==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 26-JUN-12 4FR6 . COMPND 2 MOLECULE: QUEUINE TRNA-RIBOSYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ZYMOMONAS MOBILIS SUBSP. MOBILIS; . AUTHOR F.IMMEKUS,G.KLEBE . 342 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13968.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 233 68.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 8.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 18 5.3 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.9 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 . 16 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 128 37.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.3 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 0 2 4 1 0 2 0 2 1 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 RESIDUES PER ALPHA HELIX . 1 3 3 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 0 0 PARALLEL BRIDGES PER LADDER . 0 1 0 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 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 11 A R 0 0 171 0, 0.0 22,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 152.6 9.1 -10.1 26.6 2 12 A P - 0 0 64 0, 0.0 3,-0.2 0, 0.0 156,-0.0 -0.308 360.0-104.6 -74.0 165.3 10.4 -8.0 29.5 3 13 A R S S- 0 0 71 1,-0.3 20,-0.4 19,-0.2 2,-0.3 0.921 102.6 -8.6 -55.1 -45.9 9.7 -4.4 30.2 4 14 A F + 0 0 32 18,-0.2 2,-0.3 19,-0.1 -1,-0.3 -0.902 67.0 160.2-162.9 123.8 13.2 -3.5 29.0 5 15 A S E -A 21 0A 57 16,-1.6 16,-3.0 -2,-0.3 2,-0.5 -0.879 15.0-165.4-148.8 120.4 16.2 -5.5 28.1 6 16 A F E -A 20 0A 28 -2,-0.3 2,-0.4 14,-0.2 14,-0.2 -0.914 10.9-178.7-107.8 125.1 19.2 -4.3 26.0 7 17 A S E -A 19 0A 57 12,-2.5 12,-2.3 -2,-0.5 2,-0.6 -0.994 20.0-143.9-125.8 131.4 21.5 -7.0 24.7 8 18 A I E +A 18 0A 53 -2,-0.4 10,-0.3 10,-0.2 3,-0.1 -0.873 17.0 179.6 -95.9 118.3 24.6 -6.3 22.6 9 19 A A E + 0 0 80 8,-2.5 2,-0.3 -2,-0.6 9,-0.2 0.727 66.0 1.2 -89.3 -27.9 25.1 -9.1 20.0 10 20 A A E -A 17 0A 20 7,-1.8 7,-2.6 2,-0.0 2,-0.3 -0.988 59.0-158.1-165.0 149.5 28.3 -7.7 18.3 11 21 A R E -A 16 0A 103 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.952 8.7-176.2-132.4 149.9 30.8 -4.9 18.5 12 22 A E E > S-A 15 0A 46 3,-2.4 3,-2.0 -2,-0.3 2,-0.2 -0.841 72.6 -48.1-147.2 108.2 33.3 -3.3 16.2 13 23 A G T 3 S- 0 0 76 -2,-0.3 224,-0.1 1,-0.3 -1,-0.1 -0.527 124.1 -23.9 64.3-129.4 35.4 -0.5 17.8 14 24 A K T 3 S+ 0 0 89 222,-0.6 -1,-0.3 -2,-0.2 2,-0.2 0.545 118.2 104.7 -86.0 -10.0 32.9 1.6 19.6 15 25 A A E < -A 12 0A 0 -3,-2.0 -3,-2.4 221,-0.2 2,-0.3 -0.461 50.9-172.2 -76.0 142.5 30.0 0.6 17.4 16 26 A R E -A 11 0A 2 223,-0.3 2,-0.4 219,-0.2 -5,-0.2 -0.964 12.8-164.7-130.1 152.2 27.5 -1.9 18.7 17 27 A T E +A 10 0A 10 -7,-2.6 -8,-2.5 -2,-0.3 -7,-1.8 -0.993 35.0 102.3-136.3 144.0 24.6 -3.9 17.3 18 28 A G E -AB 8 29A 7 11,-1.9 11,-2.8 -2,-0.4 2,-0.4 -0.873 54.3 -71.3-178.1-150.6 21.9 -5.6 19.3 19 29 A T E -AB 7 28A 49 -12,-2.3 -12,-2.5 -2,-0.3 2,-0.5 -0.999 11.9-151.7-142.6 142.3 18.3 -5.6 20.5 20 30 A I E -AB 6 27A 0 7,-2.5 7,-3.0 -2,-0.4 2,-0.5 -0.973 22.3-155.8-104.0 123.2 16.1 -3.8 22.9 21 31 A E E +AB 5 26A 18 -16,-3.0 -16,-1.6 -2,-0.5 2,-0.3 -0.893 21.6 164.1 -98.2 130.7 13.3 -6.1 24.0 22 32 A M E > - B 0 25A 0 3,-2.0 3,-1.5 -2,-0.5 -19,-0.2 -0.891 51.4 -98.8-135.0 166.6 10.1 -4.4 25.3 23 33 A K T 3 S+ 0 0 92 -20,-0.4 -20,-0.1 135,-0.3 3,-0.1 0.904 121.9 45.3 -60.2 -37.8 6.6 -5.7 25.8 24 34 A R T 3 S- 0 0 107 1,-0.2 2,-0.3 -21,-0.1 -1,-0.3 0.533 126.0 -52.1 -83.8 -2.7 5.3 -4.4 22.5 25 35 A G E < -B 22 0A 10 -3,-1.5 -3,-2.0 47,-0.2 2,-0.4 -0.907 56.0 -69.7 158.5 174.1 8.2 -5.6 20.5 26 36 A V E -B 21 0A 63 -2,-0.3 2,-0.6 -5,-0.2 -5,-0.2 -0.836 33.1-156.1 -99.4 136.0 11.9 -6.0 19.7 27 37 A I E -B 20 0A 0 -7,-3.0 -7,-2.5 -2,-0.4 2,-0.3 -0.959 11.4-143.2-112.4 116.1 13.9 -3.0 18.4 28 38 A R E -B 19 0A 94 -2,-0.6 -9,-0.2 -9,-0.2 12,-0.1 -0.623 32.3-106.1 -81.1 132.5 17.0 -3.8 16.4 29 39 A T E S+B 18 0A 0 -11,-2.8 -11,-1.9 -2,-0.3 2,-0.2 -0.897 98.9 45.8-117.3 146.1 19.9 -1.5 17.1 30 40 A P S S- 0 0 0 0, 0.0 2,-0.4 0, 0.0 211,-0.2 0.480 92.4-172.8 -61.2 141.2 21.3 0.7 15.7 31 41 A A E -c 241 0B 5 209,-2.0 211,-1.8 -2,-0.2 2,-0.5 -0.944 30.1-152.0-119.8 137.7 17.8 2.0 15.0 32 42 A F E -c 242 0B 3 -2,-0.4 8,-0.4 209,-0.2 9,-0.3 -0.953 15.7-160.1-103.9 130.6 16.2 4.8 13.1 33 43 A M - 0 0 1 209,-2.3 211,-0.4 -2,-0.5 9,-0.2 -0.910 10.9-161.0-113.8 94.2 12.9 5.9 14.6 34 44 A P - 0 0 10 0, 0.0 9,-2.5 0, 0.0 2,-0.1 -0.386 31.4 -92.1 -76.6 161.7 10.7 7.7 12.1 35 45 A V B -d 43 0B 53 209,-0.3 9,-0.2 7,-0.2 10,-0.0 -0.426 35.3-132.8 -69.0 143.0 7.9 10.0 12.9 36 46 A G 0 0 31 7,-2.5 -1,-0.1 1,-0.2 8,-0.1 0.764 360.0 360.0 -70.7 -25.5 4.7 8.0 13.0 37 47 A T 0 0 157 6,-0.3 -1,-0.2 0, 0.0 7,-0.0 0.242 360.0 360.0 -94.8 360.0 2.5 10.3 10.9 38 ! 