==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 16-JUL-03 1OJZ . COMPND 2 MOLECULE: ADP-RIBOSYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS; . AUTHOR H.R.EVANS,J.M.SUTTON,D.E.HOLLOWAY,J.AYRISS,C.C.SHONE, . 212 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10822.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 163 76.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 4.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 36 17.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 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 . 1 0.5 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 . 1 0.5 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 . 27 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 56 26.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 0 0 1 0 1 0 1 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 PARALLEL BRIDGES PER LADDER . 3 1 0 2 0 0 2 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 1 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 A 0 0 124 0, 0.0 79,-0.2 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 153.4 -6.7 16.6 -14.2 2 2 A E - 0 0 160 1,-0.2 78,-0.1 77,-0.1 0, 0.0 -0.477 360.0 -69.7 -95.5 166.8 -6.8 17.2 -10.4 3 3 A T - 0 0 53 -2,-0.2 78,-0.3 76,-0.1 2,-0.2 -0.209 49.7-126.7 -55.9 138.0 -5.9 15.0 -7.5 4 4 A K B +a 81 0A 85 76,-2.6 78,-2.0 -3,-0.1 2,-0.3 -0.605 25.6 178.8 -88.8 147.0 -8.2 12.0 -6.8 5 5 A N - 0 0 77 -2,-0.2 2,-0.3 76,-0.2 137,-0.1 -0.845 19.5-149.6-148.9 104.9 -9.7 11.3 -3.4 6 6 A F + 0 0 16 135,-0.6 137,-0.5 76,-0.4 3,-0.1 -0.622 35.4 154.6 -87.2 136.2 -12.0 8.3 -3.3 7 7 A T + 0 0 123 -2,-0.3 2,-0.5 135,-0.1 -1,-0.1 0.360 65.0 76.5-128.2 -14.6 -15.0 7.9 -1.1 8 8 A D > - 0 0 77 1,-0.1 4,-1.9 2,-0.0 5,-0.1 -0.906 67.9-152.5-105.8 125.1 -16.8 5.4 -3.3 9 9 A L H > S+ 0 0 90 -2,-0.5 4,-2.8 1,-0.2 5,-0.2 0.871 94.4 54.0 -62.9 -39.7 -15.5 1.8 -3.3 10 10 A V H > S+ 0 0 106 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.908 109.9 46.5 -63.6 -41.7 -16.7 1.1 -6.9 11 11 A E H > S+ 0 0 100 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.887 113.8 49.7 -67.0 -38.1 -14.8 4.1 -8.3 12 12 A A H X S+ 0 0 0 -4,-1.9 4,-3.6 2,-0.2 -2,-0.2 0.925 109.9 50.0 -65.1 -46.9 -11.7 3.1 -6.3 13 13 A T H X S+ 0 0 49 -4,-2.8 4,-2.9 2,-0.2 -2,-0.2 0.918 111.2 49.6 -58.1 -45.0 -11.8 -0.5 -7.5 14 14 A K H X S+ 0 0 154 -4,-2.2 4,-1.1 2,-0.2 -1,-0.2 0.930 114.3 44.6 -60.4 -46.8 -12.2 0.7 -11.1 15 15 A W H >X S+ 0 0 23 -4,-2.3 4,-0.9 1,-0.2 3,-0.5 0.936 114.8 49.0 -64.3 -45.8 -9.2 3.0 -10.7 16 16 A G H >X S+ 0 0 0 -4,-3.6 4,-2.0 1,-0.2 3,-0.9 0.894 103.0 59.7 -61.7 -41.7 -7.1 0.4 -8.9 17 17 A N H 3X S+ 0 0 72 -4,-2.9 4,-2.9 1,-0.3 -1,-0.2 0.829 97.5 61.6 -56.8 -32.5 -7.8 -2.3 -11.4 18 18 A S H S+ 0 0 26 -4,-2.0 4,-1.3 1,-0.2 5,-0.5 0.917 111.3 47.9 -58.5 -44.1 -3.3 -4.0 -11.7 21 21 A K H <5S+ 0 0 170 -4,-2.9 3,-0.2 1,-0.2 -1,-0.2 0.894 111.7 48.7 -64.7 -41.8 -3.7 -4.3 -15.5 22 22 A S H <5S+ 0 0 66 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.773 104.5 63.4 -69.2 -25.1 -0.8 -2.0 -16.3 23 23 A A H <5S- 0 0 6 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.891 82.1-159.6 -66.6 -41.6 1.3 -4.1 -13.8 24 24 A K T <5 - 0 0 172 -4,-1.3 -3,-0.1 -3,-0.2 -2,-0.1 0.961 20.3-154.5 56.9 52.6 1.0 -7.3 -15.8 25 25 A Y < - 0 0 27 -5,-0.5 2,-0.2 1,-0.1 -1,-0.1 -0.249 6.1-148.4 -60.4 143.3 1.9 -9.4 -12.7 26 26 A S > - 0 0 50 -3,-0.1 4,-2.4 1,-0.0 3,-0.2 -0.446 37.6 -93.4-100.4 178.9 3.5 -12.8 -13.1 27 27 A S H > S+ 0 0 90 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.860 129.6 55.4 -63.3 -32.7 3.0 -15.7 -10.7 28 28 A K H > S+ 0 0 107 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.853 107.6 48.6 -67.4 -34.9 6.1 -14.5 -8.9 29 29 A D H > S+ 0 0 3 -3,-0.2 4,-2.4 2,-0.2 5,-0.2 0.938 110.8 49.8 -69.4 -47.7 4.6 -11.1 -8.5 30 30 A K H X S+ 0 0 87 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.869 110.3 50.9 -58.9 -39.2 1.3 -12.4 -7.2 31 31 A M H X S+ 0 0 113 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.896 109.7 49.7 -66.6 -41.5 3.1 -14.6 -4.7 32 32 A A H X S+ 0 0 20 -4,-1.6 4,-1.5 2,-0.2 -2,-0.2 0.933 114.3 44.0 -64.2 -47.6 5.2 -11.8 -3.3 33 33 A I H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 3,-0.2 0.964 115.7 46.9 -63.2 -52.1 2.2 -9.5 -2.8 34 34 A Y H X S+ 0 0 81 -4,-2.5 4,-2.0 1,-0.2 140,-0.4 0.939 111.9 48.9 -55.9 -54.2 0.0 -12.2 -1.3 35 35 A N H X S+ 0 0 77 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.813 110.8 52.6 -58.1 -30.9 2.6 -13.5 1.1 36 36 A Y H < S+ 0 0 11 -4,-1.5 -1,-0.2 -3,-0.2 -2,-0.2 0.939 108.9 47.6 -71.2 -46.3 3.4 -9.9 2.3 37 37 A T H < S+ 0 0 20 -4,-2.3 3,-0.2 135,-0.3 -2,-0.2 0.815 118.4 43.2 -63.3 -30.2 -0.2 -9.1 3.0 38 38 A K H < S+ 0 0 115 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.835 135.6 6.6 -84.8 -35.3 -0.6 -12.4 4.9 39 39 A N < + 0 0 94 