==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 05-NOV-07 2VFT . COMPND 2 MOLECULE: XYLITOL OXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES COELICOLOR; . AUTHOR F.FORNERIS,A.MATTEVI . 415 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16189.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 263 63.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 83 20.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 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 . 31 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 67 16.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.0 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 0 1 2 1 2 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 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 PARALLEL BRIDGES PER LADDER . 3 4 1 1 3 1 0 3 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 . 1 1 0 1 0 0 0 1 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 3 A D 0 0 166 0, 0.0 2,-0.3 0, 0.0 16,-0.2 0.000 360.0 360.0 360.0 131.5 4.1 20.1 11.5 2 4 A I - 0 0 88 14,-1.6 2,-0.5 2,-0.0 0, 0.0 -0.880 360.0-123.2-122.6 161.8 7.3 21.4 12.9 3 5 A T - 0 0 109 -2,-0.3 2,-0.5 9,-0.0 13,-0.1 -0.937 24.8-164.5-106.0 122.9 7.8 24.4 15.2 4 6 A V + 0 0 13 11,-0.6 9,-2.7 -2,-0.5 2,-0.3 -0.950 14.8 169.5-109.9 130.2 10.2 27.0 13.8 5 7 A T B -A 12 0A 61 -2,-0.5 7,-0.2 7,-0.2 5,-0.0 -0.813 36.0 -98.8-126.1 172.1 11.6 29.6 16.2 6 8 A N - 0 0 4 5,-2.0 38,-0.2 -2,-0.3 3,-0.2 -0.210 51.3 -90.9 -75.8 179.2 14.4 32.3 16.1 7 9 A W S S+ 0 0 32 36,-2.7 275,-0.5 38,-0.3 37,-0.2 0.928 127.4 44.6 -63.6 -46.6 17.7 31.5 17.8 8 10 A A S S- 0 0 7 35,-0.5 -1,-0.2 37,-0.4 276,-0.1 0.715 104.6-131.8 -72.5 -16.7 16.8 32.9 21.3 9 11 A G S S+ 0 0 35 2,-0.2 -2,-0.1 -3,-0.2 -1,-0.1 0.420 77.3 113.2 81.6 0.7 13.4 31.1 21.1 10 12 A N S S+ 0 0 46 274,-0.2 2,-0.5 1,-0.1 36,-0.1 0.654 71.1 60.3 -77.9 -14.4 11.3 34.1 22.1 11 13 A I - 0 0 18 34,-0.2 -5,-2.0 36,-0.1 2,-0.6 -0.971 65.8-169.1-115.3 118.7 9.8 34.3 18.6 12 14 A T B -A 5 0A 87 -2,-0.5 -7,-0.2 -7,-0.2 2,-0.1 -0.930 21.3-136.6-101.5 122.2 7.8 31.3 17.4 13 15 A Y - 0 0 4 -9,-2.7 -9,-0.4 -2,-0.6 38,-0.0 -0.364 10.6-128.9 -78.4 154.9 7.0 31.6 13.6 14 16 A T S S+ 0 0 47 -11,-0.1 41,-0.1 -2,-0.1 -1,-0.1 0.695 76.1 110.7 -70.2 -18.9 3.5 30.7 12.3 15 17 A A - 0 0 9 1,-0.1 -11,-0.6 -11,-0.1 -2,-0.1 -0.333 53.0-163.1 -65.8 134.2 5.1 28.5 9.6 16 18 A K S S+ 0 0 109 1,-0.1 -14,-1.6 -13,-0.1 2,-0.3 0.368 79.3 30.9 -96.5 0.4 4.5 24.8 10.0 17 19 A E - 0 0 124 -16,-0.2 2,-0.6 41,-0.0 41,-0.5 -0.972 69.4-140.0-152.3 147.5 7.4 24.0 7.6 18 20 A L - 0 0 26 -2,-0.3 2,-0.3 39,-0.1 41,-0.2 -0.953 28.2-139.6-107.9 110.4 10.7 25.7 6.7 19 21 A L B -b 59 0B 38 39,-2.2 41,-3.1 -2,-0.6 44,-0.1 -0.540 21.6-178.1 -79.0 133.4 11.1 25.3 2.9 20 22 A R - 0 0 121 -2,-0.3 41,-0.1 39,-0.2 -1,-0.1 -0.698 11.7-158.4-133.3 76.0 14.7 24.6 1.9 21 23 A P - 0 0 13 0, 0.0 42,-0.2 0, 0.0 3,-0.0 -0.265 8.1-149.8 -59.2 145.8 15.0 24.4 -2.0 22 24 A H S S+ 0 0 148 42,-0.1 2,-0.3 1,-0.1 3,-0.1 0.381 73.7 32.9-101.3 4.5 18.0 22.4 -3.2 23 25 A S S > S- 0 0 52 1,-0.1 4,-2.3 41,-0.1 5,-0.1 -0.986 77.4-116.7-151.7 158.3 18.6 24.3 -6.5 24 26 A L H > S+ 0 0 67 -2,-0.3 4,-3.0 2,-0.2 5,-0.2 0.867 117.2 58.0 -61.8 -39.3 18.2 27.8 -7.9 25 27 A D H > S+ 0 0 130 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.940 109.4 44.4 -54.2 -48.5 15.6 26.4 -10.4 26 28 A A H > S+ 0 0 38 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.873 112.8 52.1 -63.2 -39.4 13.5 25.2 -7.4 27 29 A L H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.940 109.8 47.9 -65.9 -47.3 14.1 28.5 -5.5 28 30 A R H X S+ 0 0 73 -4,-3.0 4,-2.7 1,-0.2 -1,-0.2 0.915 113.7 47.1 -57.4 -46.2 12.9 30.6 -8.5 29 31 A A H X S+ 0 0 44 -4,-2.1 4,-2.4 -5,-0.2 -1,-0.2 0.903 111.8 51.1 -62.9 -44.0 9.8 28.4 -9.0 30 32 A L H < S+ 0 0 40 -4,-2.5 4,-0.5 2,-0.2 -2,-0.2 0.936 113.0 45.0 -59.9 -47.4 9.0 28.5 -5.2 31 33 A V H >< S+ 0 0 0 -4,-2.8 3,-1.4 1,-0.2 -2,-0.2 0.954 114.6 47.7 -63.1 -46.3 9.2 32.3 -5.1 32 34 A A H 3< S+ 0 0 42 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.864 115.5 46.4 -63.6 -32.9 7.2 32.8 -8.3 33 35 A D T 3< S+ 0 0 136 -4,-2.4 2,-0.4 -5,-0.2 -1,-0.3 0.334 97.6 85.1 -92.0 3.8 4.5 30.3 -7.0 34 36 A S < - 0 0 13 -3,-1.4 3,-0.1 -4,-0.5 22,-0.1 -0.908 63.9-150.6-111.8 140.0 4.2 31.7 -3.5 35 37 A A S S+ 0 0 89 -2,-0.4 2,-0.3 1,-0.2 -1,-0.1 0.855 84.6 14.4 -77.7 -34.7 1.9 34.7 -2.6 36 38 A R S S- 0 0 123 19,-0.3 21,-2.9 369,-0.1 2,-0.3 -0.995 72.0-178.2-145.0 136.6 4.0 36.0 0.4 37 39 A V E +c 57 0B 1 