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 39 64 A A 0 0 53 0, 0.0 3,-0.1 0, 0.0 -6,-0.1 0.000 360.0 360.0 360.0 147.1 10.7 0.5 11.5 40 65 A D + 0 0 33 -8,-0.4 2,-0.3 1,-0.3 -7,-0.1 0.569 360.0 19.5-101.2 -16.5 10.6 -1.2 14.9 41 66 A I - 0 0 1 -9,-0.3 -1,-0.3 31,-0.1 2,-0.3 -0.982 68.8-158.3-153.5 140.6 9.6 1.9 16.8 42 67 A I E - e 0 74B 11 31,-1.5 33,-2.4 -2,-0.3 2,-0.5 -0.839 21.0-114.2-120.3 163.9 8.1 5.3 15.8 43 68 A L E -de 35 75B 15 -9,-2.5 -7,-2.5 -2,-0.3 -6,-0.3 -0.832 20.0-151.9-100.5 133.2 8.2 8.7 17.4 44 69 A G E - e 0 76B 10 31,-2.4 2,-0.9 -2,-0.5 33,-0.6 -0.645 23.2-119.1 -90.8 160.5 5.0 10.4 18.6 45 70 A N > + 0 0 65 -2,-0.2 4,-2.9 1,-0.2 5,-0.3 -0.751 30.7 179.5-109.4 83.2 4.9 14.2 18.7 46 71 A T H > S+ 0 0 3 -2,-0.9 4,-2.1 1,-0.2 5,-0.2 0.896 79.3 50.7 -50.6 -48.0 4.4 15.2 22.3 47 72 A Y H > S+ 0 0 34 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.942 114.7 41.9 -63.2 -46.8 4.4 18.9 21.6 48 73 A H H >> S+ 0 0 107 1,-0.2 4,-2.9 2,-0.2 3,-1.2 0.962 115.4 49.8 -62.5 -48.9 1.8 18.7 18.9 49 74 A L H 3<>S+ 0 0 15 -4,-2.9 5,-2.4 1,-0.3 -1,-0.2 0.809 103.4 58.1 -63.4 -30.9 -0.4 16.2 20.7 50 75 A M H 3<5S+ 0 0 35 -4,-2.1 5,-0.3 -5,-0.3 -1,-0.3 0.771 116.5 37.0 -71.6 -22.3 -0.5 18.1 23.9 51 76 A L H <<5S+ 0 0 103 -3,-1.2 -2,-0.2 -4,-0.9 -1,-0.2 0.746 116.9 55.6 -95.0 -35.7 -2.0 21.1 22.0 52 77 A R T <5S- 0 0 46 -4,-2.9 -1,-0.3 -5,-0.2 -2,-0.1 -0.853 134.5 -14.9-149.3 112.3 -4.2 19.1 19.6 53 78 A P T 5S- 0 0 69 0, 0.0 4,-0.2 0, 0.0 -3,-0.1 -0.994 104.5-118.1 -88.9 1.8 -6.2 17.2 20.6 54 79 A G >< - 0 0 16 -5,-2.4 4,-2.3 -6,-0.2 -4,-0.2 -0.096 22.4 -96.3 108.5 145.3 -4.6 17.2 24.1 55 80 A A H > S+ 0 0 1 -5,-0.3 4,-2.4 1,-0.2 5,-0.2 0.874 124.7 53.2 -62.4 -41.4 -3.0 14.4 26.0 56 81 A E H > S+ 0 0 129 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.906 107.9 50.6 -62.5 -40.8 -6.2 13.8 27.9 57 82 A R H > S+ 0 0 35 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.902 109.6 50.8 -65.0 -42.4 -8.2 13.5 24.7 58 83 A I H <>S+ 0 0 0 -4,-2.3 5,-2.8 2,-0.2 4,-0.3 0.937 109.0 50.3 -60.0 -41.1 -5.8 11.0 23.3 59 84 A A H ><5S+ 0 0 34 -4,-2.4 3,-1.6 1,-0.2 -2,-0.2 0.925 107.5 54.8 -59.6 -42.5 -6.0 8.9 26.4 60 85 A K H 3<5S+ 0 0 187 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.829 105.9 52.8 -57.4 -34.2 -9.8 9.1 26.0 61 86 A L T 3<5S- 0 0 96 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.411 134.2 -88.7 -84.3 1.0 -9.4 7.7 22.5 62 87 A G T < 5 - 0 0 53 -3,-1.6 4,-0.4 -4,-0.3 -3,-0.2 0.488 69.6 -74.7 110.6 5.2 -7.4 4.8 23.8 63 88 A G >< - 0 0 10 -5,-2.8 4,-2.4 -6,-0.2 5,-0.2 -0.091 63.4 -65.5 92.4 168.2 -3.9 6.1 23.8 64 89 A L H > S+ 0 0 2 46,-2.7 4,-2.5 1,-0.2 6,-0.3 0.850 125.8 