==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 15-NOV-00 1G81 . COMPND 2 MOLECULE: CHORISMATE LYASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR D.T.GALLAGHER,M.MAYHEW,M.J.HOLDEN,V.L.VILKER,A.HOWARD . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8101.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 111 67.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 55 33.5 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 . 3 1.8 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 . 14 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 17.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 16 9.8 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+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 1 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 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 0 1 0 0 0 1 0 1 0 3 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 1 A S 0 0 124 0, 0.0 3,-0.1 0, 0.0 76,-0.0 0.000 360.0 360.0 360.0 132.8 -1.3 4.9 36.0 2 2 A H >> - 0 0 62 1,-0.1 4,-2.0 0, 0.0 3,-0.6 -0.877 360.0-110.9-176.8 143.3 -0.4 3.3 39.3 3 3 A P H 3> S+ 0 0 88 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.828 117.2 54.1 -52.0 -36.8 1.2 4.5 42.6 4 4 A A H 3> S+ 0 0 6 1,-0.2 4,-2.0 2,-0.2 85,-0.1 0.845 109.1 47.6 -69.2 -33.7 4.4 2.5 41.9 5 5 A L H <> S+ 0 0 3 -3,-0.6 4,-2.2 2,-0.2 -1,-0.2 0.809 108.6 54.5 -75.7 -28.9 4.8 4.2 38.5 6 6 A T H X S+ 0 0 88 -4,-2.0 4,-0.9 2,-0.2 -2,-0.2 0.948 110.9 46.7 -65.2 -43.0 4.2 7.6 40.1 7 7 A Q H >< S+ 0 0 73 -4,-2.1 3,-0.8 1,-0.2 4,-0.5 0.912 109.6 53.7 -63.5 -42.4 7.1 6.7 42.5 8 8 A L H >< S+ 0 0 1 -4,-2.0 3,-1.3 1,-0.2 -1,-0.2 0.917 107.0 52.2 -57.4 -42.2 9.2 5.5 39.6 9 9 A R H 3< S+ 0 0 134 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.680 103.7 58.2 -69.6 -18.5 8.7 8.9 37.9 10 10 A A T << S+ 0 0 45 -4,-0.9 -1,-0.3 -3,-0.8 -2,-0.2 0.467 76.3 126.9 -89.8 -6.5 9.8 10.8 41.0 11 11 A L < - 0 0 4 -3,-1.3 2,-0.5 -4,-0.5 123,-0.2 -0.298 49.4-149.2 -56.6 135.6 13.3 9.1 41.2 12 12 A R E -A 133 0A 211 121,-2.2 121,-1.9 127,-0.0 2,-0.2 -0.938 16.4-150.0-109.6 124.9 16.2 11.6 41.3 13 13 A Y E -A 132 0A 43 -2,-0.5 2,-0.4 119,-0.3 119,-0.2 -0.559 9.1-145.0 -99.1 157.4 19.4 10.4 39.7 14 14 A S - 0 0 47 117,-1.8 117,-0.4 -2,-0.2 -2,-0.0 -0.936 14.5-140.8-115.3 143.0 23.1 11.0 40.3 15 15 A K S S+ 0 0 193 -2,-0.4 2,-0.4 115,-0.1 114,-0.1 0.858 92.6 