==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 05-APR-12 4EIV . COMPND 2 MOLECULE: DEOXYRIBOSE-PHOSPHATE ALDOLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: TOXOPLASMA GONDII; . AUTHOR A.S.HALAVATY,J.RUAN,G.MINASOV,L.SHUVALOVA,A.UENO,M.IGARASHI, . 512 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21021.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 397 77.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 75 14.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 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 . 30 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 214 41.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 2.1 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 1 2 0 0 0 0 1 4 4 1 3 0 1 0 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 7 7 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 0 A T > 0 0 93 0, 0.0 4,-2.5 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 165.1 -35.0 -16.7 14.7 2 6 A I H > + 0 0 26 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.844 360.0 55.8 -62.0 -32.5 -31.5 -18.3 14.7 3 7 A Y H > S+ 0 0 17 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.906 109.1 43.5 -67.4 -44.0 -31.1 -17.1 11.1 4 8 A K H > S+ 0 0 87 2,-0.2 4,-2.9 -3,-0.2 -2,-0.2 0.897 113.6 53.2 -67.0 -41.3 -31.8 -13.5 11.9 5 9 A Q H X S+ 0 0 23 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.913 110.9 45.8 -60.7 -41.3 -29.5 -13.8 15.0 6 10 A F H X S+ 0 0 5 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.912 113.6 48.5 -68.6 -42.5 -26.6 -15.2 12.9 7 11 A T H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.932 112.3 49.4 -63.3 -44.3 -27.1 -12.5 10.2 8 12 A S H X S+ 0 0 0 -4,-2.9 4,-2.3 2,-0.2 -2,-0.2 0.924 111.0 49.4 -60.0 -45.1 -27.2 -9.8 12.8 9 13 A R H X S+ 0 0 19 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.893 111.2 50.1 -61.3 -42.0 -24.0 -11.1 14.5 10 14 A T H < S+ 0 0 18 -4,-2.4 4,-0.4 1,-0.2 3,-0.2 0.925 110.4 49.0 -60.5 -48.9 -22.3 -11.2 11.2 11 15 A L H >X S+ 0 0 0 -4,-2.6 3,-1.5 1,-0.2 4,-0.9 0.871 104.8 58.5 -61.8 -37.7 -23.3 -7.6 10.3 12 16 A L H >< S+ 0 0 0 -4,-2.3 3,-0.7 1,-0.3 31,-0.5 0.887 100.6 58.1 -58.4 -37.5 -22.1 -6.4 13.7 13 17 A N T 3< S+ 0 0 20 -4,-1.4 -1,-0.3 -3,-0.2 -2,-0.2 0.636 115.4 35.5 -66.6 -16.3 -18.6 -7.8 12.8 14 18 A F T <4 S+ 0 0 5 -3,-1.5 223,-2.4 -4,-0.4 -1,-0.2 0.438 93.3 123.5-109.6 -7.0 -18.6 -5.5 9.7 15 19 A F E << +a 237 0A 0 -4,-0.9 28,-1.5 -3,-0.7 29,-1.4 -0.368 32.6 178.4 -82.3 138.4 -20.4 -2.4 11.0 16 20 A E E -ab 238 44A 4 221,-2.6 223,-1.6 27,-0.2 2,-0.3 -0.967 23.6-147.2-128.2 110.4 -19.2 1.2 11.1 17 21 A V E -ab 239 45A 0 27,-2.0 29,-2.7 -2,-0.4 2,-0.3 -0.592 11.4-128.5 -85.5 139.6 -21.9 3.4 12.6 18 22 A A E + b 0 46A 35 221,-2.2 223,-0.3 -2,-0.3 29,-0.2 -0.690 35.4 161.4 -88.4 136.6 -22.3 7.0 11.4 19 23 A A E + b 0 47A 3 27,-2.4 29,-0.5 -2,-0.3 -1,-0.1 -0.539 38.2 127.3-143.7 69.3 -22.4 10.1 13.7 20 24 A L + 0 0 8 27,-0.2 27,-0.1 3,-0.0 154,-0.1 0.356 23.3 118.5-114.3 -3.8 -21.5 12.6 10.9 21 25 A T S > S- 0 0 70 1,-0.1 3,-1.6 -3,-0.1 27,-0.2 -0.333 70.2-121.4 -70.4 155.1 -24.1 15.4 10.9 22 26 A D T 3 S+ 0 0 147 1,-0.3 -1,-0.1 -2,-0.0 0, 0.0 0.745 111.4 63.4 -64.8 -21.7 -23.1 19.0 11.6 23 27 A G T 3 S+ 0 0 62 2,-0.0 -1,-0.3 0, 0.0 -2,-0.0 0.413 73.9 125.7 -83.7 0.9 -25.5 18.9 14.5 24 28 A E < - 0 0 36 -3,-1.6 2,-0.3 4,-0.1 3,-0.0 -0.218 38.2-170.7 -58.8 153.6 -23.7 16.2 16.5 25 29 A T > - 0 0 64 1,-0.0 4,-2.6 26,-0.0 5,-0.3 -0.834 42.3 -96.0-134.3 170.0 -22.8 16.9 20.1 26 30 A N H > S+ 0 0 61 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.907 126.7 52.5 -53.7 -40.7 -20.7 15.1 22.8 27 31 A E H > S+ 0 0 139 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.900 110.4 44.2 -65.0 -44.6 -24.0 13.6 24.0 28 32 A S H > S+ 0 0 34 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.908 115.8 48.2 -69.2 -39.9 -25.1 12.3 20.6 29 33 A V H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.924 110.7 51.4 -65.6 -42.9 -21.6 10.9 19.9 30 34 A A H X S+ 0 0 10 -4,-2.8 4,-2.2 -5,-0.3 -1,-0.2 0.911 108.3 52.4 -59.4 -43.1 -21.4 9.3 23.3 31 35 A A H X S+ 0 0 43 -4,-2.1 4,-1.3 1,-0.2 -1,-0.2 0.923 112.3 44.2 -61.8 -43.9 -24.8 7.6 22.8 32 36 A V H X S+ 0 0 8 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.931 112.8 52.1 -65.4 -45.9 -23.8 6.1 19.5 33 37 A C H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.841 103.8 57.1 -61.0 -36.6 -20.4 5.0 20.8 34 38 A K H X S+ 0 0 96 -4,-2.2 4,-0.8 2,-0.2 -1,-0.2 0.908 111.9 40.7 -63.5 -42.5 -21.9 3.2 23.8 35 39 A I H < S+ 0 0 50 -4,-1.3 3,-0.4 2,-0.2 -2,-0.2 0.888 115.3 53.1 -73.5 -37.3 -24.0 1.0 21.6 36 40 A A H < S+ 0 0 0 -4,-2.5 6,-2.4 1,-0.2 -2,-0.2 0.922 113.9 42.1 -59.3 -42.6 -21.2 0.6 19.1 37 41 A A H < S+ 0 0 7 -4,-2.6 4,-0.3 4,-0.2 -1,-0.2 0.525 83.8 116.4 -88.7 -8.3 -18.7 -0.6 21.8 38 42 A K S < S- 0 0 95 -4,-0.8 4,-0.1 -3,-0.4 -3,-0.0 -0.360 83.9 -58.1 -61.8 