==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE,LYASE 06-JAN-00 1DS1 . COMPND 2 MOLECULE: CLAVAMINATE SYNTHASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES CLAVULIGERUS; . AUTHOR Z.H.ZHANG,J.REN,D.K.STAMMERS,J.E.BALDWIN,K.HARLOS,C.J.SCHOFI . 323 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13491.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 201 62.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 3.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 54 16.7 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 . 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 . 17 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 63 19.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 1 0 0 1 0 1 0 0 1 2 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 3 3 1 2 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 2 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 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 2 A T 0 0 69 0, 0.0 62,-2.8 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 145.5 -13.9 -10.4 5.4 2 3 A S E -a 63 0A 78 60,-0.2 2,-0.4 62,-0.0 62,-0.2 -0.956 360.0-165.0-129.9 146.7 -16.4 -8.7 7.8 3 4 A V E -a 64 0A 25 60,-2.6 62,-2.7 -2,-0.3 2,-0.7 -0.992 17.8-141.0-129.1 126.5 -17.6 -9.2 11.3 4 5 A D E +a 65 0A 114 -2,-0.4 3,-0.3 60,-0.2 62,-0.2 -0.737 21.5 178.4 -85.0 112.3 -20.7 -7.6 12.6 5 6 A C > + 0 0 0 60,-3.0 3,-1.9 -2,-0.7 4,-0.2 0.293 44.8 111.3 -99.7 6.6 -19.9 -6.6 16.2 6 7 A T G > S+ 0 0 86 1,-0.3 3,-1.8 59,-0.3 -1,-0.2 0.872 75.2 53.3 -51.1 -45.2 -23.2 -4.9 17.1 7 8 A A G 3 S+ 0 0 88 -3,-0.3 -1,-0.3 1,-0.3 4,-0.2 0.665 102.9 61.3 -69.2 -14.4 -24.3 -7.6 19.5 8 9 A Y G <> S+ 0 0 51 -3,-1.9 4,-2.6 1,-0.2 -1,-0.3 0.329 70.6 108.2 -89.2 3.1 -21.0 -7.2 21.4 9 10 A G H <> S+ 0 0 8 -3,-1.8 4,-2.7 1,-0.2 5,-0.2 0.881 77.7 46.3 -53.9 -52.4 -21.5 -3.6 22.3 10 11 A P H > S+ 0 0 100 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.930 116.1 45.1 -56.6 -47.6 -22.1 -4.0 26.0 11 12 A E H > S+ 0 0 108 -4,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.879 114.9 47.9 -63.0 -38.2 -19.1 -6.3 26.4 12 13 A L H X S+ 0 0 2 