==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 06-MAY-10 3AHY . COMPND 2 MOLECULE: BETA-GLUCOSIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: TRICHODERMA REESEI; . AUTHOR W.-Y.JENG,C.-I.LIU,A.H.-J.WANG . 1861 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 62559.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1324 71.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 204 11.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 3.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 0.4 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 . 115 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 203 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 592 31.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 46 2.5 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 9 3 2 14 1 7 2 2 0 4 4 4 8 0 0 4 0 0 0 4 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 1 9 18 8 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 . 8 0 0 8 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 . 4 4 0 0 0 0 0 4 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 84 0, 0.0 462,-0.2 0, 0.0 461,-0.1 0.000 360.0 360.0 360.0 132.1 -15.3 -94.4 -9.1 2 2 A L B -a 463 0A 0 460,-2.4 462,-2.7 457,-0.1 410,-0.1 -0.836 360.0 -84.0-109.2 154.6 -13.0 -91.4 -8.1 3 3 A P > - 0 0 49 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 -0.207 38.6-113.2 -59.2 153.2 -11.4 -89.3 -10.8 4 4 A K T 3 S+ 0 0 145 1,-0.3 459,-0.1 459,-0.2 -2,-0.0 0.703 115.0 53.2 -58.8 -25.2 -8.1 -90.6 -12.3 5 5 A D T 3 S+ 0 0 78 2,-0.1 -1,-0.3 679,-0.0 679,-0.1 0.290 75.9 138.0 -93.9 7.1 -6.1 -87.7 -10.8 6 6 A F < - 0 0 1 -3,-1.9 2,-0.4 458,-0.1 407,-0.2 -0.314 44.3-145.4 -57.8 131.4 -7.3 -88.3 -7.3 7 7 A Q E +b 413 0B 30 405,-2.2 407,-2.0 63,-0.0 2,-0.3 -0.846 22.2 173.1-103.7 133.9 -4.4 -87.9 -4.8 8 8 A W E +b 414 0B 3 -2,-0.4 62,-2.4 405,-0.2 63,-1.4 -0.977 16.2 117.1-136.1 156.1 -4.1 -90.0 -1.7 9 9 A G E -bc 415 71B 1 405,-1.8 407,-2.8 -2,-0.3 2,-0.3 -0.894 52.6 -67.2-177.7-151.9 -1.3 -90.3 0.9 10 10 A F E -bc 416 72B 0 61,-0.9 63,-2.7 405,-0.3 2,-0.3 -0.887 33.9-143.0-129.8 156.6 -0.4 -89.8 4.5 11 11 A A E +bc 417 73B 0 405,-2.5 408,-1.5 -2,-0.3 407,-0.6 -0.903 19.9 163.4-125.3 151.8 0.1 -86.8 6.7 12 12 A T - 0 0 1 61,-1.8 2,-0.3 -2,-0.3 410,-0.0 -0.878 25.5-132.4-147.9 176.2 2.5 -85.8 9.5 13 13 A A > - 0 0 0 -2,-0.3 4,-1.3 61,-0.2 5,-0.3 -0.981 23.1-120.5-138.7 146.8 3.5 -82.6 11.3 14 14 A A H >> S+ 0 0 2 -2,-0.3 4,-3.0 1,-0.2 3,-0.6 0.904 109.3 