==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 28-JUL-05 2BXZ . COMPND 2 MOLECULE: MALTOOLIGOSYLTREHALOSE TREHALOHYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: DEINOCOCCUS RADIODURANS; . AUTHOR H.-K.S.LEIROS,J.TIMMINS,R.B.G.RAVELLI,S.M.MCSWEENEY . 580 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22443.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 378 65.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 35 6.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 79 13.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 6 1.0 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 . 41 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 79 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 116 20.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.2 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 3 2 1 1 0 0 1 2 0 2 1 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 3 4 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 . 0 3 5 2 2 2 0 1 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 0 1 2 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 14 A S 0 0 164 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 3.3 56.2 24.0 -9.4 2 15 A F - 0 0 75 279,-0.0 2,-0.5 1,-0.0 0, 0.0 -0.565 360.0-159.7 -59.4 126.6 54.0 23.2 -6.3 3 16 A Q - 0 0 167 -2,-0.3 279,-0.1 2,-0.0 278,-0.0 -0.965 18.9-116.2-112.0 128.2 53.0 26.6 -4.9 4 17 A T - 0 0 31 -2,-0.5 278,-0.0 1,-0.1 279,-0.0 -0.237 11.5-140.2 -53.8 147.8 51.8 26.8 -1.3 5 18 A Q S S+ 0 0 87 236,-0.0 2,-0.4 2,-0.0 -1,-0.1 0.425 76.9 94.2 -86.3 1.9 48.2 27.9 -0.9 6 19 A H + 0 0 48 276,-0.1 -2,-0.1 238,-0.0 3,-0.1 -0.818 45.1 172.6-106.1 135.1 49.3 30.0 2.1 7 20 A D > - 0 0 81 -2,-0.4 3,-1.7 1,-0.1 4,-0.3 -0.996 32.2-139.8-139.0 123.3 50.2 33.7 2.0 8 21 A P G > S+ 0 0 76 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 0.819 103.8 65.0 -55.3 -30.1 50.8 35.6 5.2 9 22 A R G 3 S+ 0 0 106 1,-0.2 6,-0.1 -3,-0.1 -3,-0.0 0.808 112.8 31.2 -58.4 -35.8 48.8 38.5 3.6 10 23 A T G < S+ 0 0 56 -3,-1.7 -1,-0.2 2,-0.0 2,-0.1 0.142 85.2 142.5-113.4 