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.860 108.4 53.5 -76.5 -34.7 -16.8 -4.1 24.4 13 14 A R H X S+ 0 0 141 -4,-2.7 4,-1.6 -5,-0.3 -1,-0.2 0.910 110.5 49.8 -62.0 -40.4 -17.9 -0.9 26.2 14 15 A A H X S+ 0 0 58 -4,-2.0 4,-0.8 -5,-0.2 3,-0.3 0.956 109.2 49.1 -62.9 -48.9 -17.0 -2.8 29.4 15 16 A L H >< S+ 0 0 7 -4,-2.3 3,-1.2 1,-0.2 4,-0.4 0.906 109.2 53.5 -58.8 -40.0 -13.6 -3.9 28.2 16 17 A A H >< S+ 0 0 8 -4,-2.4 3,-1.6 1,-0.2 -1,-0.2 0.885 102.1 59.5 -60.0 -35.1 -12.9 -0.3 27.1 17 18 A A H 3< S+ 0 0 69 -4,-1.6 -1,-0.2 -3,-0.3 -2,-0.2 0.661 93.9 66.0 -69.8 -13.9 -13.7 0.9 30.7 18 19 A R T << S+ 0 0 143 -3,-1.2 -1,-0.3 -4,-0.8 -2,-0.2 0.694 88.7 91.1 -74.0 -20.4 -10.9 -1.3 32.0 19 20 A L S < S- 0 0 5 -3,-1.6 11,-0.1 -4,-0.4 71,-0.1 -0.456 90.1 -92.3 -88.2 149.1 -8.3 0.9 30.2 20 21 A P - 0 0 54 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.278 31.4-135.7 -51.7 141.8 -6.4 3.9 31.5 21 22 A R S S+ 0 0 132 1,-0.2 69,-2.8 68,-0.1 -2,-0.0 0.602 97.0 47.0 -80.4 -15.1 -8.3 7.1 30.6 22 23 A T S >> S+ 0 0 55 67,-0.2 3,-1.3 1,-0.1 4,-0.6 -0.765 72.0 180.0-124.5 79.8 -5.2 9.1 29.5 23 24 A P G >4 S+ 0 0 2 0, 0.0 3,-1.0 0, 0.0 7,-0.4 0.840 73.2 51.7 -57.5 -42.2 -3.5 6.6 27.1 24 25 A R G >4 S+ 0 0 39 64,-0.4 3,-0.7 62,-0.4 63,-0.1 0.695 93.3 72.5 -73.6 -20.6 -0.5 8.6 26.0 25 26 A A G <4 S+ 0 0 62 -3,-1.3 -1,-0.2 61,-0.4 62,-0.1 0.743 125.9 4.5 -64.6 -26.0 0.6 9.6 29.6 26 27 A D G S+ 0 0 32 -3,-0.7 4,-2.6 1,-0.2 5,-0.2 0.854 76.1 57.3 -69.6 -33.5 1.3 4.3 26.8 28 29 A Y H > S+ 0 0 78 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.943 110.6 43.6 -61.9 -44.3 3.2 1.1 27.8 29 30 A A H > S+ 0 0 43 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.875 112.6 53.9 -65.9 -39.5 0.8 0.6 30.8 30 31 A F H X S+ 0 0 0 -4,-2.3 4,-2.1 -7,-0.4 -2,-0.2 0.943 111.3 44.2 -57.3 -48.6 -2.2 1.4 28.6 31 32 A L H X S+ 0 0 0 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.833 110.6 54.7 -73.7 -29.0 -1.3 -1.2 26.0 32 33 A D H X S+ 0 0 102 -4,-2.0 4,-2.3 -5,-0.2 -1,-0.2 0.923 109.1 48.7 -66.2 -41.9 -0.5 -3.8 28.7 33 34 A A H X S+ 0 0 27 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.916 110.0 52.4 -60.2 -40.9 -3.9 -3.2 30.1 34 35 A A H X S+ 0 0 0 