43.1 -59.4 -51.4 7.1 -81.4 12.1 15 15 A Y H 34 S+ 0 0 8 104,-0.3 4,-0.3 1,-0.2 -1,-0.2 0.807 111.9 55.8 -69.3 -26.8 6.9 -81.2 15.9 16 16 A Q H 34 S+ 0 0 2 -3,-0.2 407,-2.4 1,-0.1 -1,-0.2 0.782 128.1 11.4 -73.9 -24.8 5.0 -84.5 16.2 17 17 A I H << S+ 0 0 9 -4,-1.3 36,-2.1 -3,-0.6 34,-1.1 0.692 107.3 76.3-122.7 -27.4 7.6 -86.5 14.3 18 18 A E < + 0 0 13 -4,-3.0 36,-1.7 -5,-0.3 37,-0.4 0.835 53.7 179.5 -68.5 -42.1 10.9 -84.7 13.7 19 19 A G + 0 0 3 -5,-0.3 30,-0.3 28,-0.3 -1,-0.1 -0.441 46.7 105.0 64.0-151.2 12.9 -84.7 17.0 20 20 A A > + 0 0 11 28,-0.5 3,-1.0 1,-0.1 6,-0.2 0.904 46.0 172.2 49.5 48.5 16.2 -83.0 16.6 21 21 A V T 3 S+ 0 0 24 27,-0.9 -1,-0.1 1,-0.3 28,-0.1 0.678 76.7 22.6 -70.4 -19.0 14.8 -80.0 18.5 22 22 A D T > S+ 0 0 132 26,-0.2 3,-0.6 6,-0.0 -1,-0.3 0.102 96.6 121.5-129.8 16.7 18.1 -78.2 18.7 23 23 A Q G X S+ 0 0 59 -3,-1.0 3,-1.8 1,-0.2 -4,-0.0 -0.558 76.5 5.8 -82.4 148.1 19.9 -79.8 15.8 24 24 A D G 3 S- 0 0 82 1,-0.3 -1,-0.2 -2,-0.2 71,-0.2 0.773 134.1 -51.8 51.4 35.3 21.3 -77.7 12.9 25 25 A G G < S+ 0 0 43 -3,-0.6 -1,-0.3 1,-0.2 -2,-0.1 0.458 83.4 165.9 89.1 3.0 20.5 -74.4 14.4 26 26 A R < - 0 0 18 -3,-1.8 -1,-0.2 -6,-0.2 54,-0.2 -0.296 25.7-144.2 -56.5 131.9 16.8 -74.9 15.2 27 27 A G - 0 0 7 52,-2.4 2,-0.1 1,-0.1 52,-0.1 -0.528 30.3 -89.3 -88.8 160.4 15.3 -72.3 17.6 28 28 A P - 0 0 72 0, 0.0 96,-2.6 0, 0.0 97,-0.5 -0.460 37.1-148.8 -73.1 144.6 12.7 -73.2 20.2 29 29 A S B > -J 123 0C 0 94,-0.3 4,-1.6 95,-0.1 3,-0.4 -0.567 35.3 -99.9 -99.2 172.4 9.0 -73.1 19.3 30 30 A I H > S+ 0 0 4 92,-2.7 4,-2.4 1,-0.2 91,-0.1 0.768 125.6 59.2 -62.9 -23.1 6.2 -72.3 21.7 31 31 A W H > S+ 0 0 2 91,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.838 99.8 53.3 -73.1 -34.6 5.7 -76.1 21.9 32 32 A D H > S+ 0 0 28 -3,-0.4 4,-0.9 2,-0.2 -2,-0.2 0.911 113.1 45.5 -63.3 -42.8 9.2 -76.7 23.1 33 33 A T H >X S+ 0 0 45 -4,-1.6 3,-0.9 2,-0.2 4,-0.7 0.956 111.1 51.9 -65.0 -51.0 8.6 -74.2 25.9 34 34 A F H >< S+ 0 0 6 -4,-2.4 3,-1.2 1,-0.2 6,-0.2 0.894 106.8 52.5 -53.2 -47.1 5.1 -75.7 26.7 35 35 A C H 3< S+ 0 0 20 -4,-2.3 -1,-0.2 1,-0.3 6,-0.2 0.746 103.4 59.2 -62.6 -24.1 6.5 -79.2 27.1 36 36 A A H << S+ 0 0 74 -3,-0.9 -1,-0.3 -4,-0.9 -2,-0.2 0.657 89.8 89.1 -77.7 -18.8 9.1 -78.0 29.5 37 37 A Q S X< S- 0 0 90 -3,-1.2 3,-1.1 -4,-0.7 4,-0.3 -0.674 89.2-106.9 -82.8 135.7 6.4 -76.7 31.8 38 38 A P T 3 S+ 0 0 117 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.300 94.1 13.6 -65.3 141.5 5.0 -79.2 34.4 39 39 A G T 3 S+ 0 0 82 2,-0.2 -4,-0.1 -4,-0.1 3,-0.1 0.443 