7 39.1 74 74 A N T 3 S+ 0 0 7 19,-0.1 21,-2.4 2,-0.0 2,-0.6 0.179 80.9 91.5 -99.0 15.1 -24.8 61.8 36.7 75 75 A V E < -l 95 0D 3 -3,-1.6 2,-0.6 19,-0.2 21,-0.2 -0.956 63.2-160.7-108.9 108.1 -26.7 60.8 33.6 76 76 A K E -l 96 0D 82 19,-3.3 21,-2.9 -2,-0.6 2,-0.3 -0.866 16.1-165.6 -94.2 121.3 -29.6 63.4 32.9 77 77 A L - 0 0 41 -2,-0.6 21,-0.2 19,-0.2 22,-0.1 -0.764 15.8-157.0-111.2 156.3 -32.2 61.9 30.6 78 78 A G - 0 0 17 20,-1.0 -19,-0.5 -2,-0.3 2,-0.3 -0.177 44.5 -71.3-103.6-161.8 -35.1 63.1 28.6 79 79 A K S S+ 0 0 100 1,-0.2 21,-2.3 -2,-0.1 -19,-0.2 -0.753 108.0 25.1 -96.6 150.3 -38.2 61.2 27.4 80 80 A N S S+ 0 0 32 -21,-2.1 21,-2.0 -2,-0.3 2,-0.5 0.999 70.4 164.3 62.8 70.4 -37.9 58.5 24.6 81 81 A V E -bc 61 101B 0 -21,-1.6 -19,-2.1 19,-0.2 2,-0.7 -0.990 19.2-163.2-120.3 117.0 -34.2 57.4 24.9 82 82 A Y E -bc 62 102B 20 19,-2.8 21,-3.4 -2,-0.5 2,-0.6 -0.922 7.7-175.3-110.0 106.6 -33.5 54.1 23.1 83 83 A V E -bc 63 103B 6 -21,-3.1 -19,-2.3 -2,-0.7 21,-0.2 -0.922 10.3-153.5-107.6 113.8 -30.2 52.5 24.1 84 84 A N - 0 0 34 19,-2.6 3,-0.4 -2,-0.6 23,-0.1 -0.097 41.4 -49.1 -78.7-180.0 -29.1 49.3 22.3 85 85 A T S S+ 0 0 5 1,-0.2 21,-2.7 -20,-0.1 22,-0.3 -0.128 113.3 11.8 -54.8 141.5 -26.9 46.5 23.6 86 86 A N S S+ 0 0 7 -20,-1.4 2,-0.3 -22,-0.4 -1,-0.2 0.880 78.2 160.1 59.4 51.6 -23.5 47.1 25.3 87 87 A C E -h 67 0C 0 -21,-0.9 -19,-2.0 -3,-0.4 2,-0.4 -0.741 24.1-157.3-103.5 147.2 -23.6 50.8 25.9 88 88 A Y E -hi 68 108C 1 19,-2.0 21,-3.3 -2,-0.3 2,-0.9 -0.956 9.3-169.6-129.4 113.7 -21.4 52.6 28.5 89 89 A F E -hi 69 109C 2 -21,-2.6 2,-1.2 -2,-0.4 -19,-1.2 -0.833 8.9-167.4-100.0 92.6 -22.2 56.0 30.0 90 90 A M E + i 0 110C 15 19,-2.4 21,-1.0 -2,-0.9 3,-0.4 -0.716 16.7 175.5 -84.8 93.6 -18.9 56.9 31.8 91 91 A D + 0 0 0 -2,-1.2 4,-0.2 1,-0.2 -1,-0.1 -0.092 40.2 118.3-107.1 32.5 -20.5 59.8 33.8 92 92 A G S S+ 0 0 4 2,-0.1 2,-0.4 35,-0.1 -1,-0.2 0.893 91.5 48.9 -55.8 -35.6 -17.9 61.3 36.3 93 93 A G S S- 0 0 3 -3,-0.4 38,-0.2 36,-0.2 36,-0.1 -0.847 119.1 -92.5 -99.0 134.0 -18.7 64.3 34.0 94 94 A Q - 0 0 69 -2,-0.4 37,-2.1 -86,-0.1 2,-0.6 -0.241 33.1-152.0 -53.7 131.5 -22.4 64.9 33.5 95 95 A I E -lm 75 131D 0 -21,-2.4 -19,-3.3 35,-0.2 2,-0.5 -0.930 11.2-165.8-105.6 114.4 -24.0 63.2 30.5 96 96 A T E -lm 76 132D 41 35,-2.8 37,-3.4 -2,-0.6 2,-0.5 -0.928 6.5-177.3-104.7 122.5 -27.1 65.1 29.3 97 97 A I E - m 0 133D 3 -21,-2.9 37,-0.2 -2,-0.5 -19,-0.1 -0.995 11.8-152.6-120.8 123.7 -29.4 63.3 26.9 98 98 A G - 0 0 15 35,-2.0 -20,-1.0 -2,-0.5 2,-0.3 0.333 37.3 -60.9 -73.9-155.4 -32.4 65.2 25.5 99 99 A D S S+ 0 0 61 -21,-0.2 37,-2.8 1,-0.2 -19,-0.2 -0.763 110.3 19.3 -98.3 146.1 -35.7 63.8 24.3 100 100 A N S S+ 0 0 26 -21,-2.3 37,-0.7 -20,-0.5 2,-0.4 0.990 77.6 162.8 62.9 65.7 -36.1 61.3 21.3 101 101 A V E -cd 81 137B 0 -21,-2.0 -19,-2.8 -3,-0.2 2,-0.6 -0.983 26.2-158.8-120.9 126.4 -32.5 59.9 21.2 102 102 A F