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.883 107.2 52.4 -64.0 -37.5 -5.3 -3.6 26.6 35 36 A H H X S+ 0 0 87 -4,-2.0 4,-0.8 2,-0.2 -2,-0.2 0.935 110.3 47.2 -63.7 -43.9 -3.5 -7.0 26.2 36 37 A T H >< S+ 0 0 86 -4,-2.3 3,-1.0 1,-0.2 4,-0.2 0.940 113.7 47.8 -62.7 -46.0 -4.9 -8.3 29.4 37 38 A A H >< S+ 0 0 1 -4,-2.5 3,-2.1 1,-0.2 -1,-0.2 0.808 99.7 68.8 -64.4 -31.0 -8.4 -7.2 28.4 38 39 A A H >< S+ 0 0 2 -4,-1.9 3,-1.4 1,-0.3 -1,-0.2 0.762 86.4 67.6 -62.7 -24.0 -8.0 -8.7 24.9 39 40 A A T << S+ 0 0 78 -3,-1.0 -1,-0.3 -4,-0.8 -2,-0.2 0.691 99.2 52.9 -64.7 -16.5 -8.0 -12.2 26.5 40 41 A S T < S+ 0 0 59 -3,-2.1 -1,-0.2 -4,-0.2 -2,-0.2 0.196 76.5 132.9-106.6 12.0 -11.7 -11.4 27.3 41 42 A L S < S- 0 0 11 -3,-1.4 5,-0.1 1,-0.1 -3,-0.0 -0.372 75.4 -83.4 -59.0 145.6 -12.8 -10.5 23.8 42 43 A P >> - 0 0 10 0, 0.0 4,-2.7 0, 0.0 3,-0.7 -0.235 46.2-114.7 -50.6 138.9 -16.1 -12.2 22.8 43 44 A G H 3> S+ 0 0 53 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.865 111.1 47.9 -50.9 -44.5 -15.3 -15.7 21.6 44 45 A A H 3> S+ 0 0 61 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.883 113.5 49.4 -72.6 -29.4 -16.3 -15.3 18.0 45 46 A L H <> S+ 0 0 0 -3,-0.7 4,-2.5 2,-0.2 5,-0.2 0.926 111.0 49.7 -69.6 -44.3 -14.4 -12.0 17.6 46 47 A A H X S+ 0 0 7 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.911 111.2 49.8 -57.3 -42.7 -11.3 -13.6 19.1 47 48 A T H X S+ 0 0 87 -4,-2.6 4,-2.6 -5,-0.2 5,-0.3 0.927 110.3 49.4 -63.7 -46.1 -11.6 -16.5 16.7 48 49 A A H X S+ 0 0 24 -4,-2.0 4,-2.3 -5,-0.2 -2,-0.2 0.919 113.8 46.7 -60.1 -41.5 -12.0 -14.2 13.7 49 50 A L H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.931 113.6 46.4 -65.9 -46.5 -8.9 -12.2 14.8 50 51 A D H X S+ 0 0 67 -4,-2.6 4,-2.3 -5,-0.2 5,-0.2 0.890 113.3 49.9 -66.5 -38.6 -6.7 -15.2 15.5 51 52 A T H X S+ 0 0 62 -4,-2.6 4,-2.8 -5,-0.2 5,-0.5 0.941 113.4 45.6 -64.4 -47.2 -7.7 -16.9 12.2 52 53 A F H X S+ 0 0 7 -4,-2.3 4,-2.1 -5,-0.3 -2,-0.2 0.911 112.2 52.5 -63.6 -39.4 -7.0 -13.7 10.2 53 54 A N H < S+ 0 0 31 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.948 118.1 35.0 -59.9 -47.8 -3.7 -13.2 12.1 54 55 A A H < S+ 0 0 71 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.893 