==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 10-FEB-06 2CER . COMPND 2 MOLECULE: BETA-GLUCOSIDASE A; . SOURCE 2 ORGANISM_SCIENTIFIC: SULFOLOBUS SOLFATARICUS; . AUTHOR T.M.GLOSTER,S.ROBERTS,M.MORACCI,A.VASELLA,G.J.DAVIES . 977 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35848.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 695 71.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 99 10.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 52 5.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.4 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 . 4 0.4 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 . 71 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 96 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 297 30.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 23 2.4 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 4 3 2 2 1 4 0 2 3 0 3 0 2 2 2 0 0 0 0 1 0 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 4 6 2 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 10 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 2 0 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 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 0 106 0, 0.0 2,-0.5 0, 0.0 471,-0.2 0.000 360.0 360.0 360.0 139.4 50.2 -95.4 -0.7 2 2 A Y E -A 471 0A 60 469,-2.0 469,-1.9 2,-0.0 2,-0.3 -0.933 360.0-162.2-120.1 102.3 52.9 -93.0 -2.2 3 3 A S E -A 470 0A 67 -2,-0.5 467,-0.2 467,-0.2 466,-0.1 -0.675 3.0-149.3 -93.1 138.5 56.1 -95.0 -2.4 4 4 A F - 0 0 17 465,-2.5 406,-0.0 -2,-0.3 -2,-0.0 -0.732 35.0 -83.7-103.3 155.7 59.5 -93.3 -2.9 5 5 A P > - 0 0 56 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 -0.224 40.4-116.2 -55.6 145.1 62.5 -94.7 -4.7 6 6 A N T 3 S+ 0 0 172 1,-0.3 -2,-0.0 -3,-0.1 463,-0.0 0.696 117.2 50.6 -54.3 -24.0 64.6 -97.0 -2.6 7 7 A S T 3 S+ 0 0 96 2,-0.1 -1,-0.3 414,-0.0 2,-0.1 0.632 85.1 106.0 -92.8 -20.1 67.5 -94.5 -2.8 8 8 A F < - 0 0 10 -3,-1.3 2,-0.4 461,-0.1 413,-0.2 -0.345 59.4-151.7 -57.0 136.1 65.4 -91.4 -1.8 9 9 A R E -b 421 0B 78 411,-1.7 413,-1.7 -2,-0.1 2,-0.4 -0.948 9.3-151.8-123.2 140.5 66.2 -90.3 1.7 10 10 A F E +b 422 0B 8 -2,-0.4 66,-2.9 64,-0.3 67,-0.8 -0.893 40.5 