==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 10-APR-01 1IEM . COMPND 2 MOLECULE: BETA-LACTAMASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR R.A.POWERS,E.CASELLI,P.J.FOCIA,F.PRATI,B.K.SHOICHET . 716 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27722.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 518 72.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 135 18.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.6 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 . 10 1.4 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 . 43 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 92 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 194 27.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 2.8 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 3 3 0 2 2 0 4 2 2 0 2 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 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 . 3 9 6 2 0 2 4 2 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 . 4 4 0 0 0 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 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 4 A A 0 0 88 0, 0.0 35,-0.0 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 72.8 24.0 -20.7 35.0 2 5 A P > - 0 0 58 0, 0.0 4,-2.2 0, 0.0 3,-0.4 -0.182 360.0-123.1 -49.5 140.2 24.6 -19.9 38.7 3 6 A Q H > S+ 0 0 148 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.804 109.8 64.7 -58.8 -27.8 21.5 -18.6 40.3 4 7 A Q H > S+ 0 0 109 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.961 108.1 37.9 -60.6 -51.7 23.4 -15.5 41.3 5 8 A I H > S+ 0 0 0 -3,-0.4 4,-2.7 2,-0.2 5,-0.2 0.972 115.5 54.7 -60.4 -55.1 23.9 -14.4 37.7 6 9 A N H X S+ 0 0 52 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.888 110.1 47.1 -42.3 -53.9 20.4 -15.6 36.8 7 10 A D H X S+ 0 0 51 -4,-2.9 4,-2.6 2,-0.2 5,-0.3 0.918 112.6 44.8 -62.4 -49.6 18.8 -13.5 39.5 8 11 A I H X S+ 0 0 32 -4,-2.1 4,-2.7 -5,-0.2 5,-0.3 0.971 113.0 52.5 -62.8 -48.4 20.6 -10.2 38.8 9 12 A V H X S+ 0 0 0 -4,-2.7 4,-3.3 1,-0.2 5,-0.3 0.935 116.5 37.9 -49.8 -56.0 20.1 -10.5 35.1 10 13 A H H X S+ 0 0 70 -4,-2.4 4,-1.3 -5,-0.2 -1,-0.2 0.840 113.3 55.3 -67.7 -34.3 16.3 -11.0 35.4 11 14 A R H < S+ 0 0 175 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.891 121.2 33.2 -63.9 -36.2 15.9 -8.6 38.3 12 15 A T H X S+ 0 0 23 -4,-2.7 4,-1.1 -5,-0.3 -2,-0.2 0.952 120.8 42.9 -83.7 -56.0 17.6 -6.0 36.0 13 16 A I H X S+ 0 0 0 -4,-3.3 4,-2.6 -5,-0.3 5,-0.2 0.847 103.9 63.8 -63.9 -38.9 16.5 -6.8 32.4 14 17 A T H X S+ 