E -cd 82 138B 7 35,-2.0 37,-3.2 -2,-0.4 2,-0.6 -0.938 10.6-172.9-107.7 112.5 -31.6 56.7 19.4 103 103 A I E -cd 83 139B 4 -21,-3.4 -19,-2.6 -2,-0.6 37,-0.1 -0.961 14.3-144.3-113.7 114.5 -28.3 55.2 20.6 104 104 A G > - 0 0 12 35,-1.5 3,-0.5 -2,-0.6 -20,-0.2 0.020 34.5 -70.6 -68.6 176.4 -27.1 52.2 18.6 105 105 A P T 3 S+ 0 0 2 0, 0.0 37,-2.5 0, 0.0 38,-0.3 -0.347 110.4 21.4 -73.2 156.0 -25.2 49.1 20.0 106 106 A N T 3 S+ 0 0 6 -21,-2.7 2,-0.4 35,-0.2 -19,-0.2 0.835 83.6 152.9 59.6 39.9 -21.6 49.2 21.3 107 107 A C < - 0 0 1 -3,-0.5 -19,-2.0 -22,-0.3 2,-0.4 -0.819 28.2-159.7-102.3 140.9 -21.6 53.0 22.0 108 108 A G E -ij 88 144C 0 35,-2.2 37,-2.9 -2,-0.4 2,-0.8 -0.980 10.0-163.9-125.0 124.8 -19.4 54.6 24.6 109 109 A F E -ij 89 145C 0 -21,-3.3 -19,-2.4 -2,-0.4 2,-0.5 -0.894 21.7-170.5-107.0 99.9 -20.0 58.1 26.1 110 110 A Y E +i 90 0C 10 35,-2.7 -19,-0.1 -2,-0.8 -21,-0.1 -0.853 26.2 163.7-102.9 119.8 -16.7 58.9 27.8 111 111 A T + 0 0 1 -21,-1.0 18,-2.5 -2,-0.5 2,-0.5 0.465 46.3 108.8-108.8 -6.2 -16.2 61.9 30.1 112 112 A A E -P 128 0E 19 16,-0.2 2,-0.5 -22,-0.1 16,-0.2 -0.619 42.2-176.1 -82.6 121.6 -12.9 60.8 31.7 113 113 A T E -P 127 0E 52 14,-2.3 14,-2.1 -2,-0.5 -2,-0.0 -0.957 6.8-164.3-109.3 130.8 -9.6 62.6 30.8 114 114 A H - 0 0 23 -2,-0.5 12,-0.2 12,-0.2 7,-0.1 -0.825 33.8 -94.9-103.9 154.7 -6.4 61.2 32.3 115 115 A P - 0 0 13 0, 0.0 6,-0.1 0, 0.0 -1,-0.1 -0.360 22.7-136.9 -66.4 149.6 -3.2 63.4 32.3 116 116 A L S S+ 0 0 56 5,-0.0 2,-0.4 4,-0.0 257,-0.1 0.831 88.2 82.6 -73.1 -33.6 -0.8 62.8 29.4 117 117 A N S > S- 0 0 26 1,-0.1 4,-1.9 4,-0.0 3,-0.4 -0.599 78.2-144.6 -72.8 122.4 2.2 62.8 31.8 118 118 A F H > S+ 0 0 27 -2,-0.4 4,-2.9 1,-0.2 5,-0.2 0.757 93.4 63.7 -63.4 -26.6 2.4 59.3 33.4 119 119 A H H 4 S+ 0 0 53 2,-0.2 4,-0.5 1,-0.2 -1,-0.2 0.901 111.4 36.2 -63.6 -43.1 3.6 60.7 36.9 120 120 A H H 4>S+ 0 0 93 -3,-0.4 5,-1.1 2,-0.2 3,-0.4 0.855 118.1 51.5 -75.2 -40.9 0.3 62.5 37.4 121 121 A R H ><5S+ 0 0 0 -4,-1.9 3,-2.2 1,-0.2 -2,-0.2 0.912 104.8 55.5 -62.5 -45.4 -1.8 59.8 35.7 122 122 A N T 3<5S+ 0 0 31 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.710 98.3 65.6 -61.3 -20.9 -0.2 57.0 37.9 123 123 A E T 3 5S- 0 0 107 -4,-0.5 -1,-0.3 -3,-0.4 -2,-0.2 0.481 120.4-108.7 -77.6 -6.6 -1.4 59.0 41.0 124 124 A G T < 5 + 0 0 0 -3,-2.2 -109,-1.3 1,-0.3 -108,-1.2 0.338 64.6 155.2 93.7 -2.3 -5.1 58.4 39.9 125 125 A F E < +A 14 0A 65 -5,-1.1 2,-0.3 -111,-0.2 -1,-0.3 -0.309 11.2 165.4 -62.7 136.2 -5.8 61.9 38.8 126 126 A E E -A 13 0A 20 -113,-2.3 -113,-2.6 -12,-0.2 2,-0.4 -0.924 26.7-143.9-141.9 163.5 -8.6 62.6 36.2 127 127 A K E -P 113 0E 83 -14,-2.1 -14,-2.3 -2,-0.3 2,-0.4 -0.999 20.0-135.3-132.0 131.1 -10.6 65.5 34.9 128 128 A A E -P 112 0E 4 -117,-0.5 -16,-0.2 -2,-0.4 -34,-0.1 -0.757 14.4-167.9 -91.7 129.6 -14.3 65.1 34.0 129 129 A G - 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