==== 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 22-SEP-00 1FW9 . COMPND 2 MOLECULE: CHORISMATE LYASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR D.T.GALLAGHER,M.MAYHEW,M.HOLDEN,V.VILKER,A.HOWARD . 164 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7635.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 110 67.1 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 . 54 32.9 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 . 13 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 16.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 18 11.0 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+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 0 2 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 . 1 0 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 0 100 0, 0.0 50,-0.0 0, 0.0 49,-0.0 0.000 360.0 360.0 360.0-110.1 -14.8 6.8 1.7 2 2 A H >> - 0 0 73 1,-0.1 4,-1.9 4,-0.0 3,-1.2 -0.702 360.0-119.1 -97.6 146.3 -13.6 6.1 5.2 3 3 A P H 3> S+ 0 0 98 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.807 112.8 59.2 -52.7 -31.4 -11.6 8.7 7.2 4 4 A A H 3> S+ 0 0 8 1,-0.2 4,-2.4 2,-0.2 85,-0.1 0.857 106.8 46.9 -67.5 -34.4 -8.6 6.3 7.5 5 5 A L H <> S+ 0 0 0 -3,-1.2 4,-2.3 2,-0.2 -1,-0.2 0.874 110.7 51.7 -72.3 -36.5 -8.4 6.1 3.7 6 6 A T H X S+ 0 0 85 -4,-1.9 4,-1.5 2,-0.2 -2,-0.2 0.926 112.7 46.4 -63.6 -43.8 -8.7 9.9 3.4 7 7 A Q H X S+ 0 0 48 -4,-2.7 4,-0.8 1,-0.2 3,-0.4 0.949 111.4 51.9 -61.5 -48.8 -5.8 10.2 5.9 8 8 A L H >< S+ 0 0 1 -4,-2.4 3,-0.8 1,-0.2 -2,-0.2 0.907 109.1 50.2 -51.2 -43.9 -3.8 7.6 4.1 9 9 A R H 3< S+ 0 0 62 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.821 110.3 49.0 -71.1 -28.7 -4.2 9.3 0.8 10 10 A A H 3< S+ 0 0 62 -4,-1.5 -1,-0.2 -3,-0.4 -2,-0.2 0.425 78.2 119.4 -91.3 -5.4 -3.1 12.7 2.1 11 11 A L S << S- 0 0 4 -4,-0.8 2,-1.1 -3,-0.8 123,-0.1 -0.280 72.3-117.9 -53.6 150.8 0.1 11.6 3.9 12 12 A R - 0 0 207 121,-0.4 121,-0.3 2,-0.0 2,-0.2 -0.772 39.0-163.3 -98.8 100.7 3.1 13.4 2.4 13 13 A Y + 0 0 24 -2,-1.1 2,-0.3 119,-0.2 119,-0.2 -0.529 17.5 159.9 -85.4 142.1 5.2 10.4 1.2 14 14 A S B -A 131 0A 56 117,-1.8 117,-3.0 2,-0.2 127,-0.1 -0.974 51.8-103.7-151.1 170.4 8.9 10.5 0.2 15 15 A K S S+ 0 0 153 -2,-0.3 2,-0.6 115,-0.2 114,-0.1 0.427 81.2 116.9 -79.1 3.4 11.8 8.1 -0.2 16 16 A E - 0 0 144 115,-0.2 115,-0.3 1,-0.0 -2,-0.2 -0.609 48.6-164.9 -74.3 122.9 13.3 9.1 3.1 17 17 A I - 0 0 71 -2,-0.6 -2,-0.1 113,-0.1 8,-0.0 -0.922 