141.7 -21.0 -2.9 23.8 39 43 A D S S+ 0 0 140 1,-0.2 -1,-0.1 2,-0.1 -2,-0.1 -0.398 134.8 39.2 -68.2 128.0 -19.8 -6.5 23.7 40 44 A P S S- 0 0 12 0, 0.0 -1,-0.2 0, 0.0 -2,-0.2 0.442 99.0-149.6 -80.8 129.4 -19.5 -7.7 20.9 41 45 A A - 0 0 30 -4,-0.3 -4,-0.2 1,-0.1 -5,-0.1 -0.282 5.6-128.4 -66.9 147.4 -18.1 -4.5 19.6 42 46 A I - 0 0 2 -6,-2.4 28,-0.2 -7,-0.1 -29,-0.2 -0.167 35.5 -94.5 -79.0-176.6 -18.7 -3.4 16.1 43 47 A V S S- 0 0 5 -28,-1.5 27,-2.6 -31,-0.5 2,-0.3 0.943 80.5 -57.7 -70.3 -48.3 -15.7 -2.3 13.9 44 48 A G E -bc 16 70A 2 -29,-1.4 -27,-2.0 25,-0.3 2,-0.4 -0.971 41.4 -94.5-174.8-176.4 -15.9 1.5 14.5 45 49 A V E -bc 17 71A 0 25,-2.1 27,-3.1 -2,-0.3 2,-0.6 -0.974 25.2-141.0-126.1 139.8 -17.6 4.8 14.4 46 50 A S E +bc 18 72A 3 -29,-2.7 -27,-2.4 -2,-0.4 2,-0.3 -0.924 34.4 155.6-102.4 121.0 -17.4 7.5 11.7 47 51 A V E -bc 19 73A 0 25,-2.1 27,-2.6 -2,-0.6 -27,-0.2 -0.917 46.2 -95.3-135.6 165.4 -17.3 11.1 12.9 48 52 A R > - 0 0 42 -29,-0.5 3,-2.2 -2,-0.3 4,-0.4 -0.418 49.9-100.4 -71.1 157.7 -16.0 14.5 11.7 49 53 A P G >> S+ 0 0 27 0, 0.0 3,-1.6 0, 0.0 4,-0.5 0.829 117.1 74.5 -49.4 -32.8 -12.5 15.4 12.9 50 54 A A G 34 S+ 0 0 85 1,-0.3 4,-0.2 2,-0.1 23,-0.0 0.643 99.9 42.0 -57.5 -19.3 -14.1 17.6 15.6 51 55 A F G <> S+ 0 0 34 -3,-2.2 4,-2.0 2,-0.1 -1,-0.3 0.425 86.9 90.7-111.1 4.3 -15.1 14.6 17.7 52 56 A V H <> S+ 0 0 0 -3,-1.6 4,-2.5 -4,-0.4 5,-0.2 0.959 92.1 42.9 -63.5 -53.5 -12.0 12.3 17.4 53 57 A R H X>S+ 0 0 97 -4,-0.5 4,-2.9 1,-0.2 5,-0.8 0.878 110.2 58.5 -61.7 -39.2 -10.3 13.7 20.5 54 58 A F H >>S+ 0 0 22 -4,-0.2 5,-3.1 1,-0.2 4,-1.3 0.948 112.0 39.8 -54.0 -50.7 -13.6 13.7 22.5 55 59 A I H <>S+ 0 0 0 -4,-2.0 5,-0.9 3,-0.2 -2,-0.2 0.940 122.3 40.9 -64.5 -47.4 -13.9 9.9 21.9 56 60 A R H <5S+ 0 0 58 -4,-2.5 -2,-0.2 41,-0.2 -1,-0.2 0.721 129.2 21.6 -77.2 -30.7 -10.2 9.1 22.4 57 61 A Q H <5S+ 0 0 115 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.1 0.708 133.7 22.0-108.9 -30.2 -9.3 11.3 25.4 58 62 A E T ><>< + 0 0 2 -4,-2.9 3,-2.2 -5,-0.2 4,-0.2 -0.677 64.6 174.0-126.2 74.9 -17.1 4.6 28.8 64 68 A P G > S+ 0 0 86 0, 0.0 3,-1.6 0, 0.0 4,-0.2 0.734 71.8 73.3 -56.8 -24.7 -13.8 2.7 28.8 65 69 A E G > S+ 0 0 82 1,-0.3 3,-1.9 2,-0.2 -5,-0.1 0.713 77.7 77.2 -62.1 -21.8 -15.2 0.2 26.2 66 70 A V G X S+ 0 0 0 -3,-2.2 3,-1.5 1,-0.3 -1,-0.3 0.724 77.6 72.1 -65.4 -18.9 -14.9 2.8 23.5 67 71 A A G < S+ 0 0 63 -3,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.776 90.7 64.1 -62.0 -23.3 -11.2 2.2 23.4 68 72 A G G < S+ 0 0 59 -3,-1.9 2,-0.3 -4,-0.2 -1,-0.3 0.279 92.5 67.7 -88.4 4.9 -12.2 -1.1 21.7 69 73 A I S < S- 0 0 4 -3,-1.5 -25,-0.3 -28,-0.0 2,-0.2 -0.907 85.4-112.7-117.9 154.2 -13.8 0.4 18.5 70 74 A K E -c 44 0A 70 -27,-2.6 -25,-2.1 -2,-0.3 2,-0.5 -0.541 18.9-138.8 -81.0 151.4 -12.0 2.2 15.8 71 75 A V E -c 45 0A 0 27,-0.3 29,-2.8 -27,-0.2 30,-1.6 -0.969 16.4-166.3-110.1 118.1 -12.5 5.9 15.1 72 76 A C E -cd 46 101A 4 -27,-3.1 -25,-2.1 -2,-0.5 2,-0.5 -0.944 11.9-145.2-109.0 119.5 -12.8 6.7 11.4 73 77 A A E -cd 47 102A 0 28,-2.4 30,-2.7 -2,-0.6 2,-0.7 -0.763 7.5-139.3 -90.4 125.4 -12.5 10.5 10.7 74 78 A A E - d 0 103A 0 -27,-2.6 3,-0.4 -2,-0.5 2,-0.3 -0.732 25.3-171.6 -88.0 112.1 -14.5 11.8 7.8 75 79 A V E + d 0 104A 0 28,-2.2 30,-2.2 -2,-0.7 12,-0.1 -0.775 63.4 23.9-110.4 150.7 -12.5 14.3 5.8 76 80 A N S > S- 0 0 6 -2,-0.3 4,-1.8 1,-0.3 -1,-0.2 0.701 100.2-171.3 67.5 22.0 -13.6 16.6 2.9 77 81 A F T 4 + 0 0 21 -3,-0.4 -1,-0.3 1,-0.2 67,-0.0 -0.650 39.2 6.5 -92.9 154.4 -17.1 16.3 4.3 78 82 A P T 4 S+ 0 0 56 0, 0.0 -1,-0.2 0, 0.0 94,-0.1 -0.998 134.1 14.5 -95.9 -4.1 -19.9 17.0 3.7 79 83 A E T 4 S- 0 0 80 26,-0.1 -2,-0.2 28,-0.0 29,-0.1 0.487 84.8-121.1-113.5 -6.7 -19.6 18.4 0.1 80 84 A G < + 0 0 0 -4,-1.8 -3,-0.1 27,-0.1 29,-0.1 0.811 67.9 134.1 72.3 29.7 -16.1 17.4 -1.2 81 85 A T + 0 0 111 -5,-0.2 -1,-0.1 26,-0.1 -4,-0.1 0.244 35.6 105.3 -97.6 5.3 -15.2 21.0 -1.8 82 86 A G - 0 0 25 -6,-0.2 25,-0.1 1,-0.1 43,-0.0 -0.147 66.0-118.9 -77.7 177.5 -11.7 21.0 -0.3 83 87 A T > - 0 0 72 1,-0.1 4,-2.7 42,-0.0 5,-0.4 -0.738 36.1-100.4-106.0 165.1 -8.3 21.0 -1.9 84 88 A P H > S+ 0 0 37 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.910 125.4 48.1 -52.4 -39.7 -5.7 18.3 -1.6 85 89 A D H > S+ 0 0 112 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.903 110.9 46.9 -70.1 -40.6 -3.9 20.5 1.0 86 90 A T H > S+ 0 0 69 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.907 115.8 46.5 -69.1 -37.8 -7.0 21.4 3.1 87 91 A V H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.907 109.6 53.6 -70.5 -40.0 -8.1 17.8 3.2 88 92 A S H X S+ 0 0 11 -4,-2.2 4,-2.8 -5,-0.4 -1,-0.2 0.916 106.3 53.8 -58.6 -40.0 -4.6 16.6 4.1 89 93 A L H X S+ 0 0 128 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.886 107.7 49.8 -63.7 -38.9 -4.7 19.1 7.0 90 94 A E H X S+ 0 0 61 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.924 112.9 47.6 -60.9 -46.7 -8.0 17.6 8.3 91 95 