367,-2.3 2,-0.3 -2,-0.3 21,-0.2 -0.988 12.3 177.6-137.7 138.6 7.6 35.1 1.3 38 40 A R E -c 58 0B 12 19,-2.3 21,-2.4 -2,-0.3 2,-0.4 -0.989 26.8-130.1-131.0 150.4 10.1 35.9 4.0 39 41 A V E -c 59 0B 50 -2,-0.3 2,-0.5 19,-0.2 21,-0.2 -0.767 9.3-148.6 -95.5 139.0 13.6 34.4 4.2 40 42 A L E +c 60 0B 16 19,-2.7 21,-0.5 -2,-0.4 72,-0.0 -0.941 20.3 173.4-102.6 123.8 15.0 32.9 7.4 41 43 A G S S- 0 0 35 -2,-0.5 -1,-0.1 19,-0.1 21,-0.1 0.419 70.5 -40.0 -89.9-121.6 18.8 33.3 7.8 42 44 A S S S- 0 0 17 67,-0.1 -35,-0.1 18,-0.0 -2,-0.0 0.331 76.5-118.6 -95.9 9.9 20.3 32.1 11.1 43 45 A G + 0 0 8 1,-0.1 -36,-2.7 -37,-0.1 -35,-0.5 0.651 65.1 142.3 67.6 17.0 17.4 33.5 13.3 44 46 A H + 0 0 43 -38,-0.2 2,-0.3 -37,-0.2 -1,-0.1 0.033 41.6 101.8 -84.7 29.9 19.6 36.0 15.2 45 47 A S - 0 0 15 2,-0.1 -37,-0.4 -34,-0.1 -38,-0.3 -0.749 61.5-152.3 -98.6 163.6 16.9 38.6 15.2 46 48 A F + 0 0 4 326,-2.8 2,-0.2 -2,-0.3 327,-0.1 0.195 69.9 48.7-122.3 13.3 14.7 39.1 18.3 47 49 A N S S- 0 0 19 325,-0.3 3,-0.5 324,-0.1 -2,-0.1 -0.571 102.5 -74.9-139.1-163.4 11.4 40.4 16.9 48 50 A E S > S+ 0 0 114 1,-0.2 3,-1.2 -2,-0.2 361,-0.4 0.137 83.4 119.1 -95.6 21.7 8.9 39.5 14.1 49 51 A I T 3 S+ 0 0 10 1,-0.3 -1,-0.2 322,-0.1 361,-0.2 0.874 81.7 40.8 -55.4 -37.0 11.1 40.7 11.2 50 52 A A T 3 S+ 0 0 9 -3,-0.5 -1,-0.3 -12,-0.1 -2,-0.1 0.530 87.2 114.7 -88.9 -2.4 11.3 37.1 9.6 51 53 A E < - 0 0 15 -3,-1.2 357,-0.3 1,-0.1 358,-0.3 -0.469 46.5-167.7 -72.0 121.6 7.6 36.3 10.3 52 54 A P - 0 0 7 0, 0.0 5,-0.2 0, 0.0 -1,-0.1 0.554 38.7-119.2 -91.1 -0.1 5.7 35.8 6.9 53 55 A G > - 0 0 29 3,-0.1 3,-2.3 2,-0.1 -17,-0.1 0.017 52.7 -37.1 84.5 159.5 2.2 35.8 8.5 54 56 A D T 3 S+ 0 0 150 1,-0.3 3,-0.1 -3,-0.1 -39,-0.1 -0.331 136.4 13.9 -57.7 137.2 -0.3 33.0 8.4 55 57 A G T 3 S+ 0 0 85 1,-0.3 -19,-0.3 -41,-0.1 -1,-0.3 0.287 100.1 128.5 76.3 -9.8 -0.2 31.3 4.9 56 58 A G < - 0 0 12 -3,-2.3 2,-0.5 -21,-0.1 -1,-0.3 -0.438 62.6-116.8 -74.3 149.8 3.1 33.0 4.2 57 59 A V E - c 0 37B 28 -21,-2.9 -19,-2.3 -5,-0.2 2,-0.6 -0.801 19.8-160.6 -88.0 123.8 6.1 31.0 3.0 58 60 A L E - c 0 38B 2 -2,-0.5 -39,-2.2 -41,-0.5 2,-0.4 -0.944 22.4-178.5-101.5 116.0 9.2 30.9 5.3 59 61 A L E -bc 19 39B 0 -21,-2.4 -19,-2.7 -2,-0.6 2,-0.3 -0.909 14.4-161.3-122.7 151.0 12.1 29.8 3.2 60 62 A S E - c 0 40B 12 -41,-3.1 3,-0.3 -2,-0.4 -19,-0.1 -0.896 22.2-144.4-123.5 154.5 15.8 29.2 3.9 61 63 A L S > S+ 0 0 15 -21,-0.5 3,-2.0 -2,-0.3 21,-0.2 0.302 74.6 105.9 -94.2 9.5 19.0 29.0 1.7 62 64 A A T 3 S+ 0 0 79 1,-0.3 -1,-0.2 -21,-0.1 4,-0.1 0.708 75.2 57.8 -63.0 -22.8 20.4 26.2 4.0 63 65 A G T 3 S+ 0 0 22 -3,-0.3 -1,-0.3 -42,-0.2 -2,-0.1 0.494 93.9 80.9 -84.1 -6.4 19.6 23.6 1.2 64 66 A L S < S- 0 0 34 -3,-2.0 -41,-0.1 1,-0.1 -42,-0.1 -0.679 97.8 -84.9 -95.4 152.6 21.8 25.4 -1.5 65 67 A P - 0 0 104 0, 0.0 2,-1.6 0, 0.0 17,-0.2 -0.302 36.8-126.9 -57.0 137.2 25.6 25.1 -1.8 66 68 A S - 0 0 53 -4,-0.1 2,-0.2 16,-0.1 18,-0.1 -0.580 36.3-164.1 -89.2 81.7 27.5 27.6 0.5 67 69 A V + 0 0 59 -2,-1.6 13,-2.3 16,-0.0 2,-0.4 -0.393 21.3 174.3 -72.9 130.8 29.7 29.2 -2.1 68 70 A V E +D 79 0C 29 11,-0.2 2,-0.6 -2,-0.2 11,-0.2 -0.883 8.7 174.7-138.5 104.3 32.7 31.2 -1.2 69 71 A D E -D 78 0C 97 9,-2.6 9,-2.3 -2,-0.4 2,-0.4 -0.904 12.2-161.0-124.9 101.5 34.7 32.3 -4.3 70 72 A V E -D 77 0C 3 -2,-0.6 2,-0.7 7,-0.2 7,-0.2 -0.663 9.1-160.5 -86.7 129.7 37.7 34.6 -3.9 71 73 A D E >> -D 76 0C 80 5,-3.0 5,-1.9 -2,-0.4 4,-1.2 -0.929 10.0-170.8-104.5 100.2 39.1 36.6 -6.8 72 74 A T T 45S+ 0 0 71 -2,-0.7 3,-0.3 2,-0.2 -1,-0.2 0.902 81.3 50.9 -63.1 -42.3 42.6 37.5 -5.5 73 75 A A T 45S+ 0 0 95 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.891 119.1 37.5 -59.6 -42.2 43.5 39.9 -8.3 74 76 A A T 45S- 0 0 51 2,-0.1 -1,-0.2 99,-0.0 -2,-0.2 0.594 104.1-133.2 -82.5 -14.0 40.3 41.8 -7.8 75 77 A R T <5 + 0 0 126 -4,-1.2 99,-2.4 -3,-0.3 2,-0.3 0.942 63.6 124.3 50.5 55.2 40.4 41.4 -4.0 76 78 A T E < -DE 71 173C 18 -5,-1.9 -5,-3.0 97,-0.2 2,-0.4 -0.933 48.0-153.7-134.9 160.6 36.7 40.4 -4.0 77 79 A V E -DE 70 172C 0 95,-2.1 95,-2.8 -2,-0.3 2,-0.5 -0.993 6.7-151.4-137.5 129.8 34.7 37.4 -2.7 78 80 A R E -DE 69 171C 94 -9,-2.3 -9,-2.6 -2,-0.4 2,-0.4 -0.881 27.2-178.7 -95.6 126.7 31.4 36.2 -4.1 79 81 A V E -DE 68 170C 0 91,-3.0 91,-2.2 -2,-0.5 -11,-0.2 -0.981 29.8-111.6-135.6 139.0 29.4 34.4 -1.3 80 82 A G E > - E 0 169C 7 -13,-2.3 3,-1.3 -2,-0.4 30,-0.3 -0.336 31.8-120.0 -60.5 145.4 26.0 32.7 -1.0 81 83 A G T 3 S+ 0 0 2 87,-1.8 30,-1.8 1,-0.3 31,-0.6 0.800 112.3 51.5 -60.4 -29.0 23.4 34.5 1.1 82 84 A G T 3 S+ 0 0 35 86,-0.3 -1,-0.3 -21,-0.2 -16,-0.1 0.516 82.4 110.8 -87.2 -8.0 23.1 31.6 3.6 83 85 A V < - 0 0 2 -3,-1.3 27,-2.8 -16,-0.1 28,-0.3 -0.445 64.9-134.6 -60.1 139.7 26.9 31.4 4.2 84 86 A R B > -H 109 0D 110 25,-0.3 4,-2.2 26,-0.1 3,-0.4 -0.684 17.8-112.0 -97.4 160.1 27.8 32.5 7.8 85 87 A Y H > S+ 0 0 8 23,-2.0 4,-2.9 21,-0.3 5,-0.2 0.808 111.1 63.7 -60.7 -34.1 30.7 34.8 8.6 86 88 A A H > S+ 0 0 19 20,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.962 110.7 37.5 -58.1 -47.7 32.8 32.0 10.4 87 89 A E H > S+ 0 0 66 -3,-0.4 4,-2.3 2,-0.2 5,-0.2 0.920 116.2 53.6 -66.1 -49.6 33.2 30.0 7.2 88 90 A L H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.934 110.6 46.5 -48.2 -49.2 33.5 33.2 5.0 89 91 A A H X S+ 0 0 2 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.906 110.3 51.6 -67.0 -43.2 36.4 34.5 7.2 90 92 A R H X S+ 0 0 153 -4,-1.9 4,-1.8 -5,-0.2 -1,-0.2 0.889 113.4 46.9 -56.3 -45.4 38.3 31.1 7.3 91 93 A V H X S+ 0 0 48 -4,-2.3 4,-0.9 2,-0.2 -2,-0.2 0.938 113.8 43.9 -68.8 -45.1 38.2 30.9 3.5 92 94 A V H <>S+ 0 0 0 -4,-2.5 5,-2.5 1,-0.2 3,-0.5 0.868 112.3 54.2 -72.8 -32.9 39.3 34.4 2.7 93 95 A H H ><5S+ 0 0 66 -4,-2.5 3,-1.8 -5,-0.2 -1,-0.2 0.891 103.2 55.8 -63.7 -39.2 42.0 34.3 5.3 94 96 A A H 3<5S+ 0 0 88 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.765 106.3 52.5 -65.3 -22.2 43.4 31.1 3.7 95 97 A R T 3<5S- 0 0 121 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.212 125.2-103.3 -92.9 5.0 43.7 33.1 0.4 96 98 A G T < 5S+ 0 0 41 -3,-1.8 81,-2.3 1,-0.3 -3,-0.2 0.674 86.1 106.4 84.5 16.6 45.6 35.9 2.2 97 99 A L E < -I 176 0E 10 -5,-2.5 2,-0.3 79,-0.3 -1,-0.3 -0.663 44.0-168.2-127.1 175.3 42.7 38.4 2.4 98 100 A A E -I 175 0E 0 77,-1.7 77,-2.4 -2,-0.2 -9,-0.0 -0.991 23.4-112.7-160.6 158.2 40.4 39.8 5.1 99 101 A L - 0 0 2 -2,-0.3 75,-0.1 75,-0.2 3,-0.1 -0.704 28.3-127.1 -92.9 155.3 37.3 41.8 5.9 100 102 A P S S+ 0 0 29 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.633 85.9 6.4 -75.8 -21.6 37.6 45.2 7.7 101 103 A N - 0 0 9 27,-0.1 2,-0.3 19,-0.1 21,-0.0 -0.994 55.5-163.8-154.4 167.9 35.2 44.2 10.5 102 104 A M - 0 0 5 -2,-0.3 19,-0.3 19,-0.1 17,-0.0 -0.961 28.8-109.7-143.1 159.0 33.1 41.4 12.1 103 105 A A - 0 0 13 -2,-0.3 17,-0.1 2,-0.2 169,-0.1 -0.140 46.7 -91.3 -78.6-176.1 30.1 41.3 14.5 104 106 A S S S+ 0 0 36 15,-0.3 168,-1.6 167,-0.2 