19.1 45.6 36.4 3.5 11 24 A R < - 0 0 57 -3,-1.0 2,-0.1 -4,-0.3 4,-0.1 -0.376 50.9-123.6 -66.7 132.7 46.1 34.3 6.6 12 25 A L S S+ 0 0 22 -2,-0.1 2,-0.3 13,-0.1 15,-0.2 -0.491 76.9 31.8 -74.2 149.9 42.9 33.7 8.6 13 26 A G E S-A 26 0A 0 13,-3.0 13,-2.5 -2,-0.1 2,-0.5 -0.815 112.4 -34.1 104.4-149.6 42.9 34.7 12.3 14 27 A A E +A 25 0A 6 -2,-0.3 80,-0.4 65,-0.3 11,-0.2 -0.965 60.1 179.5-117.0 119.3 44.8 37.6 13.7 15 28 A T E -A 24 0A 17 9,-2.8 9,-2.9 -2,-0.5 80,-0.1 -0.985 30.6-116.7-126.5 125.4 48.2 38.4 12.2 16 29 A P E -A 23 0A 34 0, 0.0 7,-0.3 0, 0.0 45,-0.1 -0.311 33.0-131.6 -56.3 134.8 50.6 41.3 13.2 17 30 A L E > > -A 22 0A 20 5,-3.2 3,-0.6 1,-0.1 5,-0.5 -0.622 22.6-103.4 -84.7 154.8 51.1 43.9 10.4 18 31 A P G > 5S+ 0 0 109 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 -0.211 100.4 34.4 -69.4 161.8 54.5 45.1 9.3 19 32 A G G 3 5S- 0 0 89 1,-0.3 -2,-0.0 2,-0.1 0, 0.0 0.703 127.1 -76.1 68.0 21.1 55.8 48.6 10.3 20 33 A G G < 5S+ 0 0 78 -3,-0.6 -1,-0.3 2,-0.1 3,-0.1 0.735 91.4 142.6 62.5 28.7 54.0 48.4 13.8 21 34 A A T < 5 - 0 0 54 -3,-1.5 2,-0.5 1,-0.2 -2,-0.1 0.613 59.7-118.9 -78.5 -13.9 50.8 49.1 11.9 22 35 A G E < -A 17 0A 7 -5,-0.5 -5,-3.2 37,-0.2 2,-0.4 -0.941 48.1 -29.1 121.9-132.6 48.9 46.7 14.2 23 36 A T E -AB 16 58A 0 35,-3.1 35,-2.2 -2,-0.5 2,-0.5 -0.991 37.9-143.7-133.8 140.2 47.0 43.5 13.4 24 37 A R E -AB 15 57A 32 -9,-2.9 -9,-2.8 -2,-0.4 2,-0.5 -0.915 18.9-159.8-100.4 124.2 45.0 42.2 10.4 25 38 A F E +AB 14 56A 0 31,-3.2 31,-2.0 -2,-0.5 2,-0.3 -0.895 16.2 172.3-102.1 131.7 42.0 40.2 11.4 26 39 A R E +AB 13 55A 24 -13,-2.5 -13,-3.0 -2,-0.5 2,-0.3 -0.993 5.1 165.8-139.3 147.4 40.5 37.8 8.8 27 40 A L E - B 0 54A 4 27,-2.0 27,-2.4 -2,-0.3 2,-0.4 -0.966 26.5-134.1-150.7 164.3 37.8 35.1 8.8 28 41 A W E + B 0 53A 20 -2,-0.3 2,-0.4 25,-0.2 25,-0.2 -0.989 26.9 171.1-119.9 128.3 35.8 33.0 6.4 29 42 A T - 0 0 4 23,-2.5 187,-0.2 -2,-0.4 186,-0.1 -0.986 22.5-173.0-139.0 136.7 32.1 32.6 6.9 30 43 A S S S+ 0 0 63 185,-1.6 186,-0.2 -2,-0.4 -1,-0.1 0.591 88.6 26.4 -94.4 -13.0 29.5 31.0 4.7 31 44 A T S S+ 0 0 79 184,-1.0 185,-0.1 183,-0.1 