0 0 71 -4,-1.3 4,-1.7 -5,-0.3 -1,-0.2 0.927 107.1 40.7 -55.2 -51.5 12.8 -7.6 33.0 15 18 A P H > S+ 0 0 55 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.823 113.8 58.6 -68.0 -25.9 11.9 -4.0 34.2 16 19 A L H X S+ 0 0 15 -4,-1.1 4,-2.3 2,-0.2 -2,-0.2 0.945 105.8 45.1 -66.1 -49.4 14.1 -2.7 31.4 17 20 A I H X>S+ 0 0 32 -4,-2.6 5,-1.5 1,-0.2 4,-0.7 0.864 116.6 46.6 -62.8 -38.5 12.3 -4.4 28.6 18 21 A E H <5S+ 0 0 117 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.851 114.0 46.6 -73.6 -36.5 8.9 -3.4 30.0 19 22 A Q H <5S+ 0 0 127 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.869 122.9 34.2 -73.8 -38.1 9.9 0.2 30.6 20 23 A Q H <5S- 0 0 50 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.440 103.1-129.0 -95.6 -2.9 11.5 0.7 27.2 21 24 A K T <5 - 0 0 161 -4,-0.7 -3,-0.2 1,-0.2 -4,-0.1 0.915 36.6-175.4 53.3 46.6 9.1 -1.6 25.4 22 25 A I < - 0 0 7 -5,-1.5 -1,-0.2 -6,-0.2 317,-0.1 -0.646 17.8-154.2 -76.2 119.0 11.9 -3.5 23.8 23 26 A P S S+ 0 0 28 0, 0.0 19,-2.0 0, 0.0 2,-0.3 0.931 73.1 1.7 -60.0 -51.8 10.5 -6.1 21.4 24 27 A G E +A 41 0A 0 17,-0.3 314,-1.4 19,-0.1 2,-0.3 -0.971 67.1 175.5-139.9 155.4 13.4 -8.5 21.6 25 28 A M E -AB 40 337A 0 15,-2.3 15,-3.0 -2,-0.3 2,-0.4 -0.990 14.3-162.4-161.8 148.9 16.7 -8.8 23.4 26 29 A A E -AB 39 336A 0 310,-2.4 310,-3.0 -2,-0.3 2,-0.4 -0.999 11.7-169.6-134.7 136.8 19.7 -11.0 24.1 27 30 A V E -AB 38 335A 0 11,-2.5 11,-1.9 -2,-0.4 2,-0.5 -0.981 6.5-168.1-129.8 138.2 22.2 -10.7 26.9 28 31 A A E -AB 37 334A 0 306,-2.1 306,-2.2 -2,-0.4 2,-0.6 -0.995 4.5-165.8-125.1 127.7 25.5 -12.4 27.5 29 32 A V E -AB 36 333A 0 7,-2.7 7,-1.2 -2,-0.5 2,-0.9 -0.967 7.6-155.7-114.0 117.6 27.2 -12.2 30.8 30 33 A I E +AB 35 332A 0 302,-2.3 302,-2.0 -2,-0.6 2,-0.5 -0.844 18.1 179.8 -95.5 105.3 30.9 -13.3 30.8 31 34 A Y E > -AB 34 331A 52 3,-2.3 3,-1.8 -2,-0.9 300,-0.2 -0.942 69.9 -15.6-110.9 119.6 31.6 -14.3 34.4 32 35 A Q T 3 S- 0 0 131 298,-1.1 -1,-0.2 -2,-0.5 299,-0.2 0.882 129.3 -53.7 55.3 42.5 35.1 -15.5 35.1 33 36 A G T 3 S+ 0 0 30 297,-1.3 -1,-0.3 1,-0.2 298,-0.1 0.428 117.4 108.7 76.8 -2.5 35.8 -15.9 31.4 34 37 A K E < -A 31 0A 35 -3,-1.8 -3,-2.3 296,-0.2 2,-0.3 -0.861 64.3-127.5-108.4 143.1 32.7 -18.1 30.8 35 38 A P E -A 30 0A 43 0, 0.0 2,-0.4 0, 0.0 -5,-0.2 -0.663 18.2-169.3 -93.2 147.5 29.6 -16.9 28.9 36 39 A Y E -A 29 0A 55 -7,-1.2 -7,-2.7 -2,-0.3 2,-0.3 -0.996 12.8-151.9-134.7 127.0 26.0 -17.1 30.1 37 40 A Y E +A 28 0A 59 -2,-0.4 2,-0.3 -9,-0.2 -9,-0.2 -0.763 17.5 172.9-109.4 147.3 23.1 -16.4 27.8 38 41 A F E -A 27 0A 19 -11,-1.9 -11,-2.5 -2,-0.3 2,-0.3 -0.990 9.3-169.3-144.0 144.2 19.6 -15.1 28.2 39 42 A T E -A 26 0A 56 -2,-0.3 2,-0.3 -13,-0.2 -13,-0.2 -0.993 2.5-174.1-139.7 147.9 17.0 -14.1 25.6 40 43 A W E -A 25 0A 41 -15,-3.0 -15,-2.3 -2,-0.3 11,-0.1 -0.969 41.9 -22.3-139.3 155.4 13.7 -12.4 25.6 41 44 A G E S-A 24 0A 39 -2,-0.3 10,-2.3 -17,-0.2 2,-0.3 0.001 87.6 -16.1 55.7-147.8 10.9 -11.5 23.2 42 45 A Y E -I 50 0B 107 -19,-2.0 3,-0.2 8,-0.3 296,-0.2 -0.777 19.5-173.9-110.7 144.3 10.8 -11.3 19.4 43 46 A A E S+ 0 0 7 6,-3.0 155,-3.2 1,-0.4 2,-0.3 0.715 100.8 17.5 -91.6 -33.4 13.3 -11.1 16.5 44 47 A D E > -I 49 0B 17 5,-1.7 5,-1.7 153,-0.2 -1,-0.4 -0.918 67.5-168.6-142.5 109.7 10.4 -10.6 14.1 45 48 A I T > 5S+ 0 0 88 -2,-0.3 3,-1.2 -3,-0.2 -1,-0.1 0.936 87.6 51.0 -66.8 -46.3 7.0 -9.7 15.6 46 49 A A T 3 5S+ 0 0 88 1,-0.3 -1,-0.2 2,-0.1 -2,-0.0 0.952 116.4 38.1 -56.1 -56.7 5.0 -10.3 12.4 47 50 A K T 3 5S- 0 0 154 2,-0.1 -1,-0.3 1,-0.1 -2,-0.2 0.230 107.3-123.0 -83.3 15.6 6.4 -13.8 11.8 48 51 A K T < 5 + 0 0 162 -3,-1.2 -3,-0.2 1,-0.2 -2,-0.1 0.787 53.0 160.9 49.0 33.8 6.4 -14.7 15.5 49 52 A Q E < -I 44 0B 100 -5,-1.7 -6,-3.0 1,-0.0 -5,-1.7 -0.760 30.3-140.6 -87.6 121.4 10.1 -15.5 15.5 50 53 A P E -I 42 0B 73 0, 0.0 -8,-0.3 0, 0.0 2,-0.3 -0.363 22.1-101.5 -77.8 158.8 11.7 -15.4 19.0 51 54 A V + 0 0 5 -10,-2.3 2,-0.3 -11,-0.1 -12,-0.1 -0.625 51.2 171.3 -77.5 138.5 15.1 -14.1 19.8 52 55 A T > - 0 0 51 -2,-0.3 3,-1.4 143,-0.1 172,-0.3 -0.809 51.7 -91.0-137.1 178.6 17.6 -17.0 20.2 53 56 A Q T 3 S+ 0 0 64 1,-0.3 172,-1.1 -2,-0.3 171,-0.2 0.602 126.3 54.5 -71.5 -10.9 21.3 -17.3 20.6 54 57 A Q T 3 S+ 0 0 85 169,-0.1 -1,-0.3 170,-0.1 2,-0.2 0.432 81.2 118.0-100.5 -3.5 21.6 -17.5 16.8 55 58 A T < - 0 0 5 -3,-1.4 169,-0.5 141,-0.1 2,-0.4 -0.456 59.4-136.5 -69.7 134.8 19.7 -14.3 16.2 56 59 A L B -j 196 0C 2 139,-3.3 141,-2.1 -2,-0.2 2,-0.3 -0.748 20.6-170.7 -93.0 133.9 21.7 -11.6 14.4 57 60 A F E -K 222 0D 1 165,-2.7 165,-1.9 -2,-0.4 2,-0.5 -0.909 32.1-109.2-121.0 152.0 21.4 -8.0 15.6 58 61 A E E -K 221 0D 6 -2,-0.3 163,-0.2 163,-0.2 279,-0.2 -0.707 28.0-157.3 -75.7 127.1 22.7 -4.8 13.9 59 62 A L > - 0 0 0 161,-3.2 3,-1.5 -2,-0.5 262,-0.2 0.706 17.5-169.7 -79.8 -20.0 25.6 -3.8 16.2 60 63 A G G > - 0 0 0 158,-0.6 3,-1.8 160,-0.5 160,-0.5 -0.414 68.8 -4.3 66.5-137.7 25.5 -0.2 15.2 61 64 A S G > S+ 0 0 12 1,-0.3 3,-3.1 254,-0.2 4,-0.3 0.660 115.7 83.4 -66.1 -15.0 28.5 1.7 16.5 62 65 A V G X> S+ 0 0 0 -3,-1.5 3,-2.0 1,-0.3 4,-0.8 0.784 77.2 77.2 -57.5 -19.3 29.8 -1.3 18.4 63 66 A S H <> S+ 0 0 