93.6 103.9 78.3 6.1 1.6 -80.8 34.0 40 40 A K S < S+ 0 0 83 -3,-1.1 2,-0.5 -6,-0.2 -5,-0.1 0.833 75.0 50.2 -85.8 -35.6 1.0 -79.8 30.4 41 41 A I S > S- 0 0 11 -4,-0.3 3,-1.7 -6,-0.2 -2,-0.2 -0.916 79.7-136.7-111.8 128.9 1.7 -83.2 28.7 42 42 A A T 3 S+ 0 0 88 384,-2.8 385,-0.1 -2,-0.5 386,-0.1 0.812 104.7 32.9 -56.5 -39.7 -0.1 -86.2 30.2 43 43 A D T 3 S- 0 0 66 383,-0.1 -1,-0.3 384,-0.1 3,-0.1 0.185 112.7-113.9-101.0 12.3 2.8 -88.6 30.1 44 44 A G S < S+ 0 0 68 -3,-1.7 -2,-0.1 1,-0.2 2,-0.1 0.739 73.0 134.7 61.0 27.0 5.3 -85.8 30.8 45 45 A S - 0 0 24 381,-0.1 2,-0.3 2,-0.0 -1,-0.2 -0.291 35.7-165.1 -97.1-178.4 6.9 -86.2 27.4 46 46 A S - 0 0 34 -2,-0.1 4,-0.4 -3,-0.1 3,-0.4 -0.912 40.4 -93.9-153.5 176.6 8.0 -83.8 24.7 47 47 A G S S+ 0 0 0 -2,-0.3 -28,-0.3 1,-0.2 -26,-0.1 0.187 80.4 121.8 -84.6 20.7 8.9 -83.7 21.1 48 48 A V S S- 0 0 82 1,-0.2 -27,-0.9 -29,-0.1 -28,-0.5 0.866 96.7 -5.3 -50.4 -48.9 12.6 -84.0 22.0 49 49 A T S > S+ 0 0 60 -3,-0.4 3,-2.6 -30,-0.3 4,-0.2 0.726 85.3 157.5-113.3 -43.9 13.2 -87.2 20.0 50 50 A A T 3 S- 0 0 4 -4,-0.4 -33,-0.2 1,-0.3 -32,-0.1 -0.275 83.0 -27.2 49.6-120.9 9.7 -88.1 18.8 51 51 A C T 3 S- 0 0 0 -34,-1.1 -1,-0.3 -4,-0.1 -33,-0.2 0.357 79.8-127.4 -99.8 2.6 10.2 -90.4 15.7 52 52 A D X + 0 0 31 -3,-2.6 3,-1.4 -35,-0.1 4,-0.3 0.771 55.2 153.2 55.8 31.7 13.6 -88.8 14.9 53 53 A S G > + 0 0 5 -36,-2.1 3,-1.1 1,-0.3 -35,-0.2 0.777 58.7 70.2 -64.8 -26.7 12.3 -88.2 11.3 54 54 A Y G 3 S+ 0 0 9 -36,-1.7 3,-0.4 1,-0.3 -1,-0.3 0.852 108.9 37.1 -54.2 -34.8 14.6 -85.3 10.8 55 55 A N G < S+ 0 0 77 -3,-1.4 -1,-0.3 -37,-0.4 -2,-0.2 0.373 115.8 54.6-100.9 1.7 17.4 -87.8 10.7 56 56 A R <> + 0 0 51 -3,-1.1 4,-2.1 -4,-0.3 -1,-0.2 -0.151 58.6 132.7-131.8 39.1 15.6 -90.6 8.9 57 57 A T H > S+ 0 0 30 -3,-0.4 4,-2.2 1,-0.2 5,-0.2 0.873 74.0 53.7 -59.7 -42.1 14.2 -89.0 5.7 58 58 A A H > S+ 0 0 77 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.920 110.6 47.9 -60.5 -41.4 15.4 -91.8 3.4 59 59 A E H > S+ 0 0 84 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.888 110.4 50.7 -66.6 -42.3 13.6 -94.3 5.6 60 60 A D H X S+ 0 0 3 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.886 111.5 48.2 -62.9 -39.1 10.4 -92.3 5.6 61 61 A I H X S+ 0 0 17 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.910 109.7 51.8 -68.5 -40.4 10.4 -91.9 1.9 62 62 A A H X S+ 0 0 61 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.854 109.5 51.0 -63.5 -35.1 11.0 -95.7 1.4 63 63 A L H X S+ 0 0 21 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.934 