110.3-104.5 134.8 64.1 -88.5 4.4 11 11 A G E -bc 423 77B 0 411,-2.4 413,-2.8 -2,-0.4 2,-0.3 -0.705 49.3 -80.5-163.6-138.3 65.7 -86.2 7.0 12 12 A W E -bc 424 78B 0 65,-1.2 67,-2.1 411,-0.3 2,-0.3 -0.959 15.0-135.2-150.0 161.0 66.3 -82.7 8.3 13 13 A S E + c 0 79B 0 411,-1.9 414,-0.5 -2,-0.3 413,-0.5 -0.894 23.6 174.8-118.8 153.7 68.1 -79.5 8.0 14 14 A Q - 0 0 2 65,-1.7 2,-0.3 -2,-0.3 67,-0.2 -0.967 20.3-134.6-156.0 148.7 69.6 -77.4 10.8 15 15 A A > - 0 0 1 -2,-0.3 4,-1.9 65,-0.2 5,-0.3 -0.887 14.4-132.9-113.0 149.6 71.8 -74.2 11.1 16 16 A G H > S+ 0 0 2 -2,-0.3 4,-2.4 1,-0.2 5,-0.4 0.960 105.4 43.9 -61.6 -54.7 74.8 -73.7 13.3 17 17 A F H 4 S+ 0 0 2 133,-0.2 -1,-0.2 1,-0.2 4,-0.2 0.786 117.4 47.4 -63.8 -29.4 73.8 -70.3 14.8 18 18 A Q H 4 S+ 0 0 3 1,-0.1 413,-1.9 412,-0.1 -1,-0.2 0.845 126.7 19.7 -81.9 -35.1 70.2 -71.4 15.4 19 19 A S H < S+ 0 0 0 -4,-1.9 40,-3.0 411,-0.2 41,-0.2 0.631 106.5 70.3-113.0 -23.5 70.8 -74.8 17.1 20 20 A E S >< S+ 0 0 4 -4,-2.4 40,-1.8 -5,-0.3 3,-0.5 0.963 83.6 71.4 -71.8 -50.7 74.4 -75.1 18.5 21 21 A M T 3 + 0 0 3 -5,-0.4 37,-2.8 -4,-0.2 38,-0.3 -0.169 60.1 78.5 -70.1 158.3 74.4 -72.7 21.5 22 22 A G T 3 S+ 0 0 10 1,-0.4 -1,-0.2 32,-0.3 32,-0.1 -0.084 71.7 87.4 136.4 -36.0 72.5 -73.2 24.7 23 23 A T S X S- 0 0 22 -3,-0.5 3,-2.3 1,-0.1 -1,-0.4 -0.814 93.3-100.1 -86.4 125.8 74.8 -75.6 26.6 24 24 A P T 3 S+ 0 0 139 0, 0.0 -1,-0.1 0, 0.0 30,-0.0 -0.194 112.5 35.9 -44.2 133.5 77.6 -73.9 28.7 25 25 A G T 3 S+ 0 0 74 -3,-0.0 -4,-0.1 36,-0.0 0, 0.0 0.090 95.7 88.0 106.6 -20.7 80.8 -74.0 26.6 26 26 A S < + 0 0 4 -3,-2.3 -5,-0.1 28,-0.1 33,-0.0 0.523 54.3 131.0 -89.0 -8.2 79.1 -73.6 23.2 27 27 A E - 0 0 97 -4,-0.2 27,-0.0 27,-0.1 0, 0.0 -0.218 31.4-177.0 -65.8 130.0 79.1 -69.8 23.1 28 28 A D + 0 0 7 1,-0.1 3,-0.2 -11,-0.1 6,-0.1 -0.912 10.4 169.0-123.5 97.2 80.3 -68.2 19.9 29 29 A P + 0 0 48 0, 0.0 2,-0.5 0, 0.0 6,-0.1 0.451 54.6 96.2 -84.9 3.2 80.3 -64.4 20.3 30 30 A N + 0 0 59 4,-0.1 125,-2.0 55,-0.1 126,-0.3 -0.078 61.7 87.8 -94.3 35.9 82.3 -64.0 17.1 31 31 A T B > S-K 154 0C 0 -2,-0.5 4,-1.8 123,-0.3 5,-0.2 -0.892 76.5-122.3-127.2 156.8 79.7 -63.3 14.4 32 32 A D H > S+ 0 0 5 121,-1.9 4,-3.2 -2,-0.3 5,-0.1 0.924 115.7 52.6 -55.4 -47.0 77.8 -60.3 12.9 33 33 A W H > S+ 0 0 6 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.885 106.2 51.5 -57.9 -44.0 74.5 -62.0 13.9 34 34 A Y H > S+ 0 0 27 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.955 116.3 40.7 -58.3 -49.9 75.6 -62.5 17.5 35 35 A K H X S+ 0 0 69 -4,-1.8 4,-0.6 1,-0.2 3,-0.5 0.893 113.1 55.5 -63.6 -44.4 76.5 -58.8 17.9 36 36 A W H >< S+ 0 0 0 -4,-3.2 3,-0.6 1,-0.2 -1,-0.2 0.881 108.7 45.7 -56.8 -43.7 73.5 -57.7 15.9 37 37 A V H 3< S+ 0 0 0 -4,-2.3 -1,-0.2 1,-0.2 13,-0.2 0.582 114.0 50.3 -81.0 -12.7 71.0 -59.6 18.2 38 38 A H H 3< S+ 0 0 54 -4,-0.9 -1,-0.2 -3,-0.5 -2,-0.2 0.429 81.6 122.9 -95.5 -4.2 72.8 -58.2 21.4 39 39 A D S+ 0 0 79 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.863 99.1 47.6 -51.4 -46.5 71.0 -52.3 22.6 41 41 A E H > S+ 0 0 12 2,-0.2 4,-2.0 1,-0.2 6,-0.2 0.922 110.9 50.5 -67.5 -43.5 69.7 -50.1 19.8 42 42 A N H >>S+ 0 0 0 2,-0.2 5,-1.8 1,-0.2 6,-1.3 0.852 112.2 49.2 -59.5 -38.2 68.4 -53.0 17.7 43 43 A M H ><5S+ 0 0 86 -4,-2.2 3,-1.1 2,-0.2 -2,-0.2 0.943 111.9 46.2 -66.6 -50.3 66.6 -54.3 20.8 44 44 A A H 3<5S+ 0 0 58 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.803 111.0 53.9 -61.8 -32.2 65.0 -51.0 21.6 45 45 A A H 3<5S- 0 0 11 -4,-2.0 664,-0.5 -5,-0.2 -1,-0.3 0.659 109.8-124.7 -75.0 -16.4 64.0 -50.6 18.0 46 46 A G T <<5S+ 0 0 33 -3,-1.1 -3,-0.2 -4,-0.5 -2,-0.1 0.616 76.7 125.0 77.8 13.4 62.3 -54.0 18.0 47 47 A L S - 0 0 42 -2,-0.2 3,-1.8 -3,-0.1 -18,-0.1 -0.937 12.0-134.9-123.5 136.0 69.7 -64.5 22.7 53 53 A P G > S+ 0 0 2 0, 0.0 3,-1.5 0, 0.0 378,-0.1 0.711 99.0 71.8 -63.8 -18.8 71.1 -67.4 20.8 54 54 A E G 3 S+ 0 0 37 1,-0.3 -32,-0.3 -33,-0.1 -28,-0.1 0.569 93.1 57.8 -75.9 -6.6 73.2 -68.6 23.9 55 55 A N G < S+ 0 0 94 -3,-1.8 -1,-0.3 -34,-0.1 -33,-0.1 0.065 91.6 121.1-102.5 23.5 70.0 -69.7 25.6 56 56 A G S < S- 0 0 0 -3,-1.5 -37,-0.1 1,-0.1 374,-0.1 0.272 82.9 -71.3 -77.1-162.8 69.3 -72.0 22.6 57 57 A P - 0 0 0 0, 0.0 -35,-0.2 0, 0.0 -37,-0.1 0.567 58.8-128.5 -76.1 -10.1 68.7 -75.7 22.2 58 58 A G > + 0 0 0 -37,-2.8 4,-2.6 3,-0.1 -38,-0.2 0.897 46.3 159.0 65.3 47.3 72.3 -76.8 22.8 59 59 A Y H > S+ 0 0 4 -40,-3.0 4,-1.2 -38,-0.3 -39,-0.2 0.791 70.0 69.2 -63.3 -31.2 