0 -3,-1.8 4,-1.9 1,-0.3 -1,-0.3 0.773 77.5 71.5 -59.0 -26.3 31.2 -2.0 14.9 64 67 A K H <> S+ 0 0 0 -3,-3.1 4,-3.1 153,-0.4 -1,-0.3 0.766 88.2 60.9 -64.2 -24.8 33.8 0.7 15.7 65 68 A T H <> S+ 0 0 0 -3,-2.0 4,-2.5 -4,-0.3 -1,-0.2 0.918 106.0 46.4 -67.4 -41.3 35.4 -1.7 18.2 66 69 A F H X S+ 0 0 0 -4,-0.8 4,-2.4 -3,-0.3 -2,-0.2 0.882 114.0 48.9 -65.9 -37.1 36.1 -4.1 15.3 67 70 A T H X S+ 0 0 1 -4,-1.9 4,-2.7 2,-0.2 5,-0.2 0.944 110.8 49.0 -67.5 -47.2 37.3 -1.2 13.2 68 71 A G H X S+ 0 0 0 -4,-3.1 4,-2.4 1,-0.2 -2,-0.2 0.936 115.1 44.9 -56.6 -47.6 39.6 0.0 16.0 69 72 A V H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.872 112.2 50.6 -65.4 -39.4 41.0 -3.5 16.5 70 73 A L H X S+ 0 0 2 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.905 113.1 47.6 -66.1 -37.6 41.4 -4.2 12.7 71 74 A G H X S+ 0 0 1 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.902 110.6 51.1 -67.7 -39.4 43.2 -0.9 12.5 72 75 A G H X S+ 0 0 0 -4,-2.4 4,-3.0 1,-0.2 -2,-0.2 0.892 107.4 53.6 -63.5 -38.2 45.4 -1.8 15.5 73 76 A D H X S+ 0 0 1 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.907 106.6 52.3 -62.2 -40.9 46.1 -5.1 13.7 74 77 A A H <>S+ 0 0 2 -4,-1.9 5,-1.9 2,-0.2 6,-0.8 0.903 110.6 47.6 -62.5 -41.7 47.3 -3.1 10.7 75 78 A I H ><5S+ 0 0 10 -4,-2.1 3,-2.1 1,-0.2 -2,-0.2 0.958 110.4 51.7 -62.2 -50.2 49.6 -1.0 12.9 76 79 A A H 3<5S+ 0 0 18 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.849 107.3 54.0 -55.2 -34.9 50.9 -4.2 14.5 77 80 A R T 3<5S- 0 0 104 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.569 114.5-118.9 -76.6 -9.0 51.6 -5.6 11.0 78 81 A G T < 5S+ 0 0 61 -3,-2.1 -3,-0.2 -4,-0.4 -2,-0.1 0.565 82.6 118.7 82.4 8.7 53.7 -2.5 10.2 79 82 A E S - 0 0 60 -2,-0.3 3,-1.4 4,-0.1 22,-0.4 -0.998 18.7-136.5-135.8 139.3 51.3 4.2 11.7 82 85 A L T 3 S+ 0 0 10 -2,-0.4 22,-2.0 1,-0.3 23,-0.3 0.752 108.7 58.3 -66.8 -19.3 49.0 6.3 13.8 83 86 A S T 3 S+ 0 0 25 576,-0.3 -1,-0.3 20,-0.2 575,-0.1 0.613 83.3 108.3 -84.3 -10.8 51.5 9.1 13.4 84 87 A D S < S- 0 0 12 -3,-1.4 19,-2.0 1,-0.1 20,-0.3 -0.362 77.7-111.0 -65.7 139.9 51.2 9.0 9.6 85 88 A P B > -M 102 0E 56 0, 0.0 3,-1.6 0, 0.0 4,-0.5 -0.413 21.9-118.9 -70.9 152.0 49.4 11.9 7.9 86 89 A T G >> S+ 0 0 0 15,-3.2 3,-1.5 12,-0.3 4,-0.7 0.897 110.3 64.8 -54.8 -39.9 46.0 11.1 6.4 87 90 A T G 34 S+ 0 0 44 14,-0.4 -1,-0.3 11,-0.3 6,-0.1 0.653 84.7 72.4 -62.6 -15.2 47.4 12.2 3.0 88 91 A K G <4 S+ 0 0 131 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.851 108.2 33.9 -68.1 -30.7 49.9 9.4 2.8 89 92 A Y T <4 S+ 0 0 24 -3,-1.5 -1,-0.2 -4,-0.5 -2,-0.2 0.460 130.9 35.4-100.7 -4.2 47.1 6.9 2.2 90 93 A W >< + 0 0 22 -4,-0.7 3,-2.8 3,-0.1 -1,-0.2 -0.511 63.0 170.8-146.8 68.9 45.0 9.3 0.2 91 94 A P T 3 S+ 0 0 80 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 0.704 74.5 73.7 -56.1 -16.6 47.3 11.5 -1.8 92 95 A E T 3 S+ 0 0 100 1,-0.1 2,-1.5 -3,-0.1 3,-0.2 0.677 71.8 91.5 -72.0 -16.5 44.2 12.8 -3.6 93 96 A L < + 0 0 3 -3,-2.8 -1,-0.1 1,-0.2 -3,-0.1 -0.662 47.4 152.0 -80.1 93.7 43.4 14.8 -0.4 94 97 A T + 0 0 108 -2,-1.5 -1,-0.2 3,-0.0 5,-0.1 0.551 22.2 119.2-103.4 -9.5 45.2 18.0 -1.4 95 98 A A > - 0 0 19 -3,-0.2 3,-1.9 1,-0.1 4,-0.2 -0.344 69.9-124.6 -58.6 135.7 43.1 20.7 0.4 96 99 A K G > S+ 0 0 73 1,-0.3 3,-1.4 2,-0.2 -1,-0.1 0.648 101.3 75.1 -59.9 -19.3 45.4 22.5 2.9 97 100 A Q G 3 S+ 0 0 38 1,-0.2 -1,-0.3 36,-0.2 -2,-0.1 0.680 86.7 66.5 -69.1 -12.8 43.2 21.8 6.0 98 101 A W G X + 0 0 0 -3,-1.9 3,-2.1 2,-0.1 -12,-0.3 0.597 70.0 110.8 -84.1 -10.2 44.5 18.2 5.9 99 102 A N T < S+ 0 0 117 -3,-1.4 3,-0.1 1,-0.3 -5,-0.0 -0.465 88.9 15.7 -64.0 128.0 48.1 19.2 6.8 100 103 A G T 3 S+ 0 0 47 1,-0.2 2,-0.8 -2,-0.2 -1,-0.3 0.399 92.0 123.9 90.1 -6.4 48.7 17.9 10.3 101 104 A I < - 0 0 1 -3,-2.1 -15,-3.2 40,-0.1 -14,-0.4 -0.834 42.9-172.2 -94.0 112.6 45.7 15.6 10.4 102 105 A T B > -M 85 0E 22 -2,-0.8 4,-1.8 -17,-0.3 5,-0.1 -0.428 40.5-103.5 -98.2 174.1 47.0 12.1 11.2 103 106 A L H > S+ 0 0 0 -19,-2.0 4,-2.6 -22,-0.4 5,-0.2 0.845 121.7 61.7 -66.3 -31.1 45.4 8.6 11.3 104 107 A L H > S+ 0 0 7 -22,-2.0 4,-1.9 -20,-0.3 6,-0.2 0.965 103.3 50.2 -58.7 -48.5 45.4 8.9 15.0 105 108 A H H 4>S+ 0 0 21 -23,-0.3 5,-2.2 2,-0.2 4,-0.5 0.928 111.9 44.7 -55.2 -50.3 43.1 11.9 14.7 106 109 A L H ><5S+ 0 0 0 -4,-1.8 3,-1.2 1,-0.2 -1,-0.2 0.951 113.4 51.9 -59.8 -47.7 40.6 10.2 12.4 107 110 A A H 3<5S+ 0 0 0 -4,-2.6 160,-0.5 1,-0.2 -1,-0.2 0.788 117.5 37.2 -58.8 -31.3 40.6 7.1 14.5 108 111 A T T 3<5S- 0 0 0 -4,-1.9 -1,-0.2 -3,-0.3 -2,-0.2 0.198 109.6-111.2-111.9 15.2 39.9 9.1 17.7 109 112 A Y T < 5S+ 0 0 2 -3,-1.2 37,-2.6 -4,-0.5 4,-0.2 0.794 85.2 115.5 62.5 31.3 37.5 11.8 16.5 110 113 A T < + 0 0 0 -5,-2.2 32,-2.9 -6,-0.2 33,-0.4 -0.004 26.9 112.0-119.2 29.0 40.1 14.6 17.0 111 114 A A S S- 0 0 1 -6,-0.5 -1,-0.1 30,-0.2 -5,-0.1 0.707 100.6 -85.9 -74.6 -18.4 40.7 15.8 13.4 112 115 A G S S- 0 0 0 32,-0.4 26,-2.2 -3,-0.2 27,-1.7 0.690 90.6 -26.9 121.0 28.7 39.0 19.1 14.3 113 116 A G + 0 0 15 31,-0.3 23,-0.1 24,-0.2 3,-0.1 0.716 66.6 173.6 111.1 23.9 35.3 18.7 13.8 114 117 A L - 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