==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 13-MAY-11 3AYQ . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: MERETRIX LUSORIA; . AUTHOR K.YONEDA,Y.KUWANO,T.USUI,M.OGATA,A.SUZUKI,T.ARAKI . 122 1 7 7 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6372.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 78 63.9 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 . 8 6.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.8 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 0.8 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 . 2 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 47 38.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 3.3 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 1 1 0 0 1 1 0 1 0 0 0 0 0 0 1 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 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 F 0 0 74 0, 0.0 62,-0.1 0, 0.0 7,-0.1 0.000 360.0 360.0 360.0 174.6 18.4 -12.8 2.5 2 2 A A - 0 0 0 61,-0.4 2,-0.1 60,-0.3 62,-0.0 -0.294 360.0-114.1 -62.3 150.8 21.4 -10.7 3.4 3 3 A G + 0 0 53 2,-0.1 2,-0.3 5,-0.0 -1,-0.1 -0.381 58.3 102.1 -85.1 166.9 20.7 -7.8 5.8 4 4 A G S S- 0 0 58 2,-0.2 4,-0.1 -2,-0.1 67,-0.1 -0.991 83.5 -39.4 156.9-158.7 21.0 -4.1 5.0 5 5 A T S S+ 0 0 74 -2,-0.3 2,-0.4 65,-0.2 -1,-0.1 0.619 110.8 81.8 -77.3 -13.4 18.9 -1.0 4.2 6 6 A V S S- 0 0 3 1,-0.0 -2,-0.2 83,-0.0 64,-0.1 -0.804 85.6-120.9 -94.7 132.0 16.5 -3.0 2.0 7 7 A S > - 0 0 39 -2,-0.4 4,-2.4 1,-0.1 5,-0.2 -0.280 15.3-120.7 -69.7 156.6 13.8 -5.0 3.9 8 8 A Q H > S+ 0 0 89 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.855 115.4 53.7 -65.0 -35.0 13.5 -8.7 3.6 9 9 A R H > S+ 0 0 203 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.867 109.4 48.3 -67.3 -36.2 9.9 -8.3 2.2 10 10 A a H > S+ 0 0 0 112,-0.3 4,-2.7 2,-0.2 5,-0.2 0.933 112.1 48.0 -68.6 -46.1 11.2 -6.0 -0.5 11 11 A L H X S+ 0 0 0 -4,-2.4 4,-3.0 1,-0.2 -2,-0.2 0.897 110.9 52.0 -61.3 -40.8 14.1 -8.3 -1.4 12 12 A S H X S+ 0 0 35 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.932 110.8 48.0 -61.2 -45.4 11.6 -11.2 -1.6 13 13 A b H X S+ 0 0 4 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.917 114.0 45.4 -62.9 -43.2 9.3 -9.2 -3.9 14 14 A I H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.923 112.1 52.6 -66.0 -42.0 12.2 -8.2 -6.2 15 15 A c H X S+ 0 0 0 -4,-3.0 6,-2.2 1,-0.2 4,-2.1 0.913 112.0 45.3 -59.7 -43.5 13.5 -11.8 -6.2 16 16 A K H X S+ 0 0 89 -4,-2.6 4,-2.0 4,-0.3 -1,-0.2 0.894 