136.4 17.7 -73.3 -41.0 -2.4 -16.7 11.3 55 56 A E H < S- 0 0 120 -4,-2.8 -3,-0.2 1,-0.2 -2,-0.2 0.562 83.0-150.4-110.4 -16.6 -3.9 -17.2 7.9 56 57 A G < - 0 0 8 -4,-2.1 2,-0.3 -5,-0.5 -1,-0.2 -0.343 29.3-100.3 61.5-157.7 -4.8 -13.9 6.4 57 58 A S > - 0 0 17 1,-0.1 3,-0.5 215,-0.0 120,-0.2 -0.947 19.3-104.7-149.2 170.4 -7.7 -14.1 3.9 58 59 A E T 3 S+ 0 0 126 -2,-0.3 120,-0.3 1,-0.2 119,-0.3 0.911 122.6 45.1 -64.1 -38.3 -8.3 -14.1 0.2 59 60 A D T 3 S- 0 0 31 2,-0.2 -1,-0.2 118,-0.1 200,-0.1 0.476 106.2-129.5 -90.6 1.9 -9.4 -10.5 0.2 60 61 A G S < S+ 0 0 0 -3,-0.5 212,-2.4 1,-0.1 2,-0.3 0.598 71.4 75.9 67.5 17.5 -6.6 -9.3 2.5 61 62 A H E - B 0 271A 8 210,-0.2 2,-0.4 112,-0.1 210,-0.2 -0.995 58.1-148.0-152.8 157.9 -8.6 -7.5 5.2 62 63 A L E - B 0 270A 2 208,-2.3 208,-2.8 -2,-0.3 2,-0.6 -0.984 18.0-163.1-129.0 117.0 -10.8 -7.9 8.2 63 64 A L E -aB 2 269A 3 -62,-2.8 -60,-2.6 -2,-0.4 2,-0.6 -0.914 3.0-161.1-105.7 117.2 -13.5 -5.3 8.7 64 65 A L E -aB 3 268A 0 204,-3.0 204,-2.5 -2,-0.6 2,-0.3 -0.882 16.9-166.8 -95.1 123.0 -15.1 -5.0 12.1 65 66 A R E +a 4 0A 81 -62,-2.7 -60,-3.0 -2,-0.6 -59,-0.3 -0.865 56.3 23.2-116.1 147.5 -18.4 -3.2 11.9 66 67 A G S S+ 0 0 33 -2,-0.3 201,-0.2 199,-0.2 -1,-0.2 0.760 70.2 162.3 77.0 25.4 -20.7 -1.7 14.6 67 68 A L - 0 0 6 199,-2.4 -1,-0.2 -3,-0.2 2,-0.1 -0.342 54.5 -86.0 -68.7 155.1 -18.1 -1.2 17.4 68 69 A P + 0 0 5 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.390 58.9 169.6 -66.3 129.6 -19.2 1.2 20.1 69 70 A V - 0 0 28 196,-0.1 3,-0.1 -2,-0.1 92,-0.1 -0.978 38.5 -97.3-130.2 147.3 -18.3 4.7 19.1 70 71 A E - 0 0 40 -2,-0.3 5,-0.1 1,-0.1 2,-0.0 -0.309 45.8 -96.7 -57.1 148.5 -19.4 7.9 20.7 71 72 A A > - 0 0 60 1,-0.1 3,-2.1 3,-0.1 4,-0.4 -0.367 41.2-109.0 -58.1 148.7 -22.3 9.8 19.3 72 73 A D G > S+ 0 0 76 1,-0.3 3,-1.4 2,-0.2 -1,-0.1 0.867 119.2 54.6 -54.4 -37.0 -21.1 12.5 17.0 73 74 A A G 3 S+ 0 0 88 1,-0.3 -1,-0.3 0, 0.0 -2,-0.0 0.651 104.3 56.6 -71.8 -14.9 -22.0 15.3 19.5 74 75 A D G < S+ 0 0 124 -3,-2.1 -1,-0.3 2,-0.0 -2,-0.2 0.336 90.7 90.4 -99.3 3.2 -20.0 13.6 22.2 75 76 A L S < S- 0 0 16 -3,-1.4 3,-0.1 -4,-0.4 16,-0.0 -0.638 81.8-106.2 -88.8 154.8 -16.7 13.6 20.3 76 77 A P - 0 0 