60.9 -66.2 -34.0 -1.5 6.7 20.8 65 90 A H H >>S+ 0 0 15 45,-0.4 5,-2.4 1,-0.2 4,-1.1 0.972 114.0 36.5 -53.7 -54.6 -1.1 3.0 19.8 66 91 A S H 45S+ 0 0 84 -4,-0.4 3,-0.4 3,-0.2 -2,-0.2 0.918 115.8 54.2 -64.3 -43.7 -4.8 2.7 19.1 67 92 A F H <5S+ 0 0 108 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.940 118.7 33.9 -56.4 -48.0 -5.2 6.2 17.7 68 93 A M H <5S- 0 0 59 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.532 107.1-121.1 -84.5 -13.5 -2.5 5.7 15.2 69 94 A G T <5S+ 0 0 72 -4,-1.1 2,-0.5 -3,-0.4 -3,-0.2 0.872 70.5 131.0 67.0 41.5 -3.1 2.0 14.5 70 95 A W < + 0 0 72 -5,-2.4 -1,-0.2 -6,-0.3 -2,-0.2 -0.959 32.9 178.5-128.5 111.4 0.4 1.1 15.6 71 96 A D + 0 0 133 -2,-0.5 3,-0.1 -3,-0.1 -1,-0.1 0.440 57.4 86.0 -99.3 4.2 0.8 -1.7 18.1 72 97 A R S S- 0 0 19 1,-0.2 -47,-0.2 -7,-0.1 -31,-0.1 -0.246 94.8 -56.4 -88.3 176.4 4.7 -1.7 18.3 73 98 A P - 0 0 0 0, 0.0 -31,-1.5 0, 0.0 2,-0.4 -0.282 48.2-160.6 -59.6 148.3 6.8 0.6 20.5 74 99 A I E -e 42 0B 0 -33,-0.2 39,-2.2 37,-0.2 40,-2.0 -0.995 3.0-155.5-127.5 132.3 6.5 4.3 20.5 75 100 A L E -ef 43 114B 0 -33,-2.4 -31,-2.4 -2,-0.4 2,-0.4 -0.875 10.6-165.4-102.5 137.6 9.1 6.8 21.8 76 101 A T E -ef 44 115B 0 38,-2.4 40,-0.9 -2,-0.4 -31,-0.1 -0.992 14.4-134.7-122.8 140.1 8.0 10.3 22.9 77 102 A D - 0 0 35 -33,-0.6 -31,-0.1 -2,-0.4 41,-0.1 -0.338 29.7-112.3 -79.5 168.0 10.2 13.3 23.5 78 103 A S - 0 0 0 39,-0.3 28,-0.1 -2,-0.1 29,-0.1 0.629 43.4-121.5 -87.7 -9.7 9.6 15.3 26.6 79 104 A G S > S+ 0 0 2 19,-0.0 4,-1.9 39,-0.0 5,-0.1 -0.026 86.3 96.1 106.7 -26.2 8.3 18.4 24.8 80 105 A G H > S+ 0 0 12 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.816 77.7 60.7 -74.6 -28.9 10.6 21.2 25.8 81 106 A Y H > S+ 0 0 104 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.953 112.1 41.1 -54.7 -51.6 12.9 21.1 22.9 82 107 A Q H > S+ 0 0 70 2,-0.2 4,-2.7 1,-0.2 5,-0.4 0.835 112.5 54.9 -70.4 -32.5 10.0 21.8 20.6 83 108 A V H X S+ 0 0 4 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.968 111.1 44.7 -62.9 -50.9 8.6 24.4 23.0 84 109 A M H < S+ 0 0 83 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.929 120.2 41.9 -55.2 -46.5 11.9 26.3 23.0 85 110 A S H < S+ 0 0 88 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.836 127.7 24.0 -72.6 -36.4 12.1 26.0 19.2 86 111 A L H < 0 0 64 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.706 360.0 360.0-113.0 -16.8 8.6 26.7 18.1 87 112 A S < 0 0 83 -4,-2.6 -4,-0.0 -5,-0.4 9,-0.0 -0.005 360.0 360.0-114.3 360.0 6.8 28.7 20.8 88 ! 