108.1 51.8 -66.5 -49.1 8.0 -96.4 3.7 64 64 A L H X>S+ 0 0 0 -4,-2.2 5,-2.0 1,-0.2 4,-0.5 0.874 112.6 45.5 -55.1 -37.5 5.8 -94.0 1.6 65 65 A K H ><5S+ 0 0 148 -4,-2.1 3,-0.9 1,-0.2 -2,-0.2 0.914 109.6 55.1 -72.8 -40.2 6.8 -95.9 -1.5 66 66 A S H 3<5S+ 0 0 83 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.848 111.3 45.0 -55.8 -37.0 6.3 -99.2 0.1 67 67 A L H 3<5S- 0 0 8 -4,-2.0 389,-0.3 -5,-0.1 -1,-0.3 0.526 113.2-119.0 -91.4 -7.5 2.8 -98.2 1.0 68 68 A G T <<5 + 0 0 17 -3,-0.9 -3,-0.2 -4,-0.5 -2,-0.1 0.661 45.6 175.0 80.8 23.0 2.0 -96.8 -2.4 69 69 A A < - 0 0 0 -5,-2.0 -60,-0.2 1,-0.1 -1,-0.2 -0.301 23.6-161.7 -62.8 140.4 1.3 -93.2 -1.4 70 70 A K S S+ 0 0 19 -62,-2.4 42,-2.4 1,-0.2 2,-0.3 0.735 76.5 11.6 -89.5 -30.4 0.7 -90.7 -4.3 71 71 A S E -cd 9 112B 1 -63,-1.4 -61,-0.9 40,-0.3 2,-0.4 -0.916 64.8-144.4-143.9 163.2 1.4 -87.7 -2.1 72 72 A Y E -cd 10 113B 2 40,-2.5 42,-2.5 -2,-0.3 2,-0.5 -0.983 7.1-155.7-139.8 125.7 2.8 -86.8 1.3 73 73 A R E +cd 11 114B 0 -63,-2.7 -61,-1.8 -2,-0.4 2,-0.3 -0.902 31.3 145.7-104.7 124.3 1.6 -84.0 3.6 74 74 A F E - d 0 115B 6 40,-1.7 42,-2.6 -2,-0.5 2,-0.3 -0.918 35.9-118.8-149.8 167.8 4.1 -82.7 6.1 75 75 A S E - d 0 116B 1 -2,-0.3 2,-0.5 40,-0.2 42,-0.2 -0.791 12.7-125.1-119.6 160.7 5.0 -79.4 7.7 76 76 A I - 0 0 0 40,-2.3 2,-0.9 -2,-0.3 43,-0.4 -0.862 24.1-129.2 -99.9 131.5 8.0 -77.0 7.9 77 77 A S >> - 0 0 0 -2,-0.5 3,-2.0 1,-0.2 4,-0.8 -0.727 15.6-155.0 -78.8 109.2 9.3 -76.1 11.3 78 78 A W H >> S+ 0 0 0 -2,-0.9 4,-2.6 1,-0.3 3,-1.4 0.889 91.4 59.6 -52.2 -43.1 9.4 -72.3 11.1 79 79 A S H 34 S+ 0 0 0 42,-0.5 -52,-2.4 1,-0.3 -1,-0.3 0.553 98.2 58.1 -71.5 -4.9 12.1 -72.1 13.8 80 80 A R H <4 S+ 0 0 3 -3,-2.0 15,-0.5 -54,-0.2 16,-0.3 0.692 113.6 40.7 -83.7 -22.7 14.4 -74.3 11.7 81 81 A I H << S+ 0 0 0 -3,-1.4 11,-3.2 -4,-0.8 -2,-0.2 0.897 138.3 7.4 -92.3 -47.7 14.1 -71.6 9.0 82 82 A I S < S- 0 0 0 -4,-2.6 3,-0.4 9,-0.2 -1,-0.3 -0.871 72.8-160.6-135.5 95.4 14.3 -68.4 11.1 83 83 A P S S+ 0 0 33 0, 0.0 42,-0.4 0, 0.0 41,-0.2 0.832 93.4 36.4 -54.2 -39.4 15.1 -69.5 14.6 84 84 A E S S- 0 0 102 6,-0.4 42,-0.1 2,-0.1 -5,-0.1 0.665 107.3-135.5 -83.3 -22.2 13.9 -66.2 16.3 85 85 A G + 0 0 0 -3,-0.4 61,-0.2 5,-0.3 2,-0.1 0.018 56.5 116.3 101.5 -27.4 11.1 -66.1 13.7 86 86 A G S > S- 0 0 1 1,-0.1 3,-1.8 59,-0.1 -1,-0.2 -0.313 72.5-114.3 -88.8 165.3 11.0 -62.5 12.5 87 87 A R T 3 S+ 0 0 111 1,-0.3 -1,-0.1 -2,-0.1 4,-0.1 0.636 118.4 46.8 -67.7 -17.2 11.6 -60.7 9.2 88 88 A G T 3 S+ 0 0 75 2,-0.1 -1,-0.3 0, 0.0 2,-0.2 0.328 96.7 