57.4 -68.8 -31.0 25.5 11.2 37.4 16 16 A E S S- 0 0 147 -3,-0.1 -1,-0.1 114,-0.1 114,-0.1 -0.850 95.4-114.4-103.4 131.6 28.0 9.3 39.5 17 17 A I - 0 0 62 -2,-0.4 -2,-0.1 112,-0.1 113,-0.0 -0.478 39.5-119.1 -63.2 125.1 27.2 5.8 41.0 18 18 A P - 0 0 33 0, 0.0 2,-2.1 0, 0.0 -1,-0.1 -0.302 23.7-105.7 -68.2 150.7 27.2 6.3 44.9 19 19 A A + 0 0 111 6,-0.0 2,-0.1 -2,-0.0 -2,-0.0 -0.481 62.0 161.1 -79.0 70.7 29.7 4.3 47.0 20 20 A L - 0 0 43 -2,-2.1 5,-0.0 1,-0.2 -3,-0.0 -0.272 48.4 -71.9 -87.0 171.9 27.1 1.8 48.3 21 21 A D >> - 0 0 86 1,-0.1 4,-2.3 -2,-0.1 3,-0.6 -0.373 47.5-114.6 -65.9 150.3 27.6 -1.6 49.9 22 22 A P H 3> S+ 0 0 101 0, 0.0 4,-2.2 0, 0.0 -1,-0.1 0.772 112.4 54.7 -53.3 -36.4 28.8 -4.3 47.4 23 23 A Q H 3> S+ 0 0 146 2,-0.2 4,-1.3 1,-0.2 5,-0.1 0.878 110.7 45.9 -69.9 -37.3 25.6 -6.4 47.7 24 24 A L H <> S+ 0 0 14 -3,-0.6 4,-2.5 2,-0.2 -1,-0.2 0.899 113.0 49.7 -72.1 -39.9 23.4 -3.5 46.8 25 25 A L H X S+ 0 0 39 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.858 102.6 61.5 -67.0 -34.8 25.7 -2.5 43.9 26 26 A D H < S+ 0 0 91 -4,-2.2 4,-0.2 -5,-0.2 -1,-0.2 0.922 111.2 40.1 -54.6 -46.3 25.7 -6.0 42.6 27 27 A W H >< S+ 0 0 18 -4,-1.3 3,-1.2 1,-0.2 -2,-0.2 0.946 116.9 48.2 -65.7 -52.0 21.9 -5.7 42.2 28 28 A L H 3< S+ 0 0 0 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.809 115.7 42.0 -63.3 -32.9 21.9 -2.1 40.9 29 29 A L T 3< S+ 0 0 53 -4,-2.8 -1,-0.3 -5,-0.2 -2,-0.2 0.335 80.1 142.2 -97.4 9.0 24.5 -2.5 38.3 30 30 A L < - 0 0 44 -3,-1.2 2,-1.6 -4,-0.2 -3,-0.1 -0.203 53.7-133.5 -50.9 134.1 23.3 -5.9 37.1 31 31 A E S S+ 0 0 133 95,-0.0 2,-0.3 2,-0.0 -1,-0.2 -0.294 81.7 43.9 -90.6 55.6 23.7 -6.1 33.3 32 32 A D S S- 0 0 41 -2,-1.6 83,-0.1 83,-0.1 2,-0.0 -0.931 97.3 -79.7-171.3 173.7 20.2 -7.5 32.6 33 33 A S - 0 0 13 -2,-0.3 4,-0.4 1,-0.1 3,-0.2 -0.218 51.9-105.5 -72.1 177.3 16.6 -6.9 33.7 34 34 A M S > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.1 5,-0.3 0.461 91.1 103.8 -89.6 0.5 15.8 -8.5 37.1 35 35 A T H > S+ 0 0 3 79,-0.5 4,-1.9 1,-0.2 -1,-0.2 0.930 87.7 32.8 -51.0 -57.3 13.7 -11.4 35.7 36 36 A K H > S+ 0 0 92 -3,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.858 117.4 53.8 -70.8 -35.4 16.2 -14.2 36.1 37 37 A R H 4 S+ 0 0 58 -4,-0.4 4,-0.4 2,-0.2 -1,-0.2 0.785 110.7 48.7 -67.4 -29.7 17.8 -12.8 39.3 38 38 A F H >< S+ 0 0 0 -4,-2.3 3,-1.2 2,-0.2 5,-0.3 0.877 109.3 50.9 -75.8 -38.3 14.4 -12.6 40.9 39 39 A E H >X S+ 0 0 