55 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.195 53.6 -73.2 -61.1 169.4 -14.1 16.3 20.4 77 78 A T - 0 0 103 1,-0.1 213,-0.2 213,-0.0 3,-0.1 -0.395 64.4 -92.7 -55.0 137.1 -13.7 18.7 17.5 78 79 A T - 0 0 13 211,-2.6 -1,-0.1 -3,-0.1 213,-0.1 -0.404 55.5-100.0 -55.5 133.0 -11.9 16.9 14.6 79 80 A P - 0 0 25 0, 0.0 -1,-0.1 0, 0.0 210,-0.1 -0.175 30.3-167.5 -57.7 152.1 -8.2 17.5 15.1 80 81 A S + 0 0 99 -3,-0.1 2,-0.3 1,-0.1 -2,-0.1 0.378 67.5 25.6-113.8 -6.8 -6.4 20.2 13.0 81 82 A S S S- 0 0 69 44,-0.0 40,-0.1 2,-0.0 -1,-0.1 -0.919 76.3 -91.2-159.9 167.0 -2.8 19.2 13.8 82 83 A T S S+ 0 0 51 -2,-0.3 2,-0.1 2,-0.1 33,-0.1 -0.969 83.7 46.8-138.7 143.0 -0.3 16.5 14.8 83 84 A P S S- 0 0 61 0, 0.0 32,-0.1 0, 0.0 37,-0.1 0.503 81.2-128.4 -76.8 166.7 0.9 15.3 17.3 84 85 A A - 0 0 20 35,-0.3 2,-0.1 -2,-0.1 -2,-0.1 -0.494 33.6 -90.6 -74.0 152.1 -2.0 14.8 19.6 85 86 A P > - 0 0 71 0, 0.0 3,-1.9 0, 0.0 -61,-0.2 -0.393 27.2-135.3 -60.6 136.1 -1.9 16.2 23.1 86 87 A E T 3 S+ 0 0 124 1,-0.3 -61,-0.4 -2,-0.1 -62,-0.4 0.809 105.6 57.6 -62.8 -28.2 -0.5 13.6 25.6 87 88 A D T 3 S+ 0 0 122 -63,-0.1 -1,-0.3 -64,-0.1 2,-0.1 0.456 75.1 130.5 -82.1 1.3 -3.3 14.6 28.0 88 89 A R < - 0 0 33 -3,-1.9 -64,-0.4 1,-0.1 -63,-0.1 -0.304 61.9-117.7 -64.0 130.5 -6.1 13.8 25.5 89 90 A S - 0 0 83 -67,-0.1 -67,-0.2 1,-0.1 -1,-0.1 -0.332 39.9 -84.7 -69.3 149.0 -8.8 11.6 27.1 90 91 A L - 0 0 21 -69,-2.8 2,-0.3 -71,-0.1 -1,-0.1 -0.281 37.7-149.3 -51.8 133.6 -9.4 8.1 25.7 91 92 A L >> - 0 0 9 -3,-0.1 4,-2.0 1,-0.1 3,-0.7 -0.788 21.8-121.7-101.5 145.9 -11.8 7.8 22.7 92 93 A T H 3> S+ 0 0 29 -2,-0.3 4,-2.3 1,-0.3 5,-0.2 0.885 112.6 52.5 -61.2 -37.9 -13.7 4.5 22.4 93 94 A M H 3> S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.830 107.5 53.1 -68.9 -27.3 -12.3 3.7 18.9 94 95 A E H <> S+ 0 0 1 -3,-0.7 4,-1.8 2,-0.2 -1,-0.2 0.884 107.2 51.9 -65.2 -41.3 -8.8 4.2 20.4 95 96 A A H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.916 108.5 51.5 -58.1 -44.6 -9.8 1.7 23.1 96 97 A M H X>S+ 0 0 1 -4,-2.3 4,-2.9 1,-0.2 5,-0.5 0.921 107.7 51.4 -60.4 -43.0 -10.9 -0.7 20.3 97 98 A L H X5S+ 0 0 0 -4,-2.1 4,-1.3 1,-0.2 -1,-0.2 0.842 110.0 51.4 -63.8 -30.8 -7.6 -0.3 