99.1-103.6 6.3 14.6 -58.9 10.7 89 89 A D S < S- 0 0 40 -3,-1.8 2,-0.1 1,-0.1 0, 0.0 -0.563 84.2 -86.3 -97.7 156.9 16.1 -62.0 12.2 90 90 A A - 0 0 83 -2,-0.2 -6,-0.4 1,-0.1 2,-0.3 -0.334 38.9-131.2 -60.6 135.7 18.9 -64.3 10.9 91 91 A V - 0 0 74 -9,-0.2 2,-0.9 -8,-0.1 -9,-0.2 -0.695 13.7-131.8 -86.7 139.8 17.8 -67.0 8.5 92 92 A N >> - 0 0 32 -11,-3.2 4,-1.8 -2,-0.3 3,-0.9 -0.795 17.4-169.2 -96.1 98.0 19.2 -70.5 9.2 93 93 A Q H 3> S+ 0 0 108 -2,-0.9 4,-2.6 1,-0.3 -1,-0.2 0.819 83.6 59.5 -56.7 -34.8 20.6 -71.9 5.9 94 94 A A H 3> S+ 0 0 38 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.826 104.4 49.4 -61.8 -38.4 21.0 -75.4 7.3 95 95 A G H <> S+ 0 0 0 -3,-0.9 4,-1.6 -15,-0.5 -1,-0.2 0.906 112.3 48.2 -69.5 -42.6 17.2 -75.6 8.1 96 96 A I H X S+ 0 0 15 -4,-1.8 4,-2.2 -16,-0.3 -2,-0.2 0.928 109.8 52.6 -61.6 -43.5 16.4 -74.5 4.6 97 97 A D H X S+ 0 0 83 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.850 104.9 56.5 -62.4 -37.2 18.9 -77.0 3.0 98 98 A H H X S+ 0 0 32 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.931 111.5 40.5 -59.4 -48.8 17.3 -79.8 4.9 99 99 A Y H X S+ 0 0 1 -4,-1.6 4,-2.5 2,-0.2 -2,-0.2 0.828 112.0 56.2 -73.4 -32.6 13.8 -79.2 3.5 100 100 A V H X S+ 0 0 59 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.957 111.5 44.3 -59.9 -48.8 15.2 -78.5 0.0 101 101 A K H X S+ 0 0 123 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.897 111.6 53.4 -62.3 -42.7 16.9 -81.9 0.0 102 102 A F H X S+ 0 0 12 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.936 110.0 46.2 -60.6 -46.2 13.8 -83.5 1.4 103 103 A V H X S+ 0 0 6 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.870 111.5 52.6 -63.5 -39.0 11.5 -82.2 -1.3 104 104 A D H X S+ 0 0 49 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.930 110.4 48.4 -60.6 -45.6 14.1 -83.1 -4.0 105 105 A D H X S+ 0 0 41 -4,-2.5 4,-1.0 2,-0.2 -2,-0.2 0.850 110.8 50.3 -66.0 -37.9 14.1 -86.7 -2.6 106 106 A L H ><>S+ 0 0 0 -4,-2.1 5,-2.2 2,-0.2 3,-0.5 0.942 112.2 46.7 -64.1 -47.1 10.3 -86.9 -2.5 107 107 A L H ><5S+ 0 0 25 -4,-2.5 3,-1.2 1,-0.2 -2,-0.2 0.855 108.4 55.2 -67.1 -34.0 10.0 -85.7 -6.1 108 108 A D H 3<5S+ 0 0 68 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.767 106.9 52.0 -67.3 -25.8 12.8 -88.1 -7.2 109 109 A A T <<5S- 0 0 36 -4,-1.0 572,-0.5 -3,-0.5 -1,-0.3 0.457 119.4-116.0 -83.0 -6.0 10.6 -90.9 -5.7 110 110 A G T < 5S+ 0 0 3 -3,-1.2 572,-2.5 -4,-0.3 2,-0.4 0.695 71.8 133.5 75.8 22.6 7.6 -89.6 -7.7 111 111 A I < - 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