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 -0.591 69.6 149.5-152.7 80.0 2.7 -12.4 6.9 40 40 A S >> + 0 0 37 -3,-0.2 4,-2.5 -4,-0.2 3,-1.6 0.620 52.9 86.1 -91.7 -15.1 4.7 -9.1 6.5 41 41 A S H 3> S+ 0 0 64 1,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.870 82.0 61.5 -56.1 -39.6 6.5 -9.0 9.9 42 42 A P H 34 S+ 0 0 50 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.760 117.2 32.6 -59.5 -21.7 9.4 -11.2 8.8 43 43 A I H <> S+ 0 0 12 -3,-1.6 4,-1.4 -4,-0.1 -2,-0.2 0.872 121.2 40.1-100.6 -52.5 10.2 -8.5 6.2 44 44 A N H X S+ 0 0 18 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.806 108.4 59.7 -73.5 -29.1 9.3 -5.1 7.6 45 45 A T H X S+ 0 0 74 -4,-1.6 4,-2.4 -5,-0.4 -1,-0.2 0.965 110.1 41.4 -64.6 -51.1 10.6 -5.6 11.2 46 46 A P H > S+ 0 0 36 0, 0.0 4,-1.0 0, 0.0 -1,-0.2 0.868 114.2 54.0 -64.3 -33.3 14.2 -6.3 10.1 47 47 A L H >< S+ 0 0 0 -4,-1.4 3,-0.7 1,-0.2 6,-0.3 0.941 111.1 45.0 -64.3 -45.3 13.9 -3.5 7.5 48 48 A R H >< S+ 0 0 100 -4,-2.7 3,-1.2 1,-0.2 -1,-0.2 0.872 107.8 59.0 -66.2 -34.8 12.9 -1.1 10.3 49 49 A S H 3< S+ 0 0 102 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.722 117.6 31.0 -67.0 -21.2 15.6 -2.4 12.6 50 50 A A T X< S- 0 0 22 -4,-1.0 3,-1.9 -3,-0.7 -1,-0.3 -0.085 108.5-118.3-128.5 37.6 18.3 -1.5 10.1 51 51 A N T < S- 0 0 111 -3,-1.2 -1,-0.5 1,-0.3 -2,-0.1 -0.200 73.9 -37.0 54.1-154.6 16.8 1.6 8.4 52 52 A G T 3 S+ 0 0 26 -3,-0.1 2,-1.3 -4,-0.1 -1,-0.3 0.204 102.3 129.7 -84.5 22.3 16.3 1.0 4.7 53 53 A D X + 0 0 52 -3,-1.9 3,-1.5 -6,-0.3 4,-0.2 -0.598 30.4 175.9 -83.7 92.8 19.6 -1.0 4.7 54 54 A V G > S+ 0 0 16 -2,-1.3 3,-1.5 1,-0.3 -1,-0.2 0.714 72.0 74.5 -64.9 -21.0 18.8 -4.3 2.9 55 55 A N G 3 S+ 0 0 121 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.585 89.2 57.1 -71.9 -10.1 22.4 -5.3 3.2 56 56 A K G < S+ 0 0 145 -3,-1.5 -1,-0.3 -6,-0.1 -2,-0.2 0.441 92.2 96.4 -97.9 -1.2 22.2 -6.0 6.9 57 57 A L S < S- 0 0 14 -3,-1.5 -3,-0.0 -4,-0.2 5,-0.0 -0.433 84.9 -93.9 -88.9 161.5 19.4 -8.5 6.3 58 58 A S > - 0 0 64 -2,-0.1 4,-2.1 1,-0.1 5,-0.2 -0.314 42.7-106.6 -67.1 158.7 19.6 -12.3 6.1 59 59 A E H > S+ 0 0 134 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.871 117.3 52.7 -56.5 -44.7 19.8 -13.7 2.5 60 60 A N H > S+ 0 0 92 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.923 112.4 45.9 -59.8 -43.2 16.3 -15.0 2.3 61 61 A I H > S+ 0 0 11 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.859 108.4 54.9 -69.8 -35.6 14.9 -11.7 3.3 62 62 A Q H X