==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 03-OCT-03 1R44 . COMPND 2 MOLECULE: D-ALANYL-D-ALANINE DIPEPTIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROCOCCUS FAECIUM; . AUTHOR S.D.PRATT,L.KATZ,J.M.SEVERIN,T.HOLZMAN,C.H.PARK . 1212 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 49253.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 747 61.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 2.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 130 10.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.5 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 . 10 0.8 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 . 85 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 156 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 247 20.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 1.7 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 7 0 2 0 0 0 0 6 1 1 1 8 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 6 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 . 6 2 16 0 0 6 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 . 6 0 0 0 6 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 M 0 0 109 0, 0.0 3,-0.1 0, 0.0 200,-0.1 0.000 360.0 360.0 360.0 129.6 44.4 14.8 -3.1 2 2 A E > - 0 0 76 1,-0.1 3,-1.1 2,-0.1 2,-0.2 -0.078 360.0 -92.1 -51.6 152.2 44.7 16.4 0.3 3 3 A I T 3 S+ 0 0 141 1,-0.2 -1,-0.1 40,-0.0 3,-0.1 -0.448 109.4 18.9 -77.4 136.9 45.9 14.4 3.3 4 4 A G T 3 S+ 0 0 12 1,-0.3 40,-2.5 -2,-0.2 41,-0.3 0.246 110.8 96.2 87.3 -11.1 43.3 12.6 5.4 5 5 A F E < +A 43 0A 1 -3,-1.1 -1,-0.3 38,-0.3 2,-0.3 -0.723 47.9 175.0-107.6 163.4 40.8 12.9 2.6 6 6 A T E -A 42 0A 6 36,-3.0 36,-3.0 -2,-0.3 2,-0.6 -0.970 43.9 -93.1-156.7 160.7 39.8 10.6 -0.2 7 7 A F E > -A 41 0A 21 -2,-0.3 3,-1.7 34,-0.2 4,-0.4 -0.784 43.6-136.7 -76.4 119.6 37.3 10.2 -3.1 8 8 A L G >> S+ 0 0 0 32,-2.8 4,-3.4 -2,-0.6 3,-1.3 0.791 98.3 62.0 -58.3 -29.2 34.6 8.4 -1.2 9 9 A D G 34 S+ 0 0 20 31,-0.5 -1,-0.3 1,-0.3 6,-0.2 0.792 93.2 64.7 -68.3 -23.0 33.9 5.9 -4.0 10 10 A E G <4 S+ 0 0 95 -3,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.688 117.7 26.4 -75.2 -11.3 37.5 4.6 -3.6 11 11 A I T <4 S+ 0 0 54 -3,-1.3 2,-1.1 -4,-0.4 -2,-0.2 0.710 124.2 48.8-111.4 -43.7 36.6 3.4 -0.1 12 12 A V S >< S- 0 0 0 -4,-3.4 3,-1.1 1,-0.2 -1,-0.2 -0.743 81.7-171.9-101.8 90.9 32.8 2.8 -0.5 13 13 A H T 3 + 0 0 143 -2,-1.1 -1,-0.2 1,-0.2 -4,-0.0 0.843 67.6 34.6 -68.1 -48.9 32.9 0.8 -3.7 14 14 