24.3-132.0-102.3 115.5 13.3 6.2 5.5 18 18 A P - 0 0 38 0, 0.0 2,-2.2 0, 0.0 0, 0.0 -0.245 23.7 -97.7 -69.9 164.5 13.9 7.7 8.9 19 19 A A + 0 0 111 6,-0.0 2,-0.1 0, 0.0 -2,-0.0 -0.492 66.6 160.6 -81.4 74.5 16.5 6.4 11.3 20 20 A L - 0 0 36 -2,-2.2 5,-0.1 1,-0.2 -3,-0.0 -0.387 50.6 -72.0 -92.4 168.1 14.1 4.3 13.3 21 21 A D >> - 0 0 103 1,-0.1 4,-2.3 -2,-0.1 3,-0.7 -0.314 51.9-113.9 -54.8 142.5 14.6 1.4 15.7 22 22 A P H 3> S+ 0 0 86 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.840 115.5 54.2 -51.0 -40.1 15.5 -1.7 13.6 23 23 A Q H 3> S+ 0 0 140 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.896 109.1 48.0 -63.4 -39.6 12.3 -3.5 14.5 24 24 A L H <> S+ 0 0 29 -3,-0.7 4,-2.7 2,-0.2 5,-0.2 0.908 111.4 51.0 -67.8 -40.1 10.2 -0.6 13.3 25 25 A L H X S+ 0 0 42 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.896 106.7 54.4 -60.2 -41.3 12.3 -0.5 10.1 26 26 A D H X S+ 0 0 116 -4,-2.3 4,-0.7 -5,-0.2 -1,-0.2 0.901 109.9 47.2 -61.3 -41.2 11.7 -4.2 9.6 27 27 A W H >< S+ 0 0 23 -4,-1.8 3,-0.8 1,-0.2 -2,-0.2 0.957 116.2 43.5 -60.9 -52.4 8.0 -3.6 9.8 28 28 A L H 3< S+ 0 0 0 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.837 116.1 46.0 -67.3 -30.8 8.1 -0.6 7.4 29 29 A L H 3< S+ 0 0 53 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.497 76.2 136.7 -92.3 -2.4 10.4 -2.2 4.9 30 30 A L << - 0 0 49 -3,-0.8 2,-1.6 -4,-0.7 -3,-0.1 -0.156 53.8-137.6 -46.5 130.6 8.8 -5.6 4.6 31 31 A E S S+ 0 0 89 93,-0.0 2,-0.3 95,-0.0 -1,-0.2 -0.406 80.3 49.3 -92.3 63.1 8.6 -6.7 1.0 32 32 A D S S- 0 0 37 -2,-1.6 83,-0.1 83,-0.1 2,-0.0 -0.943 98.3 -77.9-173.0 172.8 5.1 -8.0 1.2 33 33 A S - 0 0 11 -2,-0.3 4,-0.4 1,-0.1 3,-0.2 -0.222 48.8-107.3 -71.0 177.3 1.7 -6.9 2.6 34 34 A M S > S+ 0 0 1 1,-0.2 4,-2.6 2,-0.1 5,-0.3 0.478 89.9 101.6 -87.6 -4.9 1.2 -7.0 6.3 35 35 A T H > S+ 0 0 3 79,-0.5 4,-2.0 1,-0.2 -1,-0.2 0.912 86.2 33.1 -49.5 -58.5 -1.2 -10.0 6.3 36 36 A K H > S+ 0 0 69 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.882 118.0 53.2 -74.1 -33.8 1.1 -12.8 7.4 37 37 A R H 4 S+ 0 0 91 -4,-0.4 4,-0.2 1,-0.2 -1,-0.2 0.886 110.3 49.2 -67.0 -34.4 3.3 -10.7 9.7 38 38 A F H >< S+ 0 0 0 -4,-2.6 3,-1.6 1,-0.2 5,-0.3 0.903 108.0 53.6 -68.5 -38.8 0.2 -9.5 11.5 39 39 A E H >X S+ 0 0 62 -4,-2.0 3,-2.1 1,-0.3 4,-1.8 0.893 99.5 64.2 -59.4 -35.6 -1.0 -13.2 11.8 40 40 A Q T 3< S+ 0 0 118 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.558 85.4 71.6 -66.5 -8.6 2.4 -13.9 13.4 41 41 A Q T <4 S- 0 0 81 -3,-1.6 -1,-0.3 -4,-0.2 -2,-0.2 0.367 128.8 -96.8 -84.0 4.8 1.4 -11.6 16.2 42 42 A G T <4 S+ 0 0 62 -3,-2.1 2,-0.3 1,-0.3 -2,-0.2 0.896 85.3 126.8 81.9 47.2 -1.0 -14.5 17.1 43 43 A K < - 0 0 64 -4,-1.8 2,-0.6 -5,-0.3 -1,-0.3 -0.946 63.7-121.7-138.3 153.6 -4.0 -13.0 15.4 44 44 A T - 0 0 103 -2,-0.3 39,-3.0 -3,-0.1 40,-0.5 -0.851 34.9-144.4 -93.9 124.3 -6.7 -13.8 12.9 45 45 A V E +B 82 0A 15 -2,-0.6 2,-0.3 37,-0.2 37,-0.2 -0.793 23.3 173.4 -97.7 131.9 -6.5 -11.3 10.0 46 46 A S E -B 81 0A 51 35,-2.1 35,-2.8 -2,-0.4 2,-0.4 -0.924 24.6-126.0-136.2 161.1 -9.6 -10.1 8.2 47 47 A V E -B 80 0A 10 64,-0.5 2,-0.6 -2,-0.3 33,-0.2 -0.889 6.7-162.9-112.4 132.0 -10.7 -7.6 5.7 48 48 A T E -B 79 0A 63 31,-2.8 31,-2.3 -2,-0.4 2,-0.6 -0.970 28.9-134.7-106.3 119.1 -13.4 -4.9 5.9 49 49 A M E +B 78 0A 57 -2,-0.6 29,-0.2 29,-0.2 3,-0.1 -0.689 32.1 170.1 -81.8 119.7 -14.1 -3.8 2.3 50 50 A I E - 0 0 46 27,-2.5 2,-0.3 -2,-0.6 28,-0.2 0.840 69.3 -21.2 -96.9 -43.5 -14.3 -0.0 1.9 51 51 A R E +B 77 0A 78 26,-2.0 26,-3.0 -50,-0.0 -1,-0.4 -0.939 59.2 173.2-162.5 142.7 -14.4 0.1 -1.9 52 52 A E E +B 76 0A 60 -2,-0.3 2,-0.3 24,-0.2 24,-0.2 -0.949 30.4 90.9-150.2 136.1 -13.4 -2.1 -4.8 53 53 A G E S-B 75 0A 20 22,-1.6 22,-2.8 -2,-0.3 2,-0.3 -0.884 71.4 -59.1 163.5 173.1 -14.0 -1.8 -8.5 54 54 A F E +B 74 0A 96 -2,-0.3 2,-0.3 20,-0.2 20,-0.2 -0.625 55.0 179.1 -78.7 137.3 -12.7 -0.5 -11.8 55 55 A V E -B 73 0A 7 18,-3.0 18,-2.2 -2,-0.3 2,-0.1 -0.896 23.5-118.6-135.4 168.0 -12.0 3.2 -11.9 56 56 A E > - 0 0 96 -2,-0.3 3,-2.1 16,-0.2 4,-0.3 -0.429 44.1 -90.4 -98.8 173.9 -10.7 5.8 -14.3 57 57 A Q G > S+ 0 0 74 14,-0.3 3,-1.9 1,-0.3 7,-0.2 0.823 118.7 71.2 -54.7 -32.7 -7.7 8.0 -13.9 58 58 A N G 3 S+ 0 0 120 1,-0.3 -1,-0.3 2,-0.1 -3,-0.0 0.659 96.4 50.9 -62.5 -14.4 -9.8 10.7 -12.2 59 59 A E G < S+ 0 0 74 -3,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.423 105.6 55.8-103.9 3.4 -10.1 8.5 -9.1 60 60 A I <> + 0 0 0 -3,-1.9 4,-2.6 -4,-0.3 -1,-0.2 -0.288 56.4 145.8-127.6 51.8 -6.4 7.8 -8.7 61 61 A P T 4 S+ 0 0 70 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.845 75.9 47.7 -58.3 -36.1 -4.7 11.2 -8.5 62 62 A E T 4 S+ 0 0 56 1,-0.2 4,-0.2 -3,-0.1 -2,-0.1 0.889 119.6 37.6 -71.2 -39.6 -2.1 10.1 -6.0 63 63 A E T >4 S+ 0 0 2 1,-0.2 3,-1.7 -3,-0.1 4,-0.5 0.747 96.0 80.2 -85.8 -24.3 -1.1 6.9 -7.9 64 64 A L G >< S+ 0 0 30 -4,-2.6 3,-1.4 1,-0.3 -1,-0.2 0.867 88.9 53.8 -56.1 -41.2 -1.4 8.1 -11.5 65 65 A P G 3 S+ 0 0 93 