73.2 -79.0 19.8 60 60 A W H 4 S+ 0 0 27 -40,-1.8 -1,-0.2 -41,-0.2 3,-0.1 0.934 117.9 19.4 -51.0 -54.8 76.9 -78.3 20.5 61 61 A G H 4 S+ 0 0 41 -41,-0.4 3,-0.3 -3,-0.2 -2,-0.2 0.831 131.6 44.8 -82.7 -35.4 76.7 -80.4 23.8 62 62 A N H >X + 0 0 49 -4,-2.6 4,-1.6 -42,-0.2 3,-0.8 0.184 68.9 120.4-101.7 17.1 73.6 -82.5 23.1 63 63 A Y H 3X S+ 0 0 25 -4,-1.2 4,-2.2 1,-0.2 -1,-0.2 0.699 70.9 61.6 -53.7 -26.6 74.1 -83.6 19.5 64 64 A K H 3> S+ 0 0 117 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.912 104.3 47.7 -70.0 -43.5 74.0 -87.3 20.5 65 65 A T H <> S+ 0 0 70 -3,-0.8 4,-2.2 2,-0.2 -2,-0.2 0.907 110.9 52.5 -55.6 -46.4 70.4 -86.9 21.8 66 66 A F H X S+ 0 0 2 -4,-1.6 4,-1.9 1,-0.2 -2,-0.2 0.937 113.7 43.0 -54.8 -50.6 69.5 -85.1 18.5 67 67 A H H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.789 108.9 57.4 -68.5 -35.5 71.0 -88.0 16.4 68 68 A D H X S+ 0 0 58 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.962 111.1 43.5 -57.9 -52.1 69.4 -90.7 18.6 69 69 A N H X S+ 0 0 18 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.847 111.6 53.6 -60.6 -42.1 65.9 -89.2 18.0 70 70 A A H <>S+ 0 0 0 -4,-1.9 5,-2.7 2,-0.2 -1,-0.2 0.833 111.1 46.8 -61.1 -38.1 66.7 -88.8 14.3 71 71 A Q H ><5S+ 0 0 92 -4,-1.9 3,-1.6 3,-0.2 -2,-0.2 0.909 110.9 50.4 -72.6 -45.0 67.6 -92.4 14.0 72 72 A K H 3<5S+ 0 0 116 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.866 106.5 57.6 -55.8 -36.8 64.6 -93.6 16.0 73 73 A M T 3<5S- 0 0 0 -4,-2.0 394,-0.3 -5,-0.2 393,-0.3 0.471 118.3-116.1 -74.8 -2.2 62.6 -91.4 13.5 74 74 A G T < 5 + 0 0 15 -3,-1.6 -64,-0.3 1,-0.2 -3,-0.2 0.692 57.2 163.3 73.9 21.6 64.0 -93.5 10.6 75 75 A L < + 0 0 4 -5,-2.7 -64,-0.2 -6,-0.1 -1,-0.2 -0.481 19.9 178.5 -77.7 143.1 65.9 -90.5 9.2 76 76 A K + 0 0 100 -66,-2.9 67,-2.6 -2,-0.1 2,-0.3 0.303 59.5 49.6-127.6 6.4 68.7 -91.2 6.7 77 77 A I E -cd 11 143B 0 -67,-0.8 -65,-1.2 65,-0.3 2,-0.3 -0.993 53.9-177.6-149.2 148.4 69.9 -87.8 5.6 78 78 A A E -cd 12 144B 0 65,-2.0 67,-3.1 -2,-0.3 2,-0.4 -0.988 7.0-165.5-150.3 135.4 71.0 -84.6 7.4 79 79 A R E +cd 13 145B 0 -67,-2.1 -65,-1.7 -2,-0.3 2,-0.3 -0.990 25.9 140.3-126.0 122.7 72.2 -81.2 6.2 80 80 A L E - d 0 146B 7 65,-1.6 67,-3.0 -2,-0.4 2,-0.3 -0.869 