A G T 3 S+ 0 0 47 2,-0.0 -1,-0.2 0, 0.0 -5,-0.1 0.302 88.1 136.3 -85.4 14.5 29.4 0.1 -5.2 15 15 A V < - 0 0 8 -3,-1.1 2,-0.3 -6,-0.2 50,-0.2 -0.319 50.9-134.5 -70.3 139.4 28.2 3.5 -4.1 16 16 A R E +b 65 0B 151 48,-2.1 50,-3.2 2,-0.0 2,-0.3 -0.699 30.2 176.4 -87.5 142.2 26.2 5.7 -6.4 17 17 A W E -b 66 0B 86 -2,-0.3 50,-0.2 48,-0.3 2,-0.2 -0.995 28.7-179.4-150.6 162.6 27.0 9.4 -6.7 18 18 A D - 0 0 49 48,-2.0 2,-2.1 -2,-0.3 3,-0.1 -0.743 24.8-145.9-160.4 91.1 26.2 12.5 -8.5 19 19 A A > - 0 0 0 1,-0.2 3,-2.3 -2,-0.2 4,-0.2 -0.460 17.2-169.9 -71.7 88.3 28.3 15.5 -7.4 20 20 A K G > S+ 0 0 22 -2,-2.1 3,-0.9 47,-1.1 -1,-0.2 0.795 80.1 52.6 -51.2 -34.6 25.6 18.0 -7.8 21 21 A Y G 3 S+ 0 0 2 46,-0.5 11,-3.3 1,-0.2 -1,-0.3 0.527 103.2 56.7 -87.9 -6.5 27.9 20.9 -7.4 22 22 A A G < S+ 0 0 18 -3,-2.3 -1,-0.2 9,-0.2 2,-0.2 0.305 109.9 62.1 -96.3 15.3 30.4 19.7 -10.0 23 23 A T S < S- 0 0 27 -3,-0.9 9,-0.1 -4,-0.2 3,-0.1 -0.644 90.8-115.7-135.3 165.2 27.4 19.7 -12.3 24 24 A W S S+ 0 0 177 -2,-0.2 2,-1.5 1,-0.2 5,-0.1 0.584 94.8 90.3 -84.1 -8.5 24.9 22.3 -13.7 25 25 A D + 0 0 74 -5,-0.1 2,-0.3 3,-0.1 -1,-0.2 -0.408 66.7 91.3 -91.1 62.4 22.1 20.6 -11.9 26 26 A N S > S- 0 0 2 -2,-1.5 3,-1.3 -3,-0.1 69,-0.1 -0.887 93.7 -88.0-139.6 175.2 22.2 22.5 -8.6 27 27 A F T 3 S+ 0 0 4 -2,-0.3 64,-0.2 1,-0.3 68,-0.1 0.703 124.2 55.6 -66.1 -16.7 20.4 25.6 -7.3 28 28 A T T 3 S- 0 0 18 2,-0.3 -1,-0.3 62,-0.1 -3,-0.1 0.655 102.9-134.4 -84.4 -16.7 23.1 28.0 -8.7 29 29 A G S < S+ 0 0 18 -3,-1.3 -2,-0.1 1,-0.2 -5,-0.0 0.295 77.4 63.7 83.9 -8.1 22.5 26.5 -12.1 30 30 A K S S- 0 0 141 -5,-0.1 -2,-0.3 -7,-0.1 -1,-0.2 -0.800 101.8 -72.0-130.1 172.0 26.2 26.1 -12.9 31 31 A P - 0 0 41 0, 0.0 2,-0.3 0, 0.0 -9,-0.2 -0.414 56.8-115.3 -61.3 143.3 29.1 24.1 -11.4 32 32 A V > - 0 0 3 -11,-3.3 3,-2.1 -9,-0.1 43,-0.1 -0.608 32.0 -96.5 -90.6 142.3 30.2 25.5 -8.0 33 33 A D T 3 S+ 0 0 90 -2,-0.3 45,-0.2 1,-0.3 46,-0.1 -0.336 111.3 29.7 -59.8 129.9 33.6 27.0 -7.5 34 34 A G T 3 S+ 0 0 1 1,-0.1 167,-4.1 40,-0.1 2,-0.9 0.210 93.5 101.7 102.8 -12.6 36.0 24.5 -6.0 35 35 A Y B < +g 201 0C 12 -3,-2.1 167,-0.1 -14,-0.2 -1,-0.1 -0.871 31.8 150.3-105.3 99.2 34.3 21.5 -7.6 36 36 A E + 0 0 108 165,-2.9 2,-0.4 -2,-0.9 166,-0.2 0.436 61.2 53.7-105.5 -6.0 36.5 20.6 -10.5 37 37 A V S S- 0 0 28 164,-0.9 2,-2.0 2,-0.2 -14,-0.1 -0.968 79.3-127.0-132.9 138.8 35.7 16.9 -10.4 38 38 A N S S+ 0 0 77 -2,-0.4 2,-0.3 -16,-0.1 -19,-0.1 -0.518 77.5 105.1 -83.7 69.6 32.4 15.0 -10.5 39 39 A