==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 11-APR-01 1IEQ . COMPND 2 MOLECULE: BETA-D-GLUCAN GLUCOHYDROLASE ISOENZYME EXO1; . SOURCE 2 ORGANISM_SCIENTIFIC: HORDEUM VULGARE; . AUTHOR M.HRMOVA,R.DEGORI,G.B.FINCHER,J.N.VARGHESE . 602 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20231.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 411 68.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 59 9.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 13 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 41 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 80 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 151 25.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 3.0 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 1 2 5 4 1 1 1 1 0 1 1 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 3 4 1 2 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 PARALLEL BRIDGES PER LADDER . 2 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 1 0 1 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 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 D 0 0 187 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-175.7 29.5 4.0 -1.9 2 2 A Y - 0 0 116 1,-0.1 2,-0.8 2,-0.0 5,-0.0 -0.277 360.0-147.4 -56.4 131.2 26.9 3.3 0.9 3 3 A V > - 0 0 42 1,-0.2 3,-1.6 2,-0.0 4,-0.4 -0.829 7.9-164.2-107.7 95.2 27.4 5.4 4.0 4 4 A L G > S+ 0 0 26 -2,-0.8 3,-1.9 1,-0.3 6,-0.2 0.827 83.1 55.8 -43.2 -51.4 26.3 3.3 7.0 5 5 A Y G 3 S+ 0 0 7 1,-0.3 -1,-0.3 10,-0.2 10,-0.1 0.754 103.8 54.9 -61.9 -24.1 26.0 6.1 9.6 6 6 A K G < S+ 0 0 122 -3,-1.6 2,-0.9 1,-0.0 -1,-0.3 0.496 85.0 99.9 -86.3 -3.5 23.6 8.1 7.4 7 7 A D X - 0 0 35 -3,-1.9 3,-1.8 -4,-0.4 8,-0.1 -0.739 57.5-163.9 -87.5 105.2 21.2 5.1 7.1 8 8 A A T 3 S+ 0 0 56 -2,-0.9 -1,-0.1 1,-0.3 4,-0.1 0.539 84.0 65.6 -66.8 -4.6 18.4 5.7 9.6 9 9 A T T 3 S+ 0 0 118 2,-0.1 -1,-0.3 -3,-0.0 -2,-0.0 0.477 85.0 91.0 -95.7 -2.9 17.4 2.0 9.3 10 10 A K S < S- 0 0 76 -3,-1.8 5,-0.1 -6,-0.2 0, 0.0 -0.599 88.6 -89.4 -94.2 154.7 20.6 0.7 10.9 11 11 A P > - 0 0 74 0, 0.0 4,-2.2 0, 0.0 3,-0.2 -0.269 35.2-120.0 -59.9 145.4 21.2 -0.0 14.6 12 12 A V H > S+ 0 0 39 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.905 111.8 52.5 -52.0 -51.7 22.6 2.9 16.6 13 13 A E H > S+ 0 0 81 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.891 109.8 50.2 -55.5 -41.3 25.8 1.1 