35.9-117.7-142.5 179.9 73.9 -78.7 8.4 81 81 A N E - d 0 147B 2 -2,-0.3 2,-0.4 -67,-0.2 67,-0.2 -0.879 12.7-126.9-119.3 152.2 76.7 -76.1 8.4 82 82 A V - 0 0 0 65,-1.4 2,-0.8 -2,-0.3 68,-0.2 -0.784 35.8-119.1 -81.2 142.9 80.0 -75.4 10.1 83 83 A E >> - 0 0 4 -2,-0.4 3,-1.9 1,-0.2 4,-1.3 -0.831 15.8-152.0 -87.2 109.1 80.1 -71.9 11.6 84 84 A W H 3> S+ 0 0 8 -2,-0.8 4,-3.2 64,-0.4 3,-0.4 0.862 94.9 58.4 -36.8 -54.1 83.1 -70.0 9.9 85 85 A S H 34 S+ 0 0 1 1,-0.3 -1,-0.3 2,-0.2 -55,-0.1 0.684 101.5 54.3 -58.2 -27.4 83.5 -67.9 13.0 86 86 A R H <4 S+ 0 0 18 -3,-1.9 40,-0.3 2,-0.1 -1,-0.3 0.889 114.9 40.0 -74.2 -39.9 84.1 -70.9 15.2 87 87 A I H < S+ 0 0 0 -4,-1.3 36,-3.0 -3,-0.4 -2,-0.2 0.915 132.2 24.1 -75.9 -44.8 86.9 -72.1 12.8 88 88 A F < + 0 0 3 -4,-3.2 -1,-0.2 34,-0.2 -2,-0.1 -0.660 67.0 155.4-122.4 77.4 88.4 -68.6 12.2 89 89 A P + 0 0 26 0, 0.0 67,-0.2 0, 0.0 -1,-0.1 0.731 61.5 63.5 -70.6 -23.3 87.5 -66.4 15.1 90 90 A N S S- 0 0 106 31,-0.3 -60,-0.0 1,-0.1 31,-0.0 -0.825 96.2 -89.2-112.2 145.6 90.5 -64.0 14.6 91 91 A P - 0 0 88 0, 0.0 -1,-0.1 0, 0.0 66,-0.0 -0.086 34.8-137.6 -53.0 139.0 91.4 -61.8 11.6 92 92 A L - 0 0 9 -4,-0.1 90,-0.0 1,-0.1 2,-0.0 -0.786 31.1-100.5 -91.8 143.3 93.5 -63.3 8.8 93 93 A P - 0 0 76 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.379 52.9 -88.7 -60.6 142.6 96.3 -61.1 7.4 94 94 A R - 0 0 176 1,-0.1 3,-0.1 -2,-0.0 84,-0.0 -0.184 52.7 -89.0 -57.3 143.1 95.2 -59.4 4.1 95 95 A P > - 0 0 15 0, 0.0 3,-1.2 0, 0.0 2,-0.4 -0.247 50.0 -98.8 -54.1 135.6 95.9 -61.4 0.9 96 96 A Q T 3 S- 0 0 167 1,-0.3 3,-0.1 -3,-0.1 -2,-0.0 -0.449 95.6 -24.9 -64.5 117.2 99.3 -60.7 -0.6 97 97 A N T 3 S+ 0 0 147 -2,-0.4 2,-0.5 1,-0.2 -1,-0.3 0.848 90.6 153.9 35.8 53.4 98.8 -58.1 -3.4 98 98 A F < - 0 0 51 -3,-1.2 2,-1.0 4,-0.0 -1,-0.2 -0.906 47.9-124.1 -98.6 131.7 95.1 -59.1 -4.0 99 99 A D > - 0 0 98 -2,-0.5 3,-1.7 1,-0.2 -3,-0.0 -0.693 25.4-172.6 -93.7 101.0 93.5 -56.0 -5.4 100 100 A E T 3 S+ 0 0 84 -2,-1.0 77,-0.4 1,-0.3 78,-0.2 0.425 82.9 61.0 -75.9 0.4 90.5 -55.1 -3.2 101 101 A S T 3 S+ 0 0 100 76,-0.1 -1,-0.3 0, 0.0 2,-0.2 0.555 79.7 103.4 -96.0 -17.4 89.3 -52.4 -5.6 102 102 A K < - 0 0 103 -3,-1.7 75,-0.1 1,-0.1 -4,-0.0 -0.536 63.0-152.4 -68.6 131.7 88.8 -54.9 -8.4 103 103 A Q S S+ 0 0 101 -2,-0.2 2,-0.3 74,-0.0 -1,-0.1 0.857 74.0 59.9 -76.5 -43.3 85.1 -55.7 -8.9 104 104 A D - 0 0 25 137,-0.0 2,-0.5 2,-0.0 3,-0.1 -0.658 58.8-163.8 -89.1 144.4 85.4 -59.3 -10.3 105 105 A V + 0 0 8 -2,-0.3 140,-0.1 1,-0.1 3,-0.1 -0.907 19.0 167.8-124.1 97.0 87.0 -62.1 -8.4 106 106 A T + 0 0 52 -2,-0.5 2,-0.3 1,-0.3 -1,-0.1 0.576 63.8 6.2 -94.3 -15.0 87.6 -64.6 -11.3 107 107 A E - 0 0 135 -3,-0.1 2,-0.4 2,-0.0 -1,-0.3 -0.943 48.4-161.6-164.2 152.6 89.9 -66.9 -9.4 108 108 A V - 0 0 18 -2,-0.3 2,-0.4 137,-0.1 -3,-0.0 -0.960 28.3-137.4-132.2 109.2 91.4 -67.6 -5.9 109 109 A E + 0 0 140 -2,-0.4 2,-0.4 5,-0.0 -2,-0.0 -0.564 28.4 176.1 -75.8 125.9 94.4 -69.8 -6.1 110 110 A I + 0 0 22 -2,-0.4 2,-0.3 4,-0.0 -2,-0.0 -0.996 5.8 155.0-131.5 135.1 94.4 -72.4 -3.4 111 111 A N > - 0 0 67 -2,-0.4 4,-2.7 1,-0.0 5,-0.2 -0.897 57.6 -82.4-146.5-179.3 96.9 -75.2 -2.8 112 112 A E H > S+ 0 0 114 -2,-0.3 4,-2.2 1,-0.2 5,-0.1 0.813 126.5 50.0 -58.6 -36.8 98.3 -77.5 -0.1 113 113 A N H > S+ 0 0 109 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.949 111.9 46.6 -65.0 -52.0 100.8 -74.8 1.0 114 114 A E H > S+ 0 0 32 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.868 114.1 50.3 -57.8 -37.9 98.0 -72.1 1.3 115 115 A L H X S+ 0 0 5 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.869 108.6 49.9 -69.5 -41.1 95.9 -74.7 3.1 116 116 A K H X S+ 0 0 87 -4,-2.2 4,-0.5 2,-0.2 -1,-0.2 0.811 108.7 55.1 -64.7 -30.7 98.6 -75.6 5.6 117 117 A R H >< S+ 0 0 151 -4,-1.9 3,-1.1 2,-0.2 -2,-0.2 0.926 109.2 45.1 -68.3 -43.9 99.1 -71.8 6.2 118 118 A L H >X S+ 0 0 3 -4,-1.7 3,-3.0 1,-0.2 4,-1.3 0.884 101.1 70.9 -62.3 -40.3 95.4 -71.4 7.1 119 119 A D H 3< S+ 0 0 37 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.747 92.0 56.9 -50.0 -25.4 95.7 -74.5 9.3 120 120 A E T << S+ 0 0 72 -3,-1.1 -1,-0.3 -4,-0.5 -2,-0.2 0.572 108.6 46.5 -87.6 -8.5 97.9 -72.5 11.8 121 121 A Y T <4 S+ 0 0 121 -3,-3.0 -31,-0.3 -4,-0.2 -2,-0.2 0.646 89.9 106.5-100.2 -24.0 95.1 -69.9 12.2 122 122 A A S < S- 0 0 11 -4,-1.3 2,-0.6 -34,-0.1 -34,-0.2 -0.292 77.4-116.4 -64.4 137.0 92.2 -72.4 12.7 123 123 A N > - 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