73 -4,-1.9 3,-2.5 -5,-0.3 4,-1.2 0.893 100.2 68.0 -61.2 -33.1 13.7 -16.2 39.8 40 40 A Q T 3< S+ 0 0 135 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.715 87.2 65.2 -58.0 -26.6 17.0 -17.0 41.4 41 41 A Q T <4 S- 0 0 84 -3,-1.2 -1,-0.3 -4,-0.4 -2,-0.2 0.396 129.5 -94.7 -75.2 1.1 15.5 -16.2 44.8 42 42 A G T <4 S+ 0 0 60 -3,-2.5 2,-0.3 1,-0.3 -2,-0.2 0.928 84.7 127.1 82.7 52.5 13.2 -19.2 44.3 43 43 A K < - 0 0 70 -4,-1.2 2,-0.4 -5,-0.3 -1,-0.3 -0.959 61.9-122.7-140.4 152.1 10.2 -17.4 42.8 44 44 A T - 0 0 96 -2,-0.3 39,-3.1 2,-0.0 2,-0.4 -0.782 34.9-147.2 -88.5 137.7 8.0 -17.5 39.8 45 45 A V E +B 82 0A 16 -2,-0.4 2,-0.3 37,-0.2 37,-0.2 -0.910 22.5 169.5-113.5 137.7 8.1 -14.1 38.0 46 46 A S E -B 81 0A 49 35,-2.1 35,-3.1 -2,-0.4 2,-0.5 -0.935 26.6-124.6-140.9 163.9 5.2 -12.6 36.2 47 47 A V E -B 80 0A 2 64,-0.6 2,-0.6 -2,-0.3 33,-0.2 -0.938 8.6-160.9-114.5 131.8 4.3 -9.3 34.7 48 48 A T E -B 79 0A 58 31,-2.7 31,-2.4 -2,-0.5 2,-0.5 -0.954 25.7-134.8-105.5 120.9 1.3 -7.1 35.5 49 49 A M E +B 78 0A 45 -2,-0.6 29,-0.2 29,-0.2 3,-0.1 -0.673 30.3 171.1 -82.6 125.6 0.8 -4.6 32.6 50 50 A I E S- 0 0 40 27,-2.7 2,-0.3 -2,-0.5 28,-0.2 0.810 71.1 -5.4 -98.4 -42.2 0.1 -1.1 33.8 51 51 A R E +B 77 0A 85 26,-2.0 26,-3.3 2,-0.0 -1,-0.4 -0.960 58.5 173.6-157.9 132.7 0.4 0.6 30.4 52 52 A E E +B 76 0A 77 -2,-0.3 2,-0.3 24,-0.2 24,-0.2 -0.985 34.3 93.0-138.5 129.6 1.3 -0.5 26.9 53 53 A G E -B 75 0A 17 22,-1.9 22,-2.8 -2,-0.3 2,-0.3 -0.885 69.1 -71.4 163.7 165.6 1.0 1.7 23.8 54 54 A F E -B 74 0A 96 -2,-0.3 2,-0.3 20,-0.2 20,-0.2 -0.631 48.1-179.9 -81.3 140.5 2.5 4.2 21.3 55 55 A V E -B 73 0A 3 18,-2.6 18,-2.1 -2,-0.3 2,-0.1 -0.942 21.2-125.2-137.0 155.8 3.2 7.7 22.6 56 56 A E > - 0 0 103 -2,-0.3 3,-2.2 16,-0.2 4,-0.3 -0.409 43.9 -84.5 -93.6 176.3 4.6 10.9 21.2 57 57 A Q G > S+ 0 0 77 13,-0.3 3,-1.5 1,-0.3 7,-0.2 0.775 120.7 66.2 -51.9 -33.7 7.4 13.1 22.5 58 58 A N G 3 S+ 0 0 126 1,-0.3 -1,-0.3 2,-0.1 6,-0.0 0.713 97.9 55.8 -66.1 -18.2 5.3 15.0 25.0 59 59 A E G < S+ 0 0 71 -3,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.502 104.7 51.7 -92.5 -3.5 4.8 11.8 27.0 60 60 A I <> + 0 0 0 -3,-1.5 4,-2.7 -4,-0.3 3,-0.4 -0.278 58.1 145.3-127.2 53.7 8.4 10.9 27.5 61 61 A P T 4 S+ 0 0 91 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.869 75.7 48.5 -58.3 -38.1 10.1 14.0 29.0 62 62 A E T 4 S+ 0 0 79 1,-0.2 4,-0.1 -3,-0.1 -2,-0.1 0.815 120.3 37.0 -72.9 -30.2 12.5 