111.6 53.0 -67.1 -39.7 10.1 -13.1 -7.2 17 17 A M H < S+ 0 0 49 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.889 114.5 41.2 -62.2 -40.9 9.7 -10.3 -9.8 18 18 A E H < S- 0 0 46 -4,-2.5 -2,-0.2 19,-0.2 -1,-0.2 0.852 143.9 -11.6 -78.6 -37.2 13.1 -11.2 -11.4 19 19 A S H < S- 0 0 17 -4,-2.1 -3,-0.2 18,-0.3 -2,-0.2 0.253 91.7 -96.0-151.0 14.7 13.0 -15.0 -11.4 20 20 A G S < S- 0 0 40 -4,-2.0 -4,-0.3 -5,-0.4 -3,-0.1 0.762 84.1 -70.7 66.1 22.2 10.1 -16.2 -9.2 21 21 A c S S+ 0 0 39 -6,-2.2 2,-0.3 16,-0.4 -1,-0.2 0.960 105.7 121.7 52.1 64.7 13.1 -16.3 -6.7 22 22 A R S S- 0 0 174 -7,-0.3 2,-1.9 15,-0.2 -1,-0.2 -0.940 78.0 -99.2-144.2 159.7 14.8 -19.3 -8.3 23 23 A N + 0 0 88 -2,-0.3 37,-0.1 1,-0.2 14,-0.0 -0.605 54.7 162.2 -85.3 81.9 18.3 -19.8 -9.8 24 24 A V - 0 0 79 -2,-1.9 2,-0.2 1,-0.3 -1,-0.2 0.496 37.9-132.3 -81.6 -6.9 17.1 -19.4 -13.3 25 25 A G - 0 0 31 -3,-0.1 11,-1.6 34,-0.1 -1,-0.3 -0.579 43.2 -41.2 88.1-154.3 20.4 -18.8 -15.0 26 26 A d E -A 35 0A 62 9,-0.2 2,-0.3 -2,-0.2 9,-0.2 -0.683 40.5-175.2-117.6 169.1 20.9 -15.9 -17.5 27 27 A K E -A 34 0A 118 7,-1.6 7,-2.7 -2,-0.2 2,-0.4 -0.972 34.7-102.3-153.2 153.9 19.2 -14.1 -20.3 28 28 A M E +A 33 0A 118 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.675 37.9 176.6 -84.9 131.2 20.2 -11.3 -22.7 29 29 A D E > -A 32 0A 72 3,-2.1 3,-1.3 -2,-0.4 -2,-0.0 -0.869 64.2 -34.8-141.3 107.0 18.8 -7.8 -21.9 30 30 A M T 3 S- 0 0 170 -2,-0.4 3,-0.1 1,-0.3 -1,-0.0 0.899 127.8 -33.1 51.3 51.0 19.8 -4.7 -23.9 31 31 A G T 3 S+ 0 0 72 1,-0.1 2,-0.3 0, 0.0 -1,-0.3 0.173 126.4 65.4 98.5 -20.0 23.3 -5.7 -24.6 32 32 A S E < S-A 29 0A 46 -3,-1.3 -3,-2.1 -5,-0.0 2,-0.2 -0.988 78.9-106.0-141.6 151.3 24.3 -7.6 -21.4 33 33 A L E -A 28 0A 58 -2,-0.3 9,-0.6 -5,-0.2 2,-0.4 -0.486 24.3-157.0 -73.4 137.0 23.4 -10.9 -19.6 34 34 A S E -AB 27 41A 7 -7,-2.7 -7,-1.6 -2,-0.2 2,-0.3 -0.955 22.9-162.4-111.5 133.1 21.3 -10.6 -16.4 35 35 A d E > -AB 26 40A 3 5,-1.8 5,-2.0 -2,-0.4 3,-0.4 -0.900 23.0 -18.6-129.7 154.9 21.7 -13.7 -14.2 36 36 A G T > 5S- 0 0 1 -11,-1.6 3,-1.2 -2,-0.3 24,-0.2 -0.054 101.0 -15.8 67.5-161.5 20.3 -15.6 -11.2 37 37 A Y T 3 5S+ 0 0 53 22,-1.4 -16,-0.4 1,-0.3 -18,-0.3 0.816 143.6 26.5 -48.1 -44.1 17.8 -14.9 -8.5 38 38 A F T 3 5S- 0 0 0 -3,-0.4 -1,-0.3 21,-0.4 -2,-0.2 0.283 104.2-121.6-107.8 9.7 17.9 -11.1 -8.9 39 39 A Q T < 5 - 0 0 20 -3,-1.2 2,-0.4 20,-0.2 -3,-0.2 0.930 44.5-176.2 48.5 55.9 18.9 -11.1 -12.6 40 40 A I E < -B 35 0A 4 -5,-2.0 -5,-1.8 -6,-0.1 -1,-0.2 -0.672 