R S S- 0 0 57 -2,-2.0 2,-0.6 -21,-0.1 -2,-0.2 -0.947 73.7-117.1-142.5 161.8 33.3 13.0 -7.4 40 40 A I - 0 0 4 -2,-0.3 -32,-2.8 28,-0.1 -31,-0.5 -0.926 32.3-164.5-104.6 119.1 32.4 13.0 -3.8 41 41 A V E +A 7 0A 1 -2,-0.6 29,-3.9 29,-0.4 2,-0.3 -0.814 17.6 156.6-103.0 150.6 35.4 13.8 -1.6 42 42 A G E -A 6 0A 0 -36,-3.0 -36,-3.0 -2,-0.4 78,-0.2 -0.996 45.3 -80.7-166.3 165.7 35.5 13.1 2.1 43 43 A T E > -A 5 0A 0 76,-3.0 4,-2.6 -2,-0.3 3,-0.3 -0.347 45.4-117.3 -65.4 145.0 37.4 12.5 5.2 44 44 A Y H > S+ 0 0 101 -40,-2.5 4,-2.7 1,-0.2 -1,-0.1 0.837 118.4 53.6 -53.2 -33.6 38.7 8.8 5.6 45 45 A E H > S+ 0 0 65 -41,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.847 107.1 50.6 -70.9 -34.2 36.5 8.6 8.7 46 46 A L H > S+ 0 0 0 -3,-0.3 4,-2.7 73,-0.2 5,-0.2 0.963 112.3 47.8 -65.7 -47.5 33.5 9.7 6.7 47 47 A A H X S+ 0 0 0 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.907 111.0 51.1 -58.5 -45.8 34.3 7.1 4.1 48 48 A E H X S+ 0 0 109 -4,-2.7 4,-1.4 1,-0.2 -1,-0.2 0.905 115.0 41.1 -54.8 -53.3 34.7 4.5 6.8 49 49 A S H X S+ 0 0 11 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.780 111.6 56.3 -71.5 -29.7 31.4 5.2 8.4 50 50 A L H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.844 104.7 54.4 -64.7 -32.4 29.7 5.6 5.0 51 51 A L H X S+ 0 0 52 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.908 108.1 47.8 -67.1 -40.7 30.9 2.1 4.3 52 52 A K H X S+ 0 0 94 -4,-1.4 4,-3.3 1,-0.2 -2,-0.2 0.882 113.2 49.4 -64.9 -41.3 29.2 0.9 7.5 53 53 A A H X S+ 0 0 0 -4,-2.1 4,-1.4 120,-0.2 -2,-0.2 0.865 109.6 50.9 -62.0 -41.3 26.1 2.8 6.4 54 54 A K H < S+ 0 0 74 -4,-2.7 3,-0.4 2,-0.2 -2,-0.2 0.943 114.7 43.6 -61.7 -47.6 26.3 1.2 2.9 55 55 A E H < S+ 0 0 125 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.939 107.0 58.3 -63.5 -48.8 26.6 -2.2 4.5 56 56 A L H >< S+ 0 0 52 -4,-3.3 3,-3.3 2,-0.1 2,-2.4 0.738 79.6 92.5 -60.6 -23.8 23.8 -1.5 7.1 57 57 A A T 3< + 0 0 10 -4,-1.4 3,-0.2 -3,-0.4 -1,-0.1 -0.603 56.5 92.8 -68.2 75.1 21.5 -0.8 4.0 58 58 A A T 3 + 0 0 77 -2,-2.4 2,-1.5 3,-0.1 -1,-0.3 0.002 54.2 98.3-140.6 -37.4 20.8 -4.4 4.6 59 59 A T S < S- 0 0 48 -3,-3.3 3,-0.2 106,-0.1 110,-0.1 -0.664 118.0 -31.1 -52.4 90.0 18.1 -2.7 6.6 60 60 A Q S S- 0 0 104 -2,-1.5 2,-1.7 -3,-0.2 68,-0.0 0.221 100.5 -63.6 56.8 171.4 16.2 -3.5 3.5 61 61 A G S S+ 0 0 30 -4,-0.1 68,-3.5 -3,-0.0 69,-0.5 -0.717 81.2 151.2 -85.7 78.9 17.9 -3.6 0.1 62 62 A Y E - C 0 128B 12 -2,-1.7 2,-0.3 66,-0.3 66,-0.2 -0.951 28.0-164.8-112.7 135.5 18.8 0.1 