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.917 109.2 52.5 -62.9 -45.6 -6.5 14.1 8.1 92 96 A V H X S+ 0 0 63 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.931 112.9 44.9 -56.5 -46.9 -3.2 15.0 9.8 93 97 A G H X S+ 0 0 21 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.884 111.6 51.9 -66.9 -38.5 -5.1 16.5 12.7 94 98 A A H <>S+ 0 0 0 -4,-2.2 5,-2.5 2,-0.2 4,-0.3 0.919 110.6 48.1 -64.3 -42.3 -7.6 13.6 13.0 95 99 A L H ><5S+ 0 0 30 -4,-2.5 3,-1.4 1,-0.2 -2,-0.2 0.918 110.5 52.0 -66.0 -40.2 -4.7 11.1 13.1 96 100 A K H 3<5S+ 0 0 159 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.890 106.9 54.1 -59.8 -41.6 -3.0 13.2 15.8 97 101 A D T 3<5S- 0 0 43 -4,-2.1 -1,-0.3 -5,-0.1 -41,-0.2 0.471 133.0 -88.3 -73.6 -4.5 -6.2 13.2 17.8 98 102 A G T < 5 + 0 0 25 -3,-1.4 -27,-0.3 -4,-0.3 -3,-0.2 0.489 68.3 158.8 111.6 8.3 -6.3 9.4 17.7 99 103 A A < - 0 0 0 -5,-2.5 -1,-0.2 -6,-0.1 -27,-0.2 -0.354 26.0-161.8 -64.6 142.1 -8.2 8.4 14.5 100 104 A D S S+ 0 0 50 -29,-2.8 37,-0.7 1,-0.2 2,-0.3 0.711 71.7 15.7 -94.0 -28.1 -7.6 4.9 13.3 101 105 A E E -de 72 137A 2 -30,-1.6 -28,-2.4 35,-0.1 2,-0.4 -0.943 66.8-134.8-142.8 162.8 -8.8 5.4 9.7 102 106 A I E -de 73 138A 0 35,-2.5 37,-3.1 -2,-0.3 2,-0.5 -0.977 7.2-161.7-123.6 135.4 -9.7 8.2 7.3 103 107 A E E -de 74 139A 1 -30,-2.7 -28,-2.2 -2,-0.4 2,-0.6 -0.942 16.3-165.9-118.8 107.1 -12.8 8.4 5.1 104 108 A C E -de 75 140A 1 35,-3.0 37,-2.6 -2,-0.5 2,-0.3 -0.832 9.6-147.8-105.8 119.7 -12.3 10.9 2.3 105 109 A L E - e 0 141A 0 -30,-2.2 2,-0.2 -2,-0.6 37,-0.2 -0.591 18.6-136.4 -80.8 138.2 -15.1 12.2 0.2 106 110 A I - 0 0 1 35,-1.8 2,-2.0 -2,-0.3 3,-0.2 -0.479 27.4-100.7 -84.6 166.9 -14.2 13.1 -3.4 107 111 A D > + 0 0 26 1,-0.2 3,-1.2 11,-0.2 4,-0.5 -0.574 51.2 173.4 -84.8 79.5 -15.3 16.2 -5.4 108 112 A W T >> + 0 0 2 -2,-2.0 3,-1.1 1,-0.3 4,-0.5 0.803 65.3 68.7 -66.6 -26.6 -18.0 14.1 -7.1 109 113 A R H >> S+ 0 0 94 1,-0.2 3,-1.4 -3,-0.2 4,-0.8 0.837 87.2 67.6 -61.5 -31.8 -19.5 17.2 -8.8 110 114 A R H X> S+ 0 0 74 -3,-1.2 4,-2.3 1,-0.3 3,-0.6 0.829 89.5 63.4 -60.9 -30.0 -16.5 17.5 -11.0 111 115 A M H <4 S+ 0 0 3 -3,-1.1 -1,-0.3 -4,-0.5 -2,-0.2 0.777 98.8 56.2 -63.7 -27.4 -17.3 14.2 -12.8 112 116 A N H << S+ 0 0 87 -3,-1.4 -1,-0.2 -4,-0.5 -2,-0.2 0.781 112.0 40.5 -75.4 -28.9 -20.5 15.8 -14.1 113 117 A E H << S- 0 0 126 -4,-0.8 2,-0.3 -3,-0.6 -2,-0.2 0.874 135.9 -5.6 -89.9 -40.9 -18.7 18.7 -15.7 114 118 A N X - 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