16.9-141.3 -88.1 132.5 22.0 -9.1 -11.9 41 41 A K E > -B 34 0A 48 -2,-0.4 4,-2.2 -7,-0.2 3,-0.3 -0.508 27.7-107.0 -87.0 161.0 24.2 -7.9 -14.7 42 42 A E H > S+ 0 0 101 -9,-0.6 4,-2.2 1,-0.2 5,-0.2 0.879 118.3 53.5 -56.2 -42.6 28.0 -7.9 -14.5 43 43 A A H > S+ 0 0 66 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.873 109.3 49.2 -61.3 -38.2 28.3 -4.1 -14.2 44 44 A Y H > S+ 0 0 19 -3,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.915 110.4 51.1 -65.9 -43.6 25.9 -4.1 -11.3 45 45 A W H <>S+ 0 0 27 -4,-2.2 5,-2.3 2,-0.2 -2,-0.2 0.856 110.5 49.1 -62.3 -37.7 27.9 -6.9 -9.7 46 46 A I H ><5S+ 0 0 54 -4,-2.2 3,-1.7 1,-0.2 -2,-0.2 0.948 111.0 49.8 -66.9 -47.9 31.1 -4.8 -10.1 47 47 A D H 3<5S+ 0 0 44 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.775 105.2 57.2 -63.4 -27.6 29.4 -1.8 -8.6 48 48 A e T 3<5S- 0 0 4 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.329 130.9 -87.5 -87.2 9.5 28.1 -3.7 -5.5 49 49 A G T < 5 - 0 0 56 -3,-1.7 -3,-0.2 1,-0.1 -2,-0.2 0.642 53.8 -88.6 100.6 15.3 31.7 -4.8 -4.7 50 50 A R < - 0 0 148 -5,-2.3 -4,-0.1 -6,-0.2 -1,-0.1 0.896 63.5-172.7 50.0 47.8 32.3 -8.0 -6.6 51 51 A P + 0 0 18 0, 0.0 3,-0.3 0, 0.0 7,-0.2 -0.244 42.3 24.2 -69.7 161.5 30.9 -10.2 -3.8 52 52 A G S S- 0 0 53 1,-0.2 3,-0.1 6,-0.1 5,-0.0 -0.212 108.3 -61.7 79.6-174.5 31.2 -14.0 -4.0 53 53 A S S S- 0 0 106 1,-0.2 2,-0.3 2,-0.0 -1,-0.2 0.659 114.0 -15.3 -83.5 -17.3 33.7 -16.1 -5.9 54 54 A S S > S- 0 0 48 -3,-0.3 4,-2.4 1,-0.1 -1,-0.2 -0.965 73.6 -92.9-172.0 169.9 32.5 -14.7 -9.3 55 55 A W H > S+ 0 0 31 -2,-0.3 4,-2.5 1,-0.2 5,-0.1 0.960 122.5 37.3 -60.7 -55.4 29.7 -12.8 -10.9 56 56 A K H > S+ 0 0 114 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.828 116.2 53.4 -69.6 -31.6 27.7 -15.8 -12.1 57 57 A S H 4 S+ 0 0 57 2,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.938 113.1 44.0 -66.8 -45.4 28.5 -17.8 -9.0 58 58 A f H >< S+ 0 0 3 -4,-2.4 3,-1.9 -7,-0.2 7,-0.7 0.912 110.4 54.7 -63.6 -44.7 27.2 -14.9 -6.8 59 59 A A H 3< S+ 0 0 2 -4,-2.5 -22,-1.4 1,-0.3 -21,-0.4 0.817 103.8 56.3 -59.9 -31.4 24.2 -14.4 -9.0 60 60 A A T 3< S+ 0 0 35 -4,-1.4 2,-0.5 -24,-0.2 -1,-0.3 0.426 95.5 80.1 -81.7 0.1 23.2 -18.0 -8.6 61 61 A S <> - 0 0 46 -3,-1.9 4,-2.6 1,-0.1 5,-0.3 -0.940 69.1-152.4-109.9 126.2 23.2 -17.6 -4.8 62 62 A S H > S+ 0 0 48 -2,-0.5 4,-2.0 2,-0.2 -60,-0.3 0.893 99.1 46.2 -63.2 -37.7 20.1 -16.0 -3.2 63 63 A Y H > S+ 0 0 134 2,-0.2 4,-2.1 1,-0.2 -61,-0.4 0.950 115.4 42.4 -70.0 -51.6 22.3 -14.8 -0.3 64 64 