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.722 112.7 47.6 -65.5 -16.7 2.0 9.8 -11.6 66 66 A L G < S+ 0 0 33 -3,-1.7 -2,-0.2 -4,-0.2 -3,-0.1 0.404 110.4 54.3-103.6 1.2 3.5 6.5 -10.4 67 67 A L S < S- 0 0 7 -3,-1.4 27,-0.0 -4,-0.5 84,-0.0 -0.826 96.6 -79.9-130.2 166.8 1.8 4.1 -12.8 68 68 A P - 0 0 55 0, 0.0 2,-0.7 0, 0.0 -2,-0.1 -0.390 49.6-116.7 -63.1 150.2 1.3 3.7 -16.6 69 69 A K + 0 0 123 -4,-0.1 2,-0.3 26,-0.1 -5,-0.0 -0.822 58.4 138.6 -90.4 112.8 -1.4 6.1 -17.9 70 70 A E - 0 0 42 -2,-0.7 -13,-0.2 1,-0.0 3,-0.1 -0.835 62.2 -91.5-147.0-177.8 -4.2 3.9 -19.2 71 71 A S S S+ 0 0 88 -2,-0.3 2,-0.3 1,-0.1 -14,-0.3 0.820 95.4 23.6 -74.9 -33.5 -8.0 3.8 -19.3 72 72 A R - 0 0 107 -16,-0.1 24,-2.4 -15,-0.1 25,-0.3 -0.986 52.6-177.6-142.0 152.5 -8.8 1.6 -16.3 73 73 A Y E -BC 55 95A 0 -18,-2.2 -18,-3.0 -2,-0.3 2,-0.6 -0.974 30.6-121.1-141.3 146.4 -7.5 0.5 -13.0 74 74 A W E -BC 54 94A 28 20,-3.1 20,-2.7 -2,-0.3 2,-0.5 -0.843 32.2-164.7 -87.5 123.3 -8.7 -1.8 -10.3 75 75 A L E +BC 53 93A 0 -22,-2.8 -22,-1.6 -2,-0.6 2,-0.4 -0.963 9.1 179.7-111.1 126.7 -9.0 0.3 -7.0 76 76 A R E -BC 52 92A 7 16,-2.5 16,-2.8 -2,-0.5 2,-0.4 -0.980 5.0-178.5-131.5 121.1 -9.3 -1.6 -3.7 77 77 A E E +BC 51 91A 1 -26,-3.0 -27,-2.5 -2,-0.4 -26,-2.0 -0.970 15.8 161.6-120.7 131.6 -9.5 0.1 -0.3 78 78 A I E -BC 49 90A 14 12,-2.7 12,-2.6 -2,-0.4 2,-0.4 -0.929 38.7-132.0-139.4 162.6 -9.8 -1.9 2.8 79 79 A L E -BC 48 89A 19 -31,-2.3 -31,-2.8 -2,-0.3 2,-0.5 -0.977 28.3-148.8-109.3 137.1 -9.3 -1.8 6.6 80 80 A L E -BC 47 88A 6 8,-3.3 7,-3.2 -2,-0.4 8,-1.7 -0.935 16.5-165.8-110.8 122.6 -7.2 -4.8 7.8 81 81 A S E -BC 46 86A 8 -35,-2.8 -35,-2.1 -2,-0.5 2,-0.5 -0.799 17.6-150.4-114.5 153.1 -8.1 -6.2 11.3 82 82 A A E > S-BC 45 85A 1 3,-2.4 3,-1.8 -2,-0.3 -37,-0.2 -0.993 90.7 -16.3-121.5 117.3 -6.3 -8.5 13.7 83 83 A D T 3 S- 0 0 99 -39,-3.0 -1,-0.1 -2,-0.5 -38,-0.1 0.877 132.1 -53.8 47.7 40.6 -8.8 -10.4 15.9 84 84 A G T 3 S+ 0 0 61 -40,-0.5 -1,-0.3 1,-0.2 -39,-0.1 0.469 113.0 118.4 80.1 3.3 -11.3 -7.8 14.8 85 85 A E E < S-C 82 0A 89 -3,-1.8 -3,-2.4 75,-0.0 -1,-0.2 -0.903 70.8-116.2-102.4 127.7 -9.3 -4.7 15.8 86 86 A P E +C 81 0A 64 0, 0.0 74,-0.5 0, 0.0 -5,-0.3 -0.422 43.6 161.6 -68.4 128.0 -8.4 -2.4 12.9 87 87 A W E + 0 0 11 -7,-3.2 71,-2.1 1,-0.3 2,-0.3 0.607 57.9 16.6-117.6 -20.6 -4.7 -2.3 12.4 88 88 A L E -CD 80 157A 5 -8,-1.7 -8,-3.3 69,-0.3 2,-0.4 -0.998 52.4-144.0-155.8 149.7 -4.2 -0.9 8.9 89 89 A A E -CD 79 156A 0 67,-2.2 67,-2.8 -2,-0.3 2,-0.4 -0.957 