17.7 14 14 A D H > S+ 0 0 84 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.934 111.9 47.3 -62.6 -45.9 26.5 0.3 14.0 15 15 A R H X S+ 0 0 7 -4,-2.2 4,-2.3 2,-0.2 5,-0.2 0.912 112.2 49.9 -62.8 -43.2 26.0 3.9 13.0 16 16 A V H X S+ 0 0 3 -4,-3.1 4,-3.0 2,-0.2 5,-0.3 0.957 112.4 46.9 -60.4 -50.5 28.2 5.1 15.8 17 17 A A H X S+ 0 0 64 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.923 112.2 50.5 -56.9 -46.9 31.0 2.7 14.9 18 18 A D H < S+ 0 0 43 -4,-2.6 4,-0.3 -5,-0.2 -1,-0.2 0.896 115.2 42.1 -60.0 -42.8 30.8 3.6 11.3 19 19 A L H >X S+ 0 0 0 -4,-2.3 3,-2.4 1,-0.2 4,-1.0 0.960 111.0 53.5 -70.5 -51.4 30.9 7.4 11.9 20 20 A L H >< S+ 0 0 23 -4,-3.0 3,-0.9 1,-0.3 -2,-0.2 0.887 103.0 60.8 -49.5 -42.6 33.6 7.3 14.6 21 21 A G T 3< S+ 0 0 68 -4,-2.2 -1,-0.3 -5,-0.3 -2,-0.2 0.624 105.8 45.7 -63.6 -13.9 35.8 5.3 12.1 22 22 A R T <4 S+ 0 0 88 -3,-2.4 -1,-0.2 -4,-0.3 -2,-0.2 0.588 90.1 109.3-103.4 -14.3 35.8 8.2 9.6 23 23 A M << - 0 0 15 -4,-1.0 2,-0.1 -3,-0.9 -3,-0.0 -0.377 58.0-141.8 -72.3 138.9 36.5 11.0 12.0 24 24 A T > - 0 0 68 -2,-0.1 4,-1.7 1,-0.1 5,-0.2 -0.389 35.5-100.2 -85.5 170.0 39.8 12.9 12.2 25 25 A L H > S+ 0 0 43 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.897 123.9 53.8 -60.7 -39.2 41.2 14.0 15.5 26 26 A A H > S+ 0 0 48 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.888 108.6 49.0 -62.8 -39.2 39.8 17.6 15.0 27 27 A E H > S+ 0 0 8 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.800 112.0 49.0 -72.4 -27.7 36.3 16.2 14.4 28 28 A K H X S+ 0 0 20 -4,-1.7 4,-1.3 2,-0.2 3,-0.3 0.936 111.8 46.0 -76.7 -47.8 36.5 14.1 17.5 29 29 A I H < S+ 0 0 0 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.800 109.3 61.0 -64.0 -24.6 37.7 16.8 19.8 30 30 A G H >< S+ 0 0 0 -4,-1.3 21,-2.1 -5,-0.3 3,-1.8 0.911 99.2 51.8 -67.8 -43.7 35.0 18.9 18.2 31 31 A Q H 3< S+ 0 0 5 -4,-1.4 -1,-0.2 1,-0.3 -2,-0.2 0.830 105.3 58.2 -61.4 -31.0 32.1 16.7 19.3 32 32 A M T 3< S+ 0 0 0 -4,-1.3 283,-2.9 282,-0.1 2,-0.6 0.471 92.0 91.6 -79.1 1.0 33.5 16.9 22.8 33 33 A T E < -a 315 0A 0 -3,-1.8 19,-1.3 16,-0.2 18,-0.9 -0.865 50.3-177.2-108.3 118.9 33.2 20.7 22.7 34 34 A Q E -ab 316 52A 0 281,-2.5 283,-1.0 -2,-0.6 2,-0.3 -0.944 13.3-174.3-111.3 124.3 30.1 22.6 23.9 35 35 A I E - b 0 53A 0 17,-2.3 19,-1.4 -2,-0.5 2,-0.2 -0.799 28.6-103.7-119.7 159.7 30.1 26.4 23.5 36 36 A E E > - b 0 54A 4 282,-2.8 3,-1.9 -2,-0.3 