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 89 117 A Q 0 0 113 0, 0.0 2,-0.3 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 133.5 11.3 29.7 32.3 90 118 A S - 0 0 58 3,-1.8 3,-0.5 1,-0.0 0, 0.0 -0.956 360.0 -82.7-165.3 174.1 12.0 28.9 35.9 91 119 A E S S+ 0 0 68 -2,-0.3 3,-0.1 1,-0.2 -1,-0.0 0.807 126.3 58.4 -62.0 -27.6 13.3 26.0 38.1 92 120 A E S S- 0 0 120 1,-0.2 2,-0.3 7,-0.1 -1,-0.2 0.868 120.3 -94.8 -68.5 -36.8 9.7 24.7 38.1 93 121 A G - 0 0 7 -3,-0.5 -3,-1.8 6,-0.2 2,-0.4 -0.983 53.3 -43.1 155.6-145.0 9.6 24.3 34.2 94 122 A V - 0 0 37 4,-3.0 2,-0.4 -2,-0.3 -11,-0.0 -0.967 33.9-158.6-128.1 136.9 8.5 26.4 31.2 95 123 A T 0 0 90 -2,-0.4 -2,-0.0 0, 0.0 4,-0.0 -0.918 360.0 360.0-110.2 142.2 5.3 28.4 30.5 96 124 A F 0 0 102 -2,-0.4 -12,-0.0 -9,-0.0 -2,-0.0 -0.998 360.0 360.0-154.0 360.0 4.3 29.1 26.9 97 ! 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 98 135 A L 0 0 28 0, 0.0 -4,-3.0 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 138.1 5.5 22.0 31.1 99 136 A S > - 0 0 15 -6,-0.3 4,-3.0 1,-0.1 5,-0.3 -0.887 360.0 -90.1-148.4 168.6 7.6 20.7 34.0 100 137 A P H > S+ 0 0 0 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.925 128.6 45.9 -50.5 -47.2 9.3 17.3 34.6 101 138 A E H > S+ 0 0 73 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.930 114.4 44.9 -69.1 -42.1 6.2 16.1 36.3 102 139 A R H > S+ 0 0 102 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.874 111.8 53.5 -69.7 -36.5 3.7 17.3 33.6 103 140 A S H X S+ 0 0 0 -4,-3.0 4,-2.4 2,-0.2 -1,-0.2 0.938 109.7 47.0 -62.4 -44.9 5.9 16.0 30.8 104 141 A I H X S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.3 -2,-0.2 0.931 112.5 51.5 -62.8 -38.3 6.0 12.5 32.4 105 142 A E H X S+ 0 0 10 -4,-2.0 4,-2.8 2,-0.2 5,-0.2 0.925 108.9 49.5 -64.1 -47.3 2.2 12.7 32.9 106 143 A I H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.927 111.1 49.7 -56.9 -46.9 1.6 13.7 29.3 107 144 A Q H X>S+ 0 0 0 -4,-2.4 5,-1.7 1,-0.2 4,-1.2 0.867 110.0 51.4 -64.2 -34.2 3.8 10.9 28.0 108 145 A H H ><5S+ 0 0 60 -4,-2.1 3,-0.5 2,-0.2 -2,-0.2 0.944 109.3 49.9 -64.3 -46.7 1.9 8.5 30.3 109 146 A L H 3<5S+ 0 0 38 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.879 110.1 50.6 -60.0 -39.3 -1.5 9.7 28.9 110 147 A L H 3<5S- 0 0 0 -4,-2.3 -46,-2.7 -5,-0.2 -45,-0.4 0.825 108.5-133.1 -67.1 -27.7 -0.2 9.2 25.4 111 148 A G T <<5 + 0 0 32 -4,-1.2 -3,-0.2 -3,-0.5 -37,-0.2 0.756 38.8 172.7 84.1 27.0 0.9 5.6 26.4 112 149 A S < - 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