184,-0.1 0.621 82.8 110.0-128.7 -21.3 26.4 32.0 6.7 32 45 A A - 0 0 13 183,-0.4 3,-0.1 1,-0.1 -3,-0.1 -0.371 38.4-169.7 -66.4 141.2 26.8 35.1 8.9 33 46 A R S S+ 0 0 227 1,-0.3 2,-0.4 -2,-0.1 -1,-0.1 0.719 79.7 36.7 -98.9 -31.0 24.9 38.2 7.8 34 47 A T S S- 0 0 80 2,-0.0 37,-2.9 11,-0.0 2,-0.4 -0.984 71.5-174.3-123.1 139.6 26.7 40.6 10.3 35 48 A V E +D 70 0B 9 -2,-0.4 11,-2.5 11,-0.2 2,-0.3 -0.989 11.4 156.0-140.4 125.5 30.4 40.2 11.1 36 49 A A E -DE 69 45B 2 33,-2.0 33,-3.2 -2,-0.4 2,-0.4 -0.933 32.4-131.8-141.5 159.5 32.5 42.1 13.6 37 50 A V E -DE 68 44B 0 7,-2.7 7,-1.9 -2,-0.3 2,-0.7 -0.981 14.1-151.1-111.2 133.5 35.6 41.8 15.7 38 51 A R E -DE 67 43B 70 29,-2.6 29,-1.5 -2,-0.4 2,-0.5 -0.914 19.4-176.5-102.8 109.0 35.6 42.5 19.4 39 52 A V E > -DE 66 42B 4 3,-2.7 3,-2.1 -2,-0.7 27,-0.2 -0.939 68.8 -18.8-112.1 122.7 39.0 43.7 20.4 40 53 A N T 3 S- 0 0 97 25,-3.4 -1,-0.2 -2,-0.5 26,-0.1 0.878 132.1 -48.9 51.4 38.3 39.8 44.5 24.0 41 54 A G T 3 S+ 0 0 53 24,-0.3 2,-0.5 1,-0.2 -1,-0.3 0.291 117.0 109.9 89.3 -8.7 36.0 44.8 24.6 42 55 A T E < -E 39 0B 80 -3,-2.1 -3,-2.7 2,-0.0 2,-0.2 -0.896 59.8-137.3-108.1 130.0 35.2 47.1 21.6 43 56 A E E -E 38 0B 116 -2,-0.5 2,-0.4 -5,-0.3 -5,-0.2 -0.531 19.4-177.2 -84.2 141.8 33.3 45.9 18.5 44 57 A H E -E 37 0B 61 -7,-1.9 -7,-2.7 -2,-0.2 2,-0.1 -0.967 27.9-121.9-138.2 125.9 34.4 46.9 15.0 45 58 A V E -E 36 0B 111 -2,-0.4 -9,-0.3 -9,-0.2 2,-0.2 -0.372 31.4-132.9 -62.8 135.4 32.4 45.9 11.9 46 59 A X - 0 0 10 -11,-2.5 2,-0.4 -2,-0.1 -11,-0.2 -0.610 17.2-106.9 -94.4 156.7 34.6 44.0 9.4 47 60 A T E -C 55 0A 73 8,-3.2 8,-2.1 -2,-0.2 2,-0.5 -0.677 25.2-133.4 -83.7 130.5 34.9 44.5 5.7 48 61 A S E +C 54 0A 75 -2,-0.4 6,-0.2 6,-0.2 3,-0.1 -0.724 25.4 176.0 -81.9 122.4 33.3 42.0 3.3 49 62 A L E - 0 0 88 4,-3.0 5,-0.1 -2,-0.5 -1,-0.1 0.518 47.9-100.5-102.6 -9.9 35.7 41.0 0.5 50 63 A G E > S+C 53 0A 40 3,-0.8 3,-1.5 0, 0.0 -1,-0.3 -0.123 100.2 65.8 98.7 158.7 33.6 38.4 -1.3 51 64 A G T 3 S- 0 0 68 1,-0.2 3,-0.1 -2,-0.1 -22,-0.0 0.713 129.8 -68.7 61.6 23.3 33.7 34.6 -1.0 52 65 A G T 3 S+ 0 0 21 1,-0.3 -23,-2.5 -24,-0.1 2,-0.4 