A f H > S+ 0 0 15 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.917 116.0 49.9 -62.2 -43.8 25.2 -13.4 -2.4 65 65 A A H X S+ 0 0 0 -4,-2.6 4,-1.8 -7,-0.7 -1,-0.2 0.919 112.1 47.7 -61.4 -43.6 22.8 -11.8 -4.9 66 66 A S H X S+ 0 0 0 -4,-2.0 4,-2.4 -5,-0.3 -1,-0.2 0.843 109.5 53.2 -68.1 -31.0 20.8 -10.2 -2.1 67 67 A L H X S+ 0 0 50 -4,-2.1 4,-2.8 2,-0.2 -1,-0.2 0.901 106.6 53.3 -68.7 -37.8 23.9 -8.9 -0.5 68 68 A e H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.898 109.2 48.5 -62.1 -40.8 24.9 -7.4 -3.8 69 69 A V H X S+ 0 0 0 -4,-1.8 4,-2.3 2,-0.2 5,-0.2 0.929 110.6 51.6 -64.7 -44.8 21.5 -5.6 -4.0 70 70 A Q H X S+ 0 0 4 -4,-2.4 4,-1.7 1,-0.2 -65,-0.2 0.931 113.3 44.2 -57.3 -47.6 22.0 -4.4 -0.4 71 71 A N H X S+ 0 0 66 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.848 110.9 54.6 -67.1 -35.0 25.4 -3.0 -1.3 72 72 A Y H X S+ 0 0 8 -4,-2.3 4,-2.5 -5,-0.2 5,-0.4 0.895 110.5 45.5 -66.2 -39.8 24.2 -1.4 -4.5 73 73 A M H X>S+ 0 0 2 -4,-2.3 4,-1.1 2,-0.2 5,-0.6 0.843 110.1 53.7 -73.0 -32.7 21.4 0.4 -2.7 74 74 A K H <5S+ 0 0 152 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.858 114.7 44.0 -68.3 -32.3 23.8 1.6 0.1 75 75 A R H <5S+ 0 0 138 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.912 132.2 12.4 -78.3 -43.8 26.0 3.0 -2.7 76 76 A Y H X5S+ 0 0 31 -4,-2.5 4,-2.9 -5,-0.1 5,-0.3 0.788 103.1 79.0-107.8 -33.7 23.5 4.6 -4.9 77 77 A A H X>S+ 0 0 1 -4,-1.1 5,-2.6 -5,-0.4 4,-0.6 0.899 104.6 33.2 -45.1 -63.0 20.0 5.0 -3.3 78 78 A K H >4> S- 0 0 114 -2,-1.9 4,-2.4 37,-0.1 3,-0.8 -0.829 102.1 -80.2-141.7 176.1 11.9 2.1 0.7 86 86 A a H 3> S+ 0 0 0 -2,-0.3 4,-3.6 1,-0.2 5,-0.4 0.844 122.8 63.9 -54.2 -38.4 11.1 -0.6 -1.8 87 87 A E H 3> S+ 0 0 72 34,-0.3 4,-1.3 1,-0.2 -1,-0.2 0.919 113.0 35.6 -52.4 -45.2 9.6 1.8 -4.3 88 88 A G H <> S+ 0 0 0 -3,-0.8 4,-2.0 -5,-0.3 -2,-0.2 0.906 118.8 49.8 -75.2 -42.7 13.0 3.4 -4.6 89 89 A F H X S+ 0 0 1 -4,-2.4 4,-2.2 -6,-0.2 -2,-0.2 0.894 109.9 50.4 -64.4 -41.7 15.1 0.3 -4.3 90 90 A A H X S+ 0 0 0 -4,-3.6 4,-2.3 1,-0.2 -1,-0.2 0.931 112.1 47.2 -63.1 -45.1 13.1 -1.7 -6.9 91 91 A R H X S+ 0 0 37 -4,-1.3 4,-2.8 -5,-0.4 -1,-0.2 0.872 111.4 51.5 -65.3 -35.7 13.4 1.1 -9.4 92 92 A E H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 7,-0.2 0.899 109.4 50.9 -66.8 -39.6 17.1 1.4 -8.7 93 93 A H H < S+ 0 0 17 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.914 117.6 38.5 -64.0 -42.7 17.6 -2.3 -9.2 94 94 A N H < S+ 0 0 68 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.846 