4,-0.3 -0.539 28.4-126.3 -76.8 141.9 27.8 29.3 24.5 37 37 A R G > S+ 0 0 41 17,-1.8 3,-2.0 1,-0.3 -1,-0.1 0.853 106.5 72.8 -58.0 -31.9 25.7 30.7 21.6 38 38 A L G 3 S+ 0 0 120 1,-0.3 -1,-0.3 3,-0.0 281,-0.1 0.739 106.6 33.9 -55.8 -24.6 27.2 34.1 22.5 39 39 A V G < S+ 0 0 43 -3,-1.9 2,-0.3 279,-0.2 -1,-0.3 0.263 97.4 113.3-113.7 10.8 30.5 33.0 21.0 40 40 A A < + 0 0 13 -3,-2.0 3,-0.1 -4,-0.3 13,-0.0 -0.636 35.9 171.1 -89.8 142.5 29.1 30.9 18.2 41 41 A T > - 0 0 55 -2,-0.3 4,-3.1 1,-0.1 5,-0.4 -0.963 46.4-113.4-142.5 153.2 29.4 31.7 14.5 42 42 A P H > S+ 0 0 65 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.919 123.0 44.8 -55.7 -38.9 28.6 29.7 11.4 43 43 A D H > S+ 0 0 91 2,-0.2 4,-4.1 3,-0.2 5,-0.4 0.945 112.3 49.6 -67.6 -50.6 32.3 29.7 10.8 44 44 A V H > S+ 0 0 20 1,-0.2 4,-2.4 2,-0.2 6,-0.4 0.944 115.9 42.8 -54.9 -51.1 33.3 28.8 14.3 45 45 A L H X>S+ 0 0 0 -4,-3.1 5,-1.2 2,-0.2 4,-0.6 0.927 120.7 42.8 -61.6 -45.8 30.9 25.9 14.4 46 46 A R H ><5S+ 0 0 84 -4,-2.3 3,-0.8 -5,-0.4 -2,-0.2 0.971 118.7 41.5 -66.4 -55.0 31.8 24.8 10.9 47 47 A D H 3<5S+ 0 0 103 -4,-4.1 -2,-0.2 1,-0.2 -3,-0.2 0.804 121.8 40.7 -66.4 -29.9 35.6 25.2 11.2 48 48 A N H 3<5S- 0 0 47 -4,-2.4 -1,-0.2 -5,-0.4 -2,-0.2 0.436 101.4-129.2 -98.5 2.1 35.9 23.8 14.7 49 49 A F T <<5 - 0 0 52 -3,-0.8 -16,-0.2 -4,-0.6 -3,-0.2 0.846 32.7-159.2 54.7 37.2 33.3 21.0 14.2 50 50 A I < - 0 0 3 -5,-1.2 -19,-0.2 -6,-0.4 -1,-0.2 -0.189 14.0-163.3 -50.8 129.6 31.5 22.0 17.3 51 51 A G + 0 0 0 -21,-2.1 40,-1.4 -18,-0.9 2,-0.3 0.580 65.6 17.7 -94.1 -10.8 29.4 19.2 18.7 52 52 A S E -bc 34 91A 0 -19,-1.3 -17,-2.3 -22,-0.3 2,-0.3 -0.987 52.2-166.5-162.4 149.5 27.1 21.3 21.0 53 53 A L E -bc 35 92A 0 38,-1.4 40,-2.5 -2,-0.3 2,-0.3 -0.840 14.4-176.3-127.6 165.9 25.8 24.7 21.9 54 54 A L E -bc 36 93A 0 -19,-1.4 -17,-1.8 -2,-0.3 2,-0.5 -0.990 25.3-131.3-161.2 157.7 24.0 26.0 24.9 55 55 A S E - c 0 94A 0 38,-1.8 40,-0.6 -2,-0.3 3,-0.1 -0.971 25.8-150.6-112.5 120.7 22.3 29.0 26.5 56 56 A G > - 0 0 5 -2,-0.5 3,-2.4 1,-0.2 -19,-0.0 -0.224 53.7 -52.1 -76.7-179.7 23.4 29.7 30.0 57 57 A G T 3 S+ 0 0 26 1,-0.3 377,-0.4 37,-0.1 -1,-0.2 -0.325 132.6 6.2 -54.7 130.0 20.9 31.4 32.3 58 58 A G T 3 S+ 0 0 21 375,-0.3 2,-1.4 1,-0.2 -1,-0.3 0.359 87.8 136.6 79.2 -6.5 19.7 34.5 30.5 59 59 A S < + 0 0 9 -3,-2.4 -1,-0.2 374,-0.0 -22,-0.1 -0.589 32.4 149.2 -79.0 93.5 21.4 33.8 27.2 60 60 A V - 0 0 26 -2,-1.4 3,-0.1 1,-0.1 43,-0.0 -0.821 59.1-118.8-126.8 163.7 18.7 34.7 24.7 61 61 A P S S- 0 0 40 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.922 94.1 -23.3 -63.0 -48.1 18.2 36.1 21.2 62 62 A R S > S- 0 0 144 4,-0.1 3,-1.5 -3,-0.0 2,-0.3 -0.962 77.8 -87.5-157.2 161.0 16.2 39.1 22.4 63 63 A K T 3 S+ 0 0 138 -2,-0.3 40,-0.1 1,-0.3 369,-0.0 -0.613 119.4 12.6 -74.0 135.4 14.2 40.0 25.4 64 64 A G T 3 S+ 0 0 35 -2,-0.3 -1,-0.3 1,-0.2 39,-0.1 0.563 90.5 169.3 75.1 8.9 10.7 38.8 24.6 65 65 A A < - 0 0 2 -3,-1.5 39,-0.3 1,-0.1 -1,-0.2 -0.171 30.0-121.5 -54.3 145.7 11.8 36.8 21.6 66 66 A T > - 0 0 73 1,-0.1 4,-1.8 37,-0.1 5,-0.1 -0.280 24.2-101.4 -84.6 173.5 9.1 34.4 20.2 67 67 A A H > S+ 0 0 10 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.886 123.5 53.0 -62.8 -38.7 9.3 30.7 19.7 68 68 A K H > S+ 0 0 94 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.861 104.0 56.6 -65.2 -35.0 10.1 31.1 16.0 69 69 A E H > S+ 0 0 47 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.939 109.9 45.0 -61.2 -45.4 13.0 33.4 16.9 70 70 A W H X S+ 0 0 3 -4,-1.8 4,-2.8 2,-0.2 5,-0.3 0.953 113.1 50.2 -62.0 -49.6 14.4 30.7 19.0 71 71 A Q H X S+ 0 0 3 -4,-2.7 4,-2.9 66,-0.3 293,-0.3 0.912 111.3 49.6 -55.2 -41.8 13.8 28.1 16.3 72 72 A D H X S+ 0 0 105 -4,-3.1 4,-1.7 2,-0.2 -1,-0.2 0.865 110.5 50.0 -66.4 -36.0 15.5 30.3 13.8 73 73 A M H X S+ 0 0 27 -4,-2.2 4,-1.6 2,-0.2 -2,-0.2 0.947 114.7 42.8 -67.7 -47.4 18.5 30.8 16.1 74 74 A V H X S+ 0 0 0 -4,-2.8 4,-2.7 64,-0.3 3,-0.2 0.942 113.8 50.0 -64.5 -49.0 19.0 27.1 16.7 75 75 A D H X S+ 0 0 28 -4,-2.9 4,-2.8 -5,-0.3 -1,-0.2 0.864 106.9 58.3 -57.7 -34.9 18.4 26.2 13.0 76 76 A G H X S+ 0 0 36 -4,-1.7 4,-1.0 -5,-0.2 -1,-0.2 0.915 110.3 40.6 -61.1 -44.7 20.9 28.8 12.1 77 77 A F H X S+ 0 0 28 -4,-1.6 4,-1.8 -3,-0.2 3,-0.2 0.892 114.0 54.9 -70.1 -39.6 23.6 27.2 14.2 78 78 A Q H X S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.2 5,-0.2 0.906 101.5 56.6 -60.7 -45.0 22.5 23.7 13.0 79 79 A K H X S+ 0 0 140 -4,-2.8 4,-0.6 1,-0.2 -1,-0.2 0.862 106.0 52.5 -55.3 -37.2 22.8 24.6 9.3 80 80 A A H >< S+ 0 0 2 -4,-1.0 3,-0.9 -3,-0.2 -1,-0.2 0.942 112.6 43.5 -64.5 -47.4 26.5 25.5 10.0 81 81 A C H >< S+ 0 0 2 -4,-1.8 3,-1.5 1,-0.2 7,-0.3 0.854 108.4 58.7 -66.7 -35.2 27.1 22.2 11.7 82 82 A M H 3< S+ 0 0 58 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.658 97.6 63.5 -69.7 -13.1 25.2 20.3 9.0 83 83 A S T << S+ 0 0 61 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.484 78.4 109.7 -90.7 -1.2 27.6 21.7 6.4 84 84 A T S < S- 0 0 20 -3,-1.5 3,-0.1 -4,-0.2 -37,-0.1 -0.231 89.8 -97.3 -68.2 165.0 30.7 20.0 7.8 85 85 A R S S+ 0 0 156 1,-0.3 -1,-0.1 2,-0.1 -3,-0.0 0.887 127.4 29.6 -48.0 -46.3 32.3 17.2 5.9 86 86 A L S S- 0 0 9 2,-0.1 -1,-0.3 -64,-0.0 -4,-0.1 0.624 99.4-137.3 -91.7 -15.5 30.5 14.6 8.0 87 87 A G + 0 0 8 -6,-0.2 -5,-0.1 1,-0.2 -2,-0.1 0.873 31.1 179.5 60.8 41.2 27.4 16.7 8.7 88 88 A I - 0 0 7 -7,-0.3 -1,-0.2 1,-0.1 -4,-0.1 -0.638 26.5-125.9 -78.2 120.3 27.1 15.8 12.4 89 89 A P - 0 0 0 0, 0.0 2,-0.2 0, 0.0 270,-0.1 -0.285 20.8-128.9 -62.9 147.9 24.1 17.6 14.0 90 90 A M - 0 0 0 272,-0.1 2,-0.5 268,-0.1 -38,-0.3 -0.610 13.4-131.2 -94.6 159.9 24.9 19.7 17.1 91 91 A I E -c 52 0A 0 -40,-1.4 -38,-1.4 -2,-0.2 2,-0.5 -0.967 16.6-148.5-115.0 125.4 22.9 19.2 20.3 92 92 A Y E -c 53 0A 0 -2,-0.5 50,-1.2 -40,-0.2 49,-0.9 -0.820 15.4-165.5 -97.6 125.7 21.6 22.4 21.9 93 93 A G E +cd 54 142A 0 -40,-2.5 -38,-1.8 -2,-0.5 2,-0.3 -0.752 12.7 165.0-111.5 157.6 21.2 22.5 25.7 94 94 A I E -cd 55 143A 0 48,-1.4 50,-2.3 -2,-0.3 2,-1.4 -0.983 44.5 -97.4-162.4 157.5 19.5 24.8 28.1 95 95 A D + 0 0 13 -40,-0.6 2,-1.0 -2,-0.3 7,-0.2 -0.650 43.4 162.1 -84.9 88.7 18.4 25.0 31.7 96 96 A A + 0 0 2 -2,-1.4 3,-0.2 1,-0.2 4,-0.2 -0.734 17.2 148.5-102.7 77.3 14.7 24.1 31.5 97 97 A V S S+ 0 0 15 -2,-1.0 15,-0.2 1,-0.2 -1,-0.2 0.600 80.0 8.9 -90.1 -13.8 14.6 23.3 35.3 98 98 A H S S- 0 0 5 1,-1.1 11,-2.0 -3,-0.2 2,-0.2 -0.196 138.9 -38.4-159.3 52.2 11.0 24.3 35.9 99 99 A G S S- 0 0 0 -3,-0.2 2,-3.2 9,-0.2 -1,-1.1 -0.479 100.1 -49.2 109.7 174.8 9.7 24.8 32.4 100 100 A Q S > S+ 0 0 0 7,-0.3 3,-1.6 1,-0.2 6,-0.2 -0.401 77.7 172.9 -76.8 64.6 11.5 26.4 29.4 101 101 A N T 3 + 0 0 0 -2,-3.2 331,-3.1 1,-0.3 -1,-0.2 0.589 62.7 58.7 -54.2 -22.6 12.3 29.1 32.0 102 102 A N T 3 S+ 0 0 4 -7,-0.2 2,-0.4 329,-0.2 -1,-0.3 0.764 92.5 87.9 -79.1 -24.2 14.7 31.2 29.9 103 103 A V S X S- 0 0 0 -3,-1.6 3,-1.8 4,-0.1 2,-0.1 -0.604 82.5-120.5 -84.4 130.0 12.0 31.8 27.3 104 104 A Y T 3 S+ 0 0 104 -2,-0.4 338,-0.1 -39,-0.3 3,-0.1 -0.409 99.5 19.1 -65.0 134.7 9.5 34.6 27.5 105 105 A G T 3 S+ 0 0 14 1,-0.3 -1,-0.3 -2,-0.1 2,-0.1 0.412 92.2 138.2 85.6 -3.2 5.9 33.3 27.6 106 106 A A < - 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