0.552 98.2 143.3 72.2 9.4 32.6 35.0 2.6 53 66 A I E < -BC 28 50A 25 -3,-1.5 -4,-3.0 -25,-0.2 -3,-0.8 -0.693 28.4-172.9 -83.2 135.8 36.0 36.5 3.4 54 67 A Y E +BC 27 48A 36 -27,-2.4 -27,-2.0 -2,-0.4 2,-0.3 -0.978 6.2 176.6-128.3 140.5 35.9 39.4 6.1 55 68 A E E +BC 26 47A 22 -8,-2.1 -8,-3.2 -2,-0.4 2,-0.3 -0.982 12.3 171.4-144.2 151.9 38.9 41.5 7.0 56 69 A L E -B 25 0A 30 -31,-2.0 -31,-3.2 -2,-0.3 2,-0.4 -0.909 17.0-151.3-158.9 136.8 39.8 44.5 9.2 57 70 A E E +B 24 0A 90 -2,-0.3 -33,-0.2 -33,-0.2 -35,-0.1 -0.926 21.0 173.7-107.2 135.2 43.1 46.1 10.2 58 71 A L E -B 23 0A 24 -35,-2.2 -35,-3.1 -2,-0.4 2,-0.6 -0.982 42.5-113.7-137.9 149.0 43.4 47.9 13.6 59 72 A P S S+ 0 0 121 0, 0.0 2,-0.3 0, 0.0 -37,-0.2 0.055 75.4 121.3 -74.2 28.6 46.4 49.4 15.3 60 73 A V - 0 0 33 -2,-0.6 -2,-0.2 -37,-0.2 3,-0.1 -0.727 47.0-156.8 -87.4 148.1 46.3 46.8 18.2 61 74 A G > - 0 0 29 -2,-0.3 3,-2.3 1,-0.2 32,-0.3 -0.409 36.7 -42.6-112.3-171.5 49.4 44.7 18.7 62 75 A P T 3 S+ 0 0 73 0, 0.0 -1,-0.2 0, 0.0 32,-0.2 -0.266 123.4 37.8 -52.2 136.9 50.6 41.4 20.1 63 76 A G T 3 S+ 0 0 35 30,-2.3 31,-0.1 1,-0.4 -3,-0.0 0.050 81.8 132.5 99.5 -21.6 48.8 40.8 23.5 64 77 A A < - 0 0 8 -3,-2.3 29,-2.8 28,-0.1 -1,-0.4 -0.343 52.1-133.8 -59.0 146.7 45.5 42.3 22.3 65 78 A R E + F 0 92B 49 27,-0.2 -25,-3.4 -3,-0.1 2,-0.3 -0.874 35.9 154.2-108.3 137.0 42.4 40.1 23.2 66 79 A Y E +DF 39 91B 2 25,-2.2 25,-3.3 -2,-0.4 11,-0.3 -0.990 24.3 179.4-155.9 159.0 39.7 39.4 20.7 67 80 A L E -D 38 0B 9 -29,-1.5 -29,-2.6 -2,-0.3 2,-0.3 -0.923 35.0-104.4-150.9 175.5 37.0 37.2 19.4 68 81 A F E -DG 37 75B 0 7,-2.6 7,-3.5 -2,-0.3 2,-0.5 -0.729 18.4-143.2-104.6 158.4 34.6 37.5 16.5 69 82 A V E -DG 36 74B 7 -33,-3.2 -33,-2.0 -2,-0.3 2,-0.6 -0.953 16.1-172.4-124.8 113.0 30.9 38.4 16.5 70 83 A L E > S-DG 35 73B 10 3,-2.3 3,-2.2 -2,-0.5 -35,-0.2 -0.914 76.7 -20.7-112.9 117.8 28.8 36.5 14.0 71 84 A D T 3 S- 0 0 76 -37,-2.9 -1,-0.2 -2,-0.6 -36,-0.1 0.893 130.9 -50.4 47.6 41.1 25.2 37.7 13.8 72 85 A G T 3 S+ 0 0 55 -3,-0.2 -1,-0.3 -38,-0.2 -37,-0.1 0.389 112.6 121.9 81.8 -1.0 25.7 39.3 17.2 73 86 A V E < -G 70 0B 