127.9 30.4 -78.9 -34.0 15.8 -2.2 -12.5 95 95 A G H < S- 0 0 13 -4,-2.8 3,-0.4 1,-0.3 -2,-0.2 0.470 101.0-122.3-108.6 -1.5 17.1 1.1 -13.9 96 96 A G >< - 0 0 14 -4,-2.0 3,-2.4 -5,-0.2 4,-0.3 -0.531 64.8 -15.0 100.3-166.9 20.6 1.6 -12.5 97 97 A P T 3 S+ 0 0 42 0, 0.0 -1,-0.2 0, 0.0 -17,-0.2 0.762 148.4 22.5 -46.7 -35.9 22.3 4.3 -10.4 98 98 A R T > S+ 0 0 147 -3,-0.4 3,-2.0 1,-0.1 4,-0.4 -0.028 86.0 126.1-123.8 28.4 19.5 6.7 -11.1 99 99 A G G X + 0 0 0 -3,-2.4 3,-1.3 1,-0.3 6,-0.4 0.803 64.1 66.2 -57.8 -32.5 16.8 4.2 -11.9 100 100 A g G 3 S+ 0 0 6 -4,-0.3 -1,-0.3 1,-0.3 -8,-0.1 0.556 104.4 47.2 -69.2 -4.5 14.4 5.6 -9.3 101 101 A K G < S+ 0 0 133 -3,-2.0 2,-0.4 -10,-0.1 -1,-0.3 0.450 90.7 98.4-111.8 -6.1 14.3 8.7 -11.5 102 102 A K X - 0 0 103 -3,-1.3 3,-1.2 -4,-0.4 4,-0.3 -0.705 67.8-143.4 -87.1 132.0 13.8 7.0 -14.8 103 103 A G T >> S+ 0 0 51 -2,-0.4 3,-1.6 1,-0.3 4,-0.5 0.792 96.8 72.5 -62.4 -26.2 10.2 6.8 -16.1 104 104 A S H >> S+ 0 0 97 1,-0.3 3,-0.7 2,-0.2 4,-0.5 0.848 92.6 54.4 -56.5 -36.6 11.1 3.4 -17.5 105 105 A T H <> S+ 0 0 0 -3,-1.2 4,-2.0 -6,-0.4 -1,-0.3 0.515 84.1 83.6 -80.1 -4.3 11.1 1.9 -14.0 106 106 A I H <> S+ 0 0 83 -3,-1.6 4,-2.0 -4,-0.3 -1,-0.2 0.918 93.6 48.3 -62.9 -40.0 7.6 3.1 -13.2 107 107 A G H < S+ 0 0 170 -4,-2.4 3,-1.2 1,-0.2 4,-0.3 0.887 109.7 54.7 -70.1 -38.5 4.3 -4.9 -12.2 112 112 A L H >< S+ 0 0 0 -4,-2.4 3,-1.7 1,-0.3 -2,-0.2 0.885 101.5 58.6 -62.0 -38.3 6.2 -6.0 -9.1 113 113 A Q T 3< S+ 0 0 27 -4,-1.8 5,-0.3 1,-0.3 -1,-0.3 0.642 91.3 70.7 -67.9 -13.5 3.3 -4.9 -6.9 114 114 A K T < S+ 0 0 163 -3,-1.2 2,-0.3 -4,-0.4 -1,-0.3 0.633 77.2 100.8 -77.4 -12.9 1.0 -7.3 -8.7 115 115 A I S X S- 0 0 43 -3,-1.7 3,-2.7 -4,-0.3 4,-0.3 -0.557 94.7 -87.4 -75.5 133.3 2.9 -10.2 -7.0 116 116 A S T 3 S+ 0 0 109 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.1 -0.110 112.3 5.1 -43.4 122.6 1.0 -11.6 -4.0 117 117 A G T 3 S+ 0 0 81 -4,-0.1 -1,-0.3 -3,-0.1 -104,-0.1 0.528 108.4 96.2 78.3 7.2 1.9 -9.7 -0.9 118 118 A b X + 0 0 0 -3,-2.7 3,-1.9 -5,-0.3 2,-0.4 0.444 43.1 120.6-107.5 -1.6 4.0 -7.1 -2.7 119 119 A H T 3 S- 0 0 155 -4,-0.3 3,-0.1 1,-0.3 -5,-0.1 -0.500 96.7 -7.4 -68.7 121.9 1.4 -4.4 -3.2 120 120 A G T 3 S+ 0 0 31 -2,-0.4 -1,-0.3 1,-0.2 -34,-0.1 0.692 92.2 176.6 67.5 19.0 2.8 -1.3 -1.5 121 121 A V < 0 0 11 -3,-1.9 -34,-0.3 -112,-0.1 -1,-0.2 -0.262 360.0 360.0 -56.7 139.4 5.7 -3.3 -0.1 122 122 A Q 0 0 95 -36,-0.2 -112,-0.3 -37,-0.1 -113,-0.2 -0.896 360.0 360.0-112.5 360.0 8.1 -1.2 1.9