0.1 63 63 A G E - C 0 127B 4 64,-2.9 64,-2.2 -2,-0.4 2,-0.4 -0.801 23.6-115.4-108.9 161.6 21.8 1.5 -1.8 64 64 A L E - C 0 126B 2 -2,-0.3 -48,-2.1 62,-0.2 2,-0.5 -0.826 17.9-163.0-102.0 140.4 23.3 4.9 -1.1 65 65 A L E -bC 16 125B 20 60,-2.8 60,-1.8 -2,-0.4 2,-0.3 -0.981 16.2-152.5-117.9 116.1 23.4 7.8 -3.6 66 66 A L E +bC 17 124B 0 -50,-3.2 -48,-2.0 -2,-0.5 58,-0.3 -0.705 22.3 171.0 -92.5 138.2 25.8 10.5 -2.6 67 67 A W E - 0 0 20 56,-3.5 -47,-1.1 1,-0.3 -46,-0.5 0.690 66.6 -1.2-113.3 -33.0 25.3 14.1 -3.6 68 68 A D E + C 0 123B 2 55,-1.2 55,-2.5 -49,-0.1 -1,-0.3 -0.900 53.4 156.9-165.3 135.8 27.9 16.0 -1.7 69 69 A G + 0 0 0 1,-0.5 -27,-0.2 -2,-0.3 50,-0.2 0.208 69.1 23.6-120.7-114.2 30.6 15.3 0.9 70 70 A Y - 0 0 1 -29,-3.9 -1,-0.5 49,-0.3 -29,-0.4 -0.357 68.5-167.2 -61.6 130.8 33.6 17.7 1.4 71 71 A R - 0 0 24 45,-1.1 48,-0.1 -3,-0.1 43,-0.1 -0.978 18.9-124.9-127.0 117.3 32.8 21.2 0.2 72 72 A P >> - 0 0 0 0, 0.0 4,-1.6 0, 0.0 3,-0.7 -0.142 21.3-120.6 -58.4 147.3 35.6 23.8 -0.3 73 73 A K H 3> S+ 0 0 96 124,-1.5 4,-2.4 1,-0.2 5,-0.2 0.882 117.7 58.8 -54.8 -35.0 35.1 27.1 1.6 74 74 A R H 3> S+ 0 0 71 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.825 101.4 54.6 -66.3 -28.4 35.2 28.8 -1.8 75 75 A A H <> S+ 0 0 0 -3,-0.7 4,-2.0 2,-0.2 -1,-0.2 0.907 108.5 48.4 -66.7 -40.7 32.1 26.6 -2.7 76 76 A V H X S+ 0 0 4 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.895 111.9 48.8 -65.8 -39.6 30.4 28.0 0.4 77 77 A N H X S+ 0 0 92 -4,-2.4 4,-3.0 2,-0.2 -2,-0.2 0.909 107.7 55.6 -66.4 -38.1 31.4 31.6 -0.7 78 78 A C H X S+ 0 0 36 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.899 108.0 48.1 -61.2 -41.8 30.1 30.8 -4.2 79 79 A F H X S+ 0 0 2 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.900 112.3 49.1 -63.2 -43.0 26.7 29.9 -2.7 80 80 A M H X S+ 0 0 59 -4,-2.0 4,-1.2 2,-0.2 -2,-0.2 0.897 111.3 49.3 -64.2 -41.9 26.7 33.0 -0.6 81 81 A Q H < S+ 0 0 128 -4,-3.0 3,-0.4 1,-0.2 4,-0.3 0.919 111.4 50.2 -62.2 -43.2 27.6 35.1 -3.7 82 82 A W H >< S+ 0 0 22 -4,-2.5 3,-1.5 1,-0.2 -2,-0.2 0.872 106.3 54.2 -61.8 -43.7 24.8 33.5 -5.6 83 83 A A H 3< S+ 0 0 5 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.786 106.5 54.4 -62.3 -24.5 22.3 34.1 -2.8 84 84 A A T 3< S+ 0 0 72 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.492 93.4 94.5 -85.8 -5.8 23.3 37.8 -3.1 85 85 A Q S < S- 0 0 101 -3,-1.5 16,-0.1 -4,-0.3 2,-0.1 -0.455 86.5 -87.0 -83.5 159.2 22.5 37.9 -6.9 86 86 A P - 0 0 104 0, 0.0 2,-0.8 0, 0.0 -1,-0.1 -0.336 48.8 -98.4 -60.4 144.6 19.3 39.1 -8.5 87 87 A E + 0 0 64 1,-0.2 -4,-0.0 2,-0.1 13,-0.0 -0.550 41.6 170.4 -75.8 108.4 16.6 36.6 -9.0 88 88 A N - 0 0 88 -2,-0.8 -1,-0.2 -3,-0.0 0, 0.0 0.389 42.8-131.1 -91.9 -0.2 16.6 35.3 -12.6 89 89 A N + 0 0 108 1,-0.1 4,-0.5 2,-0.0 -2,-0.1 0.529 67.8 129.3 56.3 16.8 14.0 32.6 -11.6 90 90 A L S S+ 0 0 128 1,-0.2 4,-0.1 2,-0.1 -1,-0.1 0.888 85.7 9.6 -65.6 -45.6 16.1 30.0 -13.3 91 91 A T S > S+ 0 0 16 -64,-0.2 4,-2.2 2,-0.1 5,-0.4 0.304 99.8 103.1-118.2 6.7 16.2 27.5 -10.4 92 92 A K H > S+ 0 0 38 1,-0.2 4,-3.1 3,-0.2 3,-0.1 0.956 78.9 50.7 -60.8 -53.7 13.5 29.0 -8.1 93 93 A E H 4 S+ 0 0 153 -4,-0.5 -1,-0.2 1,-0.2 -2,-0.1 0.799 118.4 36.4 -50.0 -40.6 10.7 26.6 -8.8 94 94 A S H 4 S+ 0 0 52 -3,-0.2 46,-0.2 2,-0.1 -1,-0.2 0.812 130.9 25.6 -87.6 -31.2 12.6 23.5 -8.3 95 95 A Y H < S+ 0 0 9 -4,-2.2 -3,-0.2 -3,-0.1 -2,-0.2 0.640 132.9 9.4-112.0 -24.0 14.8 24.5 -5.4 96 96 A Y < + 0 0 0 -4,-3.1 3,-0.5 -5,-0.4 -3,-0.2 -0.100 62.0 152.8-161.2 60.7 13.1 27.3 -3.4 97 97 A P S S+ 0 0 19 0, 0.0 2,-0.5 0, 0.0 3,-0.1 -0.422 77.4 33.3 -68.6 164.6 9.6 28.2 -4.2 98 98 A N S S+ 0 0 127 -2,-0.1 2,-0.3 47,-0.1 47,-0.1 0.154 121.2 49.3 69.4 -25.4 7.9 29.7 -1.0 99 99 A I S S- 0 0 9 -3,-0.5 2,-0.2 -2,-0.5 -3,-0.0 -0.825 77.9-131.7-123.9 176.3 11.2 31.3 0.2 100 100 A D > - 0 0 67 -2,-0.3 4,-1.6 -3,-0.1 -17,-0.0 -0.740 36.4 -89.8-114.8 179.5 13.8 33.6 -1.7 101 101 A R T 4 S+ 0 0 8 -2,-0.2 4,-0.1 1,-0.2 -18,-0.1 0.784 126.0 51.5 -54.4 -34.9 17.7 33.5 -1.9 102 102 A T T >> S+ 0 0 92 1,-0.2 3,-2.3 2,-0.2 4,-1.6 0.963 108.1 49.8 -65.5 -54.1 18.1 35.6 1.1 103 103 A E H 3> S+ 0 0 60 1,-0.3 4,-2.3 2,-0.2 6,-0.3 0.738 95.5 73.4 -60.6 -27.1 15.8 33.5 3.2 104 104 A M H 3< S+ 0 0 0 -4,-1.6 6,-1.9 1,-0.2 5,-0.3 0.628 107.3 35.6 -63.1 -15.4 17.8 30.4 2.2 105 105 A I H X4 S+ 0 0 44 -3,-2.3 3,-1.8 4,-0.2 -2,-0.2 0.808 113.3 56.3-100.0 -45.6 20.5 31.7 4.5 106 106 A S H 3< S+ 0 0 98 -4,-1.6 -2,-0.2 1,-0.3 -3,-0.2 0.754 108.7 50.6 -52.3 -31.2 18.2 33.2 7.2 107 107 A K T 3< S- 0 0 81 -4,-2.3 -1,-0.3 -5,-0.2 -3,-0.1 0.319 117.7-104.4 -99.5 7.1 16.6 29.8 7.7 108 108 A G S < S+ 0 0 28 -3,-1.8 -3,-0.1 2,-0.3 3,-0.1 0.518 89.9 114.0 83.7 12.0 19.6 27.6 8.1 109 109 A Y S S+ 0 0 15 -6,-0.3 2,-0.5 -5,-0.3 -4,-0.2 0.784 79.1 35.3 -81.1 -36.5 19.4 26.1 4.6 110 110 A V S S- 0 0 10 -6,-1.9 2,-0.4 -7,-0.1 -2,-0.3 -0.991 85.9-141.3-118.5 123.0 22.6 27.6 3.2 111 111 A A - 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