86 -3,-2.2 -3,-2.3 2,-0.0 2,-0.2 -0.832 63.6-130.8 -99.7 116.4 27.1 36.1 18.8 74 87 A P E -G 69 0B 67 0, 0.0 -5,-0.2 0, 0.0 -37,-0.0 -0.476 35.7-179.2 -64.3 127.4 30.6 36.4 20.4 75 88 A T E -G 68 0B 4 -7,-3.5 -7,-2.6 -2,-0.2 13,-0.1 -0.999 27.3-115.9-137.1 124.6 32.5 33.4 18.9 76 89 A P - 0 0 8 0, 0.0 -9,-0.1 0, 0.0 14,-0.1 -0.234 37.2-104.2 -58.3 153.9 36.1 32.3 19.6 77 90 A D > - 0 0 3 -11,-0.3 3,-2.3 1,-0.1 135,-0.1 -0.723 19.7-154.5 -81.7 115.2 38.5 32.4 16.7 78 91 A P T 3 S+ 0 0 8 0, 0.0 92,-0.5 0, 0.0 91,-0.2 0.757 99.0 53.8 -60.6 -23.3 39.2 28.9 15.4 79 92 A Y T 3 S+ 0 0 16 90,-0.1 -65,-0.3 89,-0.1 89,-0.1 0.213 80.1 146.3 -91.5 12.6 42.5 30.2 14.1 80 93 A A < - 0 0 0 -3,-2.3 90,-0.2 1,-0.1 3,-0.1 -0.212 40.8-155.7 -51.8 135.3 43.5 31.6 17.6 81 94 A R S S+ 0 0 15 11,-0.5 2,-0.3 1,-0.3 -1,-0.1 0.590 79.9 9.9 -90.0 -14.6 47.2 31.4 18.2 82 95 A F - 0 0 5 10,-0.3 10,-2.1 89,-0.2 -1,-0.3 -0.924 55.0-164.5-163.9 145.6 46.7 31.4 22.0 83 96 A L > + 0 0 5 89,-0.5 3,-2.2 -2,-0.3 91,-0.3 -0.729 10.8 176.2-132.7 76.9 43.7 31.0 24.3 84 97 A P T 3 S+ 0 0 36 0, 0.0 -1,-0.1 0, 0.0 7,-0.1 0.782 84.5 42.9 -62.4 -26.1 44.8 32.2 27.8 85 98 A D T 3 S- 0 0 112 5,-0.6 3,-0.3 1,-0.4 6,-0.1 0.103 121.5-103.8-103.2 19.9 41.2 31.7 29.2 86 99 A G X - 0 0 26 -3,-2.2 3,-1.8 1,-0.2 -1,-0.4 -0.233 56.0 -41.4 82.0-172.8 40.6 28.4 27.5 87 100 A V T 3 S+ 0 0 2 1,-0.3 -1,-0.2 69,-0.2 70,-0.1 0.543 132.8 49.8 -74.8 -11.4 38.7 27.3 24.5 88 101 A H T 3 S+ 0 0 94 -3,-0.3 -1,-0.3 -5,-0.1 -2,-0.1 0.393 103.2 81.1-102.0 6.2 35.5 29.4 25.2 89 102 A G S < S- 0 0 14 -3,-1.8 2,-0.1 1,-0.2 -3,-0.1 -0.264 88.6 -65.7-107.6-175.5 37.5 32.6 25.7 90 103 A E - 0 0 41 -14,-0.1 -5,-0.6 -2,-0.1 -23,-0.2 -0.397 47.7-125.9 -70.0 145.3 39.1 35.5 23.9 91 104 A A E -F 66 0B 0 -25,-3.3 -25,-2.2 -8,-0.2 2,-0.4 -0.499 17.3-131.5 -82.0 159.4 42.1 34.8 21.8 92 105 A E E -F 65 0B 23 -10,-2.1 -11,-0.5 -27,-0.2 2,-0.4 -0.933 21.6-115.8-107.3 135.6 45.4 36.7 22.3 93 106 A V - 0 0 1 -29,-2.8 -30,-2.3 -2,-0.4 2,-0.4 -0.612 36.2-161.0 -65.5 127.0 47.3 38.2 19.3 94 107 A V - 0 0 15 -2,-0.4 2,-0.6 -80,-0.4 -12,-0.0 -0.927 14.0-158.0-117.1 135.2 50.7 36.5 18.9 95 108 A D > - 0 0 56 -2,-0.4 3,-1.2 1,-0.1 4,-0.3 -0.928 1.9-169.0-111.5 112.2 53.7 37.7 17.0 96 109 A F G > S+ 0 0 27 -2,-0.6 3,-0.5 1,-0.2 -1,-0.1 0.677 80.4 72.0 -74.6 -14.5 56.1 34.8 16.0 97 110 A G G 3 S+ 0 0 68 1,-0.2 -1,-0.2 3,-0.0 -2,-0.0 0.559 84.5 67.3 -72.9 -10.3 58.8 37.3 15.1 98 111 A T G < S+ 0 0 98 -3,-1.2 2,-0.2 2,-0.1 -1,-0.2 0.684 71.9 99.5 -93.4 -19.3 59.6 38.3 18.7 99 112 A F S < S- 0 0 42 -3,-0.5 2,-1.4 -4,-0.3 81,-0.0 -0.493 71.3-132.7 -71.1 135.3 61.2 35.1 20.0 100 113 A D - 0 0 139 -2,-0.2 2,-0.1 2,-0.0 -1,-0.1 -0.670 25.9-163.8 -91.8 85.2 64.9 35.1 20.1 101 114 A W - 0 0 59 -2,-1.4 3,-0.1 1,-0.1 83,-0.1 -0.441 15.4-174.7 -67.0 140.9 65.8 31.6 18.6 102 115 A T + 0 0 64 -2,-0.1 3,-0.4 1,-0.1 -1,-0.1 0.179 60.0 95.3-115.2 18.1 69.4 30.4 19.2 103 116 A D > + 0 0 15 1,-0.2 3,-1.8 2,-0.1 -1,-0.1 -0.036 34.7 125.0-106.0 31.1 69.1 27.2 17.0 104 117 A A T 3 S+ 0 0 85 1,-0.3 -1,-0.2 -3,-0.1 -2,-0.0 0.846 76.2 53.6 -59.4 -30.6 70.6 28.5 13.7 105 118 A D T 3 S+ 0 0 152 -3,-0.4 2,-0.5 2,-0.0 -1,-0.3 0.424 88.7 95.6 -87.5 2.2 73.2 25.6 13.8 106 119 A W < + 0 0 49 -3,-1.8 3,-0.1 1,-0.1 85,-0.1 -0.808 47.4 177.9 -87.6 131.2 70.4 23.0 14.2 107 120 A H - 0 0 141 -2,-0.5 -1,-0.1 1,-0.5 -3,-0.1 -0.055 44.6-101.0-126.9 36.1 69.4 21.4 10.9 108 121 A G - 0 0 18 86,-0.1 -1,-0.5 180,-0.0 2,-0.4 -0.188 39.2 -86.7 79.0-172.0 66.8 18.8 11.9 109 122 A I - 0 0 22 180,-0.3 2,-0.2 148,-0.2 5,-0.1 -0.999 27.3-124.1-142.7 136.9 67.2 15.1 12.2 110 123 A K > - 0 0 148 -2,-0.4 3,-1.8 1,-0.1 4,-0.4 -0.553 25.8-121.4 -77.4 148.4 66.8 12.2 9.7 111 124 A L G > S+ 0 0 16 1,-0.3 3,-2.1 -2,-0.2 -1,-0.1 0.893 112.6 60.5 -52.9 -46.9 64.4 9.4 10.5 112 125 A A G 3 S+ 0 0 27 1,-0.3 -1,-0.3 310,-0.1 266,-0.0 0.650 106.4 49.3 -57.4 -15.8 67.1 6.8 10.5 113 126 A D G < S+ 0 0 94 -3,-1.8 2,-0.3 309,-0.1 -1,-0.3 0.401 90.3 110.7-102.9 1.1 68.8 8.7 13.3 114 127 A C < + 0 0 1 -3,-2.1 2,-0.4 -4,-0.4 31,-0.0 -0.583 35.8 174.7 -85.7 134.7 65.7 9.0 15.5 115 128 A V - 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