18.5 98 99 A G H X5S+ 0 0 0 -4,-1.8 4,-2.3 3,-0.2 -2,-0.2 0.961 115.9 38.8 -64.1 -54.5 -5.9 -1.2 21.8 99 100 A L H X5S+ 0 0 0 -4,-2.5 4,-1.6 2,-0.2 -2,-0.2 0.946 123.2 39.2 -63.5 -54.9 -7.9 -4.3 22.4 100 101 A V H X5S+ 0 0 2 -4,-2.9 4,-1.4 -5,-0.2 -3,-0.2 0.920 115.8 53.6 -65.2 -40.4 -8.0 -5.6 18.8 101 102 A G H X -g 317 0B 0 7,-0.6 3,-1.9 3,-0.4 6,-0.6 -0.987 14.1-138.0-124.5 117.6 8.2 5.1 13.7 111 112 A R T 3 S+ 0 0 141 206,-2.8 207,-0.1 -2,-0.5 -1,-0.1 0.826 99.7 43.6 -51.5 -43.5 10.6 7.7 15.0 112 113 A E T 3 S+ 0 0 74 205,-0.3 2,-0.4 3,-0.1 -1,-0.3 0.545 102.8 80.5 -80.6 -10.6 10.7 9.9 12.0 113 114 A L S X S- 0 0 26 -3,-1.9 3,-1.6 1,-0.2 4,-0.5 -0.853 106.3 -11.5-108.8 129.4 7.0 9.8 11.3 114 115 A R G > S- 0 0 35 -2,-0.4 3,-1.8 1,-0.3 -1,-0.2 0.896 123.9 -59.4 51.3 45.1 4.2 11.8 13.1 115 116 A S G 3 S- 0 0 83 -3,-0.3 -1,-0.3 1,-0.3 -3,-0.1 0.750 94.5 -66.2 63.3 22.9 6.7 13.0 15.8 116 117 A G G < S+ 0 0 7 -3,-1.6 -1,-0.3 -6,-0.6 -2,-0.2 0.724 95.4 147.1 69.1 24.3 7.4 9.4 16.8 117 118 A T < - 0 0 41 -3,-1.8 -7,-0.6 -4,-0.5 -1,-0.2 -0.363 44.4-147.7 -88.1 168.0 3.9 8.9 18.1 118 119 A V S S+ 0 0 7 1,-0.2 2,-0.6 -9,-0.2 180,-0.3 0.824 82.3 56.8-102.3 -49.5 1.9 5.6 18.0 119 120 A Y S S- 0 0 12 178,-0.1 2,-0.5 -12,-0.1 -35,-0.3 -0.847 73.0-165.3 -88.6 123.0 -1.7 6.6 17.6 120 121 A H E -D 296 0A 1 176,-2.7 176,-2.7 -2,-0.6 2,-0.4 -0.912 14.5-141.3-113.3 124.6 -2.2 8.8 14.5 121 122 A D E -D 295 0A 4 -2,-0.5 2,-0.6 174,-0.2 174,-0.2 -0.687 14.1-154.1 -75.3 136.0 -5.3 10.9 13.8 122 123 A V E +D 294 0A 10 172,-3.1 172,-2.4 -2,-0.4 12,-0.1 -0.944 34.9 141.8-116.2 108.1 -6.1 10.8 10.1 123 124 A Y - 0 0 7 -2,-0.6 2,-0.2 170,-0.2 170,-0.1 -0.945 53.5 -94.1-141.1 154.8 -8.0 14.0 9.1 124 125 A P - 0 0 9 0, 0.0 11,-0.2 0, 0.0 10,-0.1 -0.468 39.3-173.5 -76.1 146.0 -8.0 16.3 6.1 125 126 A S > - 0 0 28 9,-1.9 3,-0.9 -2,-0.2 11,-0.1 -0.998 29.7-102.1-135.0 143.0 -5.7 19.3 6.1 126 127 A P T 3 S+ 0 0 94 0, 0.0 9,-0.0 0, 0.0 8,-0.0 -0.278 103.3 18.8 -62.3 143.1 -5.4 22.2 3.5 127 128 A G T 3 S- 0 0 87 1,-0.2 8,-0.1 7,-0.0 7,-0.0 0.762 86.7-176.1 74.9 22.3 -2.5 22.1 1.2 128 129 A A < - 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