27.4-166.4-112.6 135.2 -5.8 0.9 6.0 90 90 A G E -CD 78 155A 3 -12,-2.6 -12,-2.7 -2,-0.4 2,-0.4 -0.984 15.1-173.8-129.4 139.3 -4.8 -0.3 2.6 91 91 A R E -CD 77 154A 0 63,-2.6 63,-2.7 -2,-0.4 2,-0.4 -0.978 8.9-174.3-132.9 117.3 -5.3 1.1 -0.9 92 92 A T E -CD 76 153A 10 -16,-2.8 -16,-2.5 -2,-0.4 2,-0.5 -0.937 6.2-169.7-116.2 134.6 -4.2 -0.8 -3.9 93 93 A V E -CD 75 152A 0 59,-2.7 59,-2.9 -2,-0.4 -18,-0.2 -0.986 6.7-176.2-126.6 120.3 -4.3 0.5 -7.5 94 94 A V E -C 74 0A 1 -20,-2.7 -20,-3.1 -2,-0.5 57,-0.2 -0.955 23.6-132.4-121.2 112.6 -3.7 -2.0 -10.3 95 95 A P E >> -C 73 0A 0 0, 0.0 3,-2.2 0, 0.0 4,-0.6 -0.350 24.7-122.0 -56.4 144.5 -3.5 -0.9 -14.0 96 96 A V G >4 S+ 0 0 56 -24,-2.4 3,-1.5 1,-0.3 -23,-0.1 0.878 111.8 67.0 -59.8 -31.7 -5.8 -3.2 -16.1 97 97 A S G 34 S+ 0 0 71 -25,-0.3 -1,-0.3 1,-0.3 -24,-0.1 0.711 95.4 56.9 -60.0 -18.3 -2.6 -4.1 -18.1 98 98 A T G <4 S+ 0 0 1 -3,-2.2 2,-1.7 1,-0.1 -1,-0.3 0.663 83.1 93.5 -84.4 -17.0 -1.2 -5.8 -15.0 99 99 A L << + 0 0 18 -3,-1.5 2,-0.3 -4,-0.6 5,-0.2 -0.533 59.7 106.9 -82.1 83.1 -4.3 -8.1 -14.8 100 100 A S S > S- 0 0 51 -2,-1.7 3,-1.5 0, 0.0 4,-0.1 -0.979 71.9 -3.0-151.4 153.6 -3.0 -11.1 -16.7 101 101 A G G > S- 0 0 45 -2,-0.3 3,-2.2 1,-0.3 4,-0.3 -0.235 132.6 -14.3 59.7-147.5 -1.9 -14.6 -15.7 102 102 A P G > S+ 0 0 61 0, 0.0 3,-1.9 0, 0.0 -1,-0.3 0.800 131.4 71.2 -57.2 -28.3 -1.9 -15.2 -12.0 103 103 A E G X S+ 0 0 0 -3,-1.5 3,-1.8 1,-0.3 -2,-0.2 0.610 73.9 82.9 -68.2 -8.7 -2.2 -11.4 -11.4 104 104 A L G X S+ 0 0 65 -3,-2.2 3,-2.0 1,-0.3 4,-0.3 0.841 79.5 70.8 -59.6 -27.5 -5.8 -11.6 -12.7 105 105 A A G X S+ 0 0 37 -3,-1.9 3,-1.7 -4,-0.3 4,-0.3 0.725 74.8 80.2 -63.8 -19.4 -6.5 -12.6 -9.1 106 106 A L G < S+ 0 0 3 -3,-1.8 -1,-0.3 1,-0.3 3,-0.2 0.716 96.2 45.4 -60.3 -20.2 -5.8 -9.1 -7.9 107 107 A Q G < S+ 0 0 53 -3,-2.0 -1,-0.3 -4,-0.2 -2,-0.2 0.460 113.3 51.4 -99.1 0.4 -9.3 -8.2 -9.0 108 108 A K S < S+ 0 0 144 -3,-1.7 -2,-0.2 -4,-0.3 -1,-0.1 0.165 71.5 108.0-121.5 18.9 -10.9 -11.3 -7.4 109 109 A L > + 0 0 15 -4,-0.3 3,-2.4 -3,-0.2 -1,-0.1 0.850 44.0 170.9 -67.4 -35.6 -9.5 -11.2 -3.8 110 110 A G T 3 S- 0 0 32 1,-0.3 -1,-0.2 -3,-0.1 -2,-0.0 -0.352 75.0 -14.0 56.7-135.4 -12.8 -10.2 -2.2 111 111 A K T 3 S+ 0 0 145 2,-0.1 -64,-0.5 -62,-0.1 -1,-0.3 0.379 108.5 113.3 -80.8 8.4 -12.3 -10.5 1.5 112 112 A T S < S- 0 0 63 -3,-2.4 2,-0.3 -4,-0.1 -66,-0.1 -0.694 73.8-121.7 -76.6 128.0 -9.1 -12.5 1.1 113 113 A P - 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