12.1 31.2 63 63 A E T >4 S+ 0 0 3 -3,-0.4 3,-1.7 1,-0.1 4,-0.5 0.736 95.0 83.6 -91.9 -25.7 13.6 9.8 28.4 64 64 A L G >< S+ 0 0 35 -4,-2.7 3,-1.5 1,-0.3 -2,-0.1 0.874 87.2 53.9 -49.4 -44.5 13.6 12.2 25.4 65 65 A P G 3 S+ 0 0 96 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.743 111.8 46.7 -64.9 -16.9 17.1 13.7 26.1 66 66 A L G < S+ 0 0 29 -3,-1.7 -2,-0.2 -4,-0.1 -3,-0.1 0.400 109.7 60.4-104.2 0.7 18.6 10.2 26.1 67 67 A L S < S- 0 0 7 -3,-1.5 27,-0.0 -4,-0.5 84,-0.0 -0.828 93.6 -85.5-128.6 163.2 16.9 8.9 23.0 68 68 A P - 0 0 47 0, 0.0 2,-0.7 0, 0.0 -2,-0.1 -0.337 50.2-110.6 -62.3 151.4 16.7 9.7 19.3 69 69 A K + 0 0 125 -4,-0.1 2,-0.2 26,-0.1 -5,-0.0 -0.795 57.5 151.9 -91.0 112.1 14.1 12.4 18.5 70 70 A E - 0 0 37 -2,-0.7 -13,-0.3 1,-0.0 3,-0.1 -0.813 56.8-105.5-134.2 175.5 11.2 10.7 16.6 71 71 A S S S+ 0 0 91 -2,-0.2 2,-0.3 1,-0.1 -14,-0.2 0.758 96.7 15.2 -77.5 -19.0 7.5 10.9 16.0 72 72 A R - 0 0 100 -16,-0.2 24,-2.1 -15,-0.1 2,-0.3 -0.989 55.7-167.2-157.3 154.6 6.6 8.0 18.2 73 73 A Y E -BC 55 95A 0 -18,-2.1 -18,-2.6 -2,-0.3 2,-0.5 -0.971 27.4-120.4-141.7 152.9 7.8 5.6 20.9 74 74 A W E -BC 54 94A 18 20,-3.0 20,-3.0 -2,-0.3 2,-0.4 -0.883 30.3-159.4 -96.9 129.4 6.5 2.4 22.3 75 75 A L E -BC 53 93A 0 -22,-2.8 -22,-1.9 -2,-0.5 2,-0.4 -0.906 11.9-179.5-111.8 130.3 5.8 2.8 26.1 76 76 A R E -BC 52 92A 7 16,-2.5 16,-2.8 -2,-0.4 2,-0.5 -0.931 0.4-179.7-135.4 110.3 5.7 -0.3 28.3 77 77 A E E +BC 51 91A 2 -26,-3.3 -27,-2.7 -2,-0.4 -26,-2.0 -0.949 16.6 165.4-113.7 129.1 5.0 0.2 32.1 78 78 A I E -BC 49 90A 15 12,-2.6 12,-2.5 -2,-0.5 2,-0.5 -0.890 39.5-133.4-140.5 165.4 4.8 -2.8 34.3 79 79 A L E -BC 48 89A 11 -31,-2.4 -31,-2.7 -2,-0.3 2,-0.6 -0.990 27.0-148.5-113.2 130.1 4.8 -4.3 37.8 80 80 A L E -BC 47 88A 7 8,-3.2 7,-3.1 -2,-0.5 8,-1.4 -0.897 18.9-162.7-103.7 121.8 7.2 -7.3 38.0 81 81 A C E -BC 46 86A 6 -35,-3.1 -35,-2.1 -2,-0.6 2,-0.5 -0.819 18.4-154.5-110.4 147.0 5.9 -9.8 40.6 82 82 A A E > S-BC 45 85A 0 3,-2.5 3,-2.1 -2,-0.3 -37,-0.2 -0.974 91.5 -18.1-117.1 115.6 7.6 -12.7 42.4 83 83 A D T 3 S- 0 0 96 -39,-3.1 -1,-0.2 -2,-0.5 -38,-0.1 0.904 132.4 -52.2 47.6 42.6 5.1 -15.4 43.4 84 84 A G T 3 S+ 0 0 55 -40,-0.4 -1,-0.3 1,-0.2 -39,-0.1 0.287 113.1 121.1 84.2 -8.3 2.5 -12.7 42.8 85 85 A E E < -C 82 0A 92 -3,-2.1 -3,-2.5 1,-0.0 -1,-0.2 -0.747 68.8-117.6 -93.6 122.4 4.1 -10.1 45.0 86 86 A P E +C 81 0A 54 0, 0.0 74,-0.3 0, 0.0 -5,-0.3 -0.394 42.8 