169,-1.6 0.787 114.9 35.1 -71.4 -28.6 30.6 39.9 18.1 105 107 A L - 0 0 17 166,-0.2 -2,-0.2 167,-0.2 -1,-0.2 -0.998 69.6-154.4-131.7 123.6 29.6 36.3 17.2 106 108 A P S S+ 0 0 8 0, 0.0 -20,-1.9 0, 0.0 2,-1.3 0.554 73.7 89.4 -79.3 -9.5 30.6 34.8 13.7 107 109 A H + 0 0 38 -22,-0.2 2,-0.4 -23,-0.1 -23,-0.0 -0.242 65.9 105.7 -89.1 53.5 27.9 32.1 13.4 108 110 A I S S- 0 0 29 -2,-1.3 -23,-2.0 -3,-0.1 -22,-0.1 -0.968 77.0 -99.8-134.3 141.3 25.4 34.5 11.7 109 111 A S B > -H 84 0D 3 -2,-0.4 4,-2.1 -25,-0.2 -25,-0.3 -0.268 21.1-137.4 -62.9 142.6 24.4 34.6 7.9 110 112 A V H > S+ 0 0 0 -27,-2.8 4,-2.3 -30,-0.3 5,-0.3 0.954 104.0 45.9 -64.9 -49.4 26.0 37.2 5.7 111 113 A A H > S+ 0 0 20 -30,-1.8 4,-1.6 -28,-0.3 -1,-0.2 0.922 115.2 47.0 -63.3 -40.6 22.7 38.2 4.0 112 114 A G H > S+ 0 0 33 -31,-0.6 4,-0.6 1,-0.2 -1,-0.2 0.873 110.6 53.5 -65.7 -36.1 20.8 38.3 7.2 113 115 A S H >X>S+ 0 0 1 -4,-2.1 5,-1.8 1,-0.2 3,-1.0 0.957 112.2 41.8 -65.1 -49.5 23.5 40.4 8.9 114 116 A V H 3<5S+ 0 0 4 -4,-2.3 3,-0.4 1,-0.2 -1,-0.2 0.781 102.4 71.8 -70.3 -23.1 23.6 43.1 6.2 115 117 A A H 3<5S+ 0 0 19 -4,-1.6 46,-1.9 -5,-0.3 -1,-0.2 0.737 107.6 32.3 -60.9 -25.9 19.8 43.1 6.0 116 118 A T H <<5S- 0 0 15 -3,-1.0 255,-0.9 -4,-0.6 256,-0.3 0.467 119.5 -93.0-117.3 -5.6 19.3 44.8 9.4 117 119 A G T <5 - 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0 0 9 -2,-0.6 4,-2.9 -358,-0.1 5,-0.2 -0.449 51.1 -81.2-106.4-173.4 5.3 41.4 6.0 408 410 A A H > S+ 0 0 75 -357,-0.3 4,-2.2 1,-0.2 5,-0.2 0.901 129.6 52.7 -61.2 -36.7 3.6 43.1 9.0 409 411 A F H > S+ 0 0 34 -361,-0.4 4,-1.6 -358,-0.3 -1,-0.2 0.951 114.7 39.2 -62.6 -50.8 6.9 44.3 10.3 410 412 A V H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.892 113.8 55.5 -67.2 -38.0 8.0 45.9 7.0 411 413 A R H X S+ 0 0 110 -4,-2.9 4,-1.9 1,-0.2 -1,-0.2 0.889 105.4 52.4 -62.4 -39.4 4.5 47.3 6.3 412 414 A G H < S+ 0 0 33 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.926 110.2 48.5 -63.5 -46.7 4.4 49.1 9.6 413 415 A V H < S+ 0 0 9 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.943 117.6 39.7 -56.3 -50.6 7.7 50.8 8.9 414 416 A L H < 0 0 49 -4,-2.5 -1,-0.2 1,-0.1 -2,-0.2 0.703 360.0 360.0 -76.6 -20.9 6.7 51.9 5.4 415 417 A A < 0 0 87 -4,-1.9 -3,-0.1 -5,-0.2 -2,-0.1 0.990 360.0 360.0 -66.6 360.0 3.1 52.9 6.2