S+ 0 0 15 -4,-2.1 4,-2.8 2,-0.2 5,-0.2 0.910 108.7 50.0 -63.2 -40.6 17.1 -9.7 1.0 63 63 A E H X S+ 0 0 127 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.930 111.4 47.2 -64.0 -44.1 15.8 -11.8 -1.9 64 64 A Q H X S+ 0 0 92 -4,-1.8 4,-2.8 2,-0.2 -1,-0.2 0.875 112.7 50.3 -65.5 -35.2 12.2 -11.2 -0.9 65 65 A V H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.944 110.5 47.5 -68.9 -48.4 12.7 -7.5 -0.5 66 66 A R H X S+ 0 0 122 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.908 114.1 50.6 -58.8 -38.6 14.4 -7.1 -3.9 67 67 A Q H X S+ 0 0 50 -4,-2.3 4,-2.0 -5,-0.2 -2,-0.2 0.959 112.8 42.6 -63.8 -52.0 11.5 -9.1 -5.4 68 68 A L H X S+ 0 0 3 -4,-2.8 4,-2.5 1,-0.2 5,-0.2 0.855 110.9 56.7 -64.8 -34.2 8.7 -7.1 -3.8 69 69 A D H X S+ 0 0 45 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.947 110.0 46.6 -59.9 -45.6 10.6 -3.8 -4.6 70 70 A S H < S+ 0 0 58 -4,-2.1 -2,-0.2 -5,-0.2 4,-0.2 0.858 111.2 50.8 -64.1 -38.3 10.5 -5.0 -8.2 71 71 A T H >< S+ 0 0 0 -4,-2.0 3,-1.5 1,-0.2 -2,-0.2 0.940 110.3 48.1 -66.3 -48.1 6.8 -5.9 -8.2 72 72 A I H >< S+ 0 0 1 -4,-2.5 3,-1.5 1,-0.3 92,-0.5 0.902 105.5 58.7 -60.0 -41.8 5.7 -2.6 -6.7 73 73 A S T 3< S+ 0 0 49 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.547 85.2 83.9 -67.5 -4.1 7.7 -0.7 -9.3 74 74 A K T < S+ 0 0 84 -3,-1.5 2,-0.3 -4,-0.2 -1,-0.3 0.594 95.8 37.0 -75.8 -9.6 5.7 -2.4 -12.0 75 75 A S < - 0 0 3 -3,-1.5 89,-2.0 -4,-0.1 2,-0.3 -0.989 65.0-168.0-142.1 150.2 2.9 0.1 -11.7 76 76 A V B -I 163 0B 60 -2,-0.3 87,-0.2 87,-0.3 -54,-0.1 -0.908 38.3 -86.0-133.6 161.2 2.6 3.8 -11.1 77 77 A T - 0 0 2 85,-2.1 84,-2.4 -2,-0.3 85,-0.1 -0.495 25.4-156.4 -69.6 131.6 -0.3 6.1 -10.3 78 78 A P S S+ 0 0 52 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.626 81.0 26.1 -82.1 -13.0 -2.1 7.4 -13.4 79 79 A D S S- 0 0 34 80,-0.1 82,-0.2 -75,-0.0 2,-0.2 -0.933 95.2 -93.6-141.0 162.7 -3.3 10.5 -11.4 80 80 A S + 0 0 25 -2,-0.3 -76,-2.6 -79,-0.2 2,-0.3 -0.566 62.6 171.8 -71.4 144.7 -2.2 12.5 -8.4 81 81 A V E -aB 4 158A 0 77,-2.4 77,-4.3 -78,-0.3 2,-0.4 -0.995 36.5-122.6-161.9 153.3 -4.1 10.8 -5.5 82 82 A Y E - B 0 157A 46 -78,-2.0 -76,-0.4 -2,-0.3 2,-0.3 -0.807 25.7-177.9 -98.3 136.4 -4.6 10.6 -1.7 83 83 A V E - B 0 156A 1 73,-2.0 73,-2.5 -2,-0.4 2,-0.5 -0.939 20.0-130.0-128.1 153.9 -4.2 7.2 0.1 84 84 A Y E -CB 140 155A 12 56,-3.3 56,-2.1 -2,-0.3 2,-0.7 -0.918 13.1-167.2-116.7 127.6 -4.7 6.7 3.8 85 85 A R E - B 0 154A 19 69,-2.3 69,-2.9 -2,-0.5 2,-0.4 -0.912 16.9-154.6-108.7 103.9 -2.4 5.0 6.2 86 86 A L E + B 0 153A 8 -2,-0.7 2,-0.3 67,-0.2 67,-0.2 -0.682 21.9 178.4 -81.5 129.0 -4.4 4.3 9.4 87 87 A L E - B 0 152A 15 65,-2.6 65,-2.5 -2,-0.4 2,-0.2 -0.886 27.0-121.8-132.8 162.2 -2.1 4.1 12.5 88 88 A N > - 0 0 64 -2,-0.3 3,-1.7 63,-0.2 4,-0.3 -0.471 42.3 -98.0 -93.3 169.0 -2.1 3.6 16.2 89 89 A L G > S+ 0 0 15 1,-0.3 3,-1.5 2,-0.2 4,-0.2 0.688 113.5 79.2 -63.8 -18.6 -0.7 6.0 18.8 90 90 A D G > S+ 0 0 102 1,-0.3 3,-2.0 2,-0.2 4,-0.3 0.807 79.4 72.2 -58.8 -27.8 2.5 4.0 19.0 91 91 A Y G X S+ 0 0 24 -3,-1.7 3,-1.5 1,-0.3 -1,-0.3 0.850 87.7 62.7 -54.6 -36.3 3.5 5.7 15.7 92 92 A L G X S+ 0 0 1 -3,-1.5 3,-1.7 1,-0.3 -1,-0.3 0.568 79.7 79.9 -69.1 -10.9 4.0 8.9 17.6 93 93 A S G < S+ 0 0 100 -3,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.707 87.8 61.6 -69.5 -14.9 6.8 7.5 19.8 94 94 A S G < S+ 0 0 74 -3,-1.5 2,-0.6 -4,-0.3 -1,-0.3 0.318 83.1 98.6 -91.3 7.2 9.0 8.1 16.7 95 95 A I S X S- 0 0 5 -3,-1.7 3,-1.4 3,-0.1 2,-0.1 -0.866 74.2-128.0-103.1 120.3 8.4 11.9 16.8 96 96 A T T 3 S+ 0 0 130 -2,-0.6 3,-0.1 1,-0.2 -2,-0.1 -0.387 90.8 22.9 -65.5 131.9 11.0 14.1 18.4 97 97 A G T 3 S+ 0 0 41 1,-0.2 2,-0.9 -2,-0.1 -1,-0.2 0.160 88.6 110.8 101.3 -20.5 9.7 16.5 21.0 98 98 A F < - 0 0 20 -3,-1.4 -1,-0.2 -6,-0.2 -3,-0.1 -0.817 63.1-145.0 -91.1 108.1 6.6 14.6 21.9 99 99 A T > - 0 0 69 -2,-0.9 4,-1.8 1,-0.1 3,-0.3 -0.203 23.7-107.8 -73.9 163.3 7.3 13.3 25.5 100 100 A R H > S+ 0 0 172 1,-0.3 4,-2.0 2,-0.2 -1,-0.1 0.856 124.3 51.6 -55.4 -34.8 6.2 10.0 27.1 101 101 A E H > S+ 0 0 103 2,-0.2 4,-2.7 1,-0.2 -1,-0.3 0.830 101.3 58.6 -73.8 -33.3 3.8 12.1 29.1 102 102 A D H > S+ 0 0 11 -3,-0.3 4,-2.5 2,-0.2 -2,-0.2 0.915 111.2 43.3 -60.9 -42.2 2.3 13.9 26.1 103 103 A L H X S+ 0 0 26 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.915 110.0 55.7 -68.1 -44.6 1.3 10.4 24.8 104 104 A H H < S+ 0 0 76 -4,-2.0 4,-0.3 1,-0.2 -2,-0.2 0.943 115.1 39.3 -52.5 -49.8 0.1 9.3 28.2 105 105 A M H >< S+ 0 0 73 -4,-2.7 3,-1.7 1,-0.2 -1,-0.2 0.887 109.6 61.5 -67.4 -40.4 -2.2 12.4 28.3 106 106 A L H 3< S+ 0 0 0 -4,-2.5 9,-0.3 1,-0.3 -1,-0.2 0.847 97.4 57.6 -56.1 -37.4 -3.1 12.0 24.6 107 107 A Q T 3< S+ 0 0 108 -4,-2.2 2,-1.5 -3,-0.2 -1,-0.3 0.645 87.6 85.1 -68.9 -15.3 -4.6 8.5 25.2 108 108 A Q < + 0 0 126 -3,-1.7 -1,-0.2 -4,-0.3 7,-0.1 -0.666 69.5 179.5 -89.9 82.4 -7.0 10.2 27.6 109 109 A T - 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