161.1 -59.8 130.0 5.1 -6.8 43.4 87 87 A W E + 0 0 11 -7,-3.1 71,-2.0 1,-0.4 74,-0.3 0.589 60.9 12.7-119.3 -20.2 8.9 -6.4 43.6 88 88 A L E -CD 80 157A 4 -8,-1.4 -8,-3.2 69,-0.2 2,-0.4 -0.992 54.7-143.4-158.7 150.3 9.7 -3.8 40.9 89 89 A A E -CD 79 156A 0 67,-2.0 67,-2.8 -2,-0.3 2,-0.4 -0.961 26.2-167.3-115.6 136.4 8.0 -1.3 38.7 90 90 A G E -CD 78 155A 3 -12,-2.5 -12,-2.6 -2,-0.4 2,-0.4 -0.961 14.5-171.0-126.7 149.8 9.5 -0.9 35.2 91 91 A R E -CD 77 154A 9 63,-2.7 63,-2.7 -2,-0.4 2,-0.4 -0.953 9.6-173.9-141.2 116.4 9.0 1.7 32.4 92 92 A T E -CD 76 153A 6 -16,-2.8 -16,-2.5 -2,-0.4 2,-0.5 -0.937 6.0-166.6-113.1 134.8 10.5 1.0 29.0 93 93 A V E -CD 75 152A 0 59,-2.5 59,-2.6 -2,-0.4 -18,-0.2 -0.986 5.7-171.8-123.8 119.3 10.5 3.6 26.2 94 94 A V E -C 74 0A 1 -20,-3.0 -20,-3.0 -2,-0.5 57,-0.2 -0.932 22.4-133.5-115.7 113.9 11.4 2.3 22.8 95 95 A P E >> -C 73 0A 0 0, 0.0 3,-1.9 0, 0.0 4,-0.6 -0.396 28.7-122.0 -58.4 140.7 11.9 4.8 19.9 96 96 A V G >4 S+ 0 0 46 -24,-2.1 3,-1.1 1,-0.3 -23,-0.1 0.803 109.0 66.4 -61.4 -25.0 9.9 3.3 17.0 97 97 A S G 34 S+ 0 0 68 -25,-0.3 -1,-0.3 1,-0.3 -24,-0.1 0.779 93.9 61.1 -65.6 -20.5 13.0 3.1 14.7 98 98 A T G <4 S+ 0 0 0 -3,-1.9 2,-2.5 1,-0.2 -1,-0.3 0.771 83.3 86.4 -76.4 -20.8 14.4 0.5 17.2 99 99 A L << + 0 0 21 -3,-1.1 2,-0.3 -4,-0.6 -1,-0.2 -0.361 66.8 109.7 -78.0 64.4 11.4 -1.7 16.3 100 100 A S S > S- 0 0 54 -2,-2.5 3,-1.4 -3,-0.1 5,-0.1 -0.930 72.4 -6.0-132.9 158.2 12.9 -3.4 13.3 101 101 A G G > S- 0 0 60 -2,-0.3 3,-1.9 1,-0.3 4,-0.3 -0.244 133.8 -10.8 59.2-144.4 14.1 -6.9 12.7 102 102 A P G > S+ 0 0 81 0, 0.0 3,-1.4 0, 0.0 -1,-0.3 0.814 133.2 68.0 -57.5 -28.6 14.1 -9.1 15.8 103 103 A E G X S+ 0 0 9 -3,-1.4 3,-1.9 1,-0.3 4,-0.3 0.627 75.3 79.0 -71.3 -11.3 13.4 -6.0 17.8 104 104 A L G X S+ 0 0 99 -3,-1.9 3,-1.6 1,-0.3 4,-0.5 0.790 80.4 74.7 -64.7 -21.5 9.9 -5.4 16.4 105 105 A A G X S+ 0 0 63 -3,-1.4 3,-0.8 -4,-0.3 4,-0.3 0.699 75.0 79.1 -64.0 -17.1 8.9 -8.2 18.9 106 106 A L G X S+ 0 0 13 -3,-1.9 3,-0.9 1,-0.3 4,-0.3 0.850 88.6 55.4 -59.1 -33.6 9.3 -5.6 21.7 107 107 A Q G < S+ 0 0 49 -3,-1.6 -1,-0.3 -4,-0.3 3,-0.2 0.789 113.0 40.1 -72.7 -24.2 5.9 -4.2 20.8 108 108 A K G < S+ 0 0 185 -3,-0.8 -1,-0.2 -4,-0.5 -2,-0.2 0.184 79.8 108.0-108.7 15.7 4.2 -7.6 21.2 109 109 A L X + 0 0 29 -3,-0.9 3,-1.7 -4,-0.3 -1,-0.2 0.834 49.7 169.7 -61.7 -36.4 6.0 -8.9 24.2 110 110 A G T 3 - 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