==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE, TRANSFERASE 04-FEB-13 4J2F . COMPND 2 MOLECULE: GLUTATHIONE S-TRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: RICINUS COMMUNIS; . AUTHOR J.KIM,R.TORO,R.BHOSLE,N.F.AL OBAIDI,L.L.MORISCO,S.R.WASSERMA . 218 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11607.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 151 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 5.5 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 . 2 0.9 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 . 10 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 100 45.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.3 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 0 1 1 1 0 0 0 2 0 2 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 E 0 0 134 0, 0.0 2,-0.2 0, 0.0 56,-0.0 0.000 360.0 360.0 360.0 130.0 3.9 8.8 7.3 2 4 A V - 0 0 94 26,-0.0 56,-2.2 55,-0.0 2,-0.5 -0.538 360.0-156.5 -72.3 130.2 7.0 7.9 5.2 3 5 A L E +A 57 0A 15 -2,-0.2 26,-2.9 54,-0.2 2,-0.4 -0.954 13.6 179.2-113.3 117.7 9.2 5.4 6.9 4 6 A K E -Ab 56 29A 69 52,-3.1 52,-3.4 -2,-0.5 2,-0.6 -0.958 15.0-157.6-121.4 135.9 12.9 5.2 5.9 5 7 A L E -Ab 55 30A 0 24,-2.9 26,-3.0 -2,-0.4 2,-0.6 -0.955 6.9-157.8-110.5 115.9 15.6 2.9 7.3 6 8 A H E +Ab 54 31A 3 48,-3.4 48,-1.9 -2,-0.6 2,-0.2 -0.891 36.8 138.2 -89.4 121.0 19.1 4.1 6.9 7 9 A G E - b 0 32A 0 24,-2.9 26,-3.0 -2,-0.6 2,-0.3 -0.729 50.7-117.4-146.4-177.8 21.4 1.1 7.0 8 10 A A > - 0 0 5 -2,-0.2 3,-2.2 24,-0.2 6,-0.2 -0.984 27.8-128.6-139.3 136.1 24.4 -0.7 5.7 9 11 A W T 3 S+ 0 0 86 -2,-0.3 -1,-0.1 1,-0.3 6,-0.1 0.821 104.3 42.9 -61.6 -33.2 24.0 -4.2 4.2 10 12 A P T 3 S+ 0 0 16 0, 0.0 -1,-0.3 0, 0.0 3,-0.0 0.443 88.6 111.2 -92.0 6.7 26.7 -6.0 6.1 11 13 A S <> - 0 0 15 -3,-2.2 4,-2.1 1,-0.2 5,-0.2 -0.617 56.6-154.2 -81.0 130.2 25.8 -4.5 9.6 12 14 A P H > S+ 0 0 5 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.869 97.3 55.8 -63.2 -28.6 24.3 -6.7 12.2 13 15 A F H > S+ 0 0 70 2,-0.2 4,-0.8 1,-0.2 144,-0.0 0.909 108.5 44.4 -76.0 -37.5 22.7 -3.6 13.7 14 16 A S H >> S+ 0 0 0 -6,-0.2 4,-2.4 1,-0.2 3,-1.0 0.916 110.8 56.9 -67.0 -40.3 20.9 -2.5 10.5 15 17 A C H 3X S+ 0 0 5 -4,-2.1 4,-3.1 1,-0.3 -2,-0.2 0.860 97.2 62.3 -65.6 -29.7 19.8 -6.1 10.0 16 18 A R H 3X S+ 0 0 9 -4,-1.7 4,-1.8 1,-0.2 -1,-0.3 0.851 108.0 43.1 -56.8 -47.7 18.2 -6.2 13.4 17 19 A V H S+ 0 0 0 -4,-3.1 5,-2.2 2,-0.2 4,-0.8 0.952 115.4 46.2 -61.5 -45.9 10.3 -4.5 10.2 22 24 A K H ><5S+ 0 0 81 -4,-3.2 3,-0.7 -5,-0.3 -2,-0.2 0.921 107.3 56.0 -70.1 -34.3 9.9 -7.7 8.2 23 25 A L H 3<5S+ 0 0 41 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.787 117.3 37.0 -64.9 -29.5 8.5 -9.8 11.1 24 26 A K H 3<5S- 0 0 27 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.506 109.3-127.3 -93.6 -14.2 5.8 -7.2 11.6 25 27 A G T <<5 + 0 0 58 -4,-0.8 -3,-0.2 -3,-0.7 -4,-0.1 0.831 46.9 165.1 67.5 38.3 5.4 -6.6 7.8 26 28 A I < - 0 0 8 -5,-2.2 -1,-0.2 -6,-0.2 -2,-0.1 -0.713 35.7-125.9 -86.4 126.2 5.9 -2.9 8.1 27 29 A P + 0 0 106 0, 0.0 2,-0.3 0, 0.0 -1,-0.0 -0.403 41.0 159.5 -66.6 146.0 6.6 -1.2 4.7 28 30 A Y - 0 0 56 -2,-0.1 2,-0.4 -26,-0.1 -24,-0.2 -0.981 41.0-118.2-157.8 163.6 9.7 1.0 4.5 29 31 A E E -b 4 0A 97 -26,-2.9 -24,-2.9 -2,-0.3 2,-0.4 -0.886 31.3-143.8-103.4 133.7 12.1 2.5 2.2 30 32 A Y E -b 5 0A 74 -2,-0.4 2,-0.4 -26,-0.2 -24,-0.2 -0.845 13.5-169.1 -99.5 143.2 15.7 1.4 2.7 31 33 A V E -b 6 0A 35 -26,-3.0 -24,-2.9 -2,-0.4 2,-0.4 -0.993 15.2-140.5-133.3 120.6 18.7 3.7 2.2 32 34 A E E -b 7 0A 87 -2,-0.4 2,-0.5 -26,-0.2 -24,-0.2 -0.689 17.8-155.7 -80.4 134.3 22.2 2.4 2.1 33 35 A E - 0 0 12 -26,-3.0 2,-0.1 -2,-0.4 19,-0.1 -0.944 11.7-132.8-113.9 126.0 24.7 4.6 3.9 34 36 A D - 0 0 80 -2,-0.5 5,-0.4 3,-0.2 -26,-0.0 -0.470 13.5-161.5 -64.5 144.7 28.4 4.7 3.2 35 37 A L S S+ 0 0 82 -2,-0.1 3,-0.2 3,-0.1 -1,-0.1 0.564 82.5 54.2-111.3 -11.1 30.5 4.5 6.3 36 38 A F S S+ 0 0 138 1,-0.3 2,-0.6 0, 0.0 -1,-0.1 0.859 123.4 24.7 -83.6 -48.7 33.9 5.9 5.1 37 39 A N S S- 0 0 135 0, 0.0 -1,-0.3 0, 0.0 -3,-0.2 -0.941 93.0-148.8-119.2 99.0 32.5 9.1 3.7 38 40 A K - 0 0 87 -2,-0.6 -3,-0.1 -3,-0.2 -5,-0.0 -0.443 11.6-115.9 -78.6 147.6 29.2 9.8 5.6 39 41 A S > - 0 0 28 -5,-0.4 4,-2.1 -2,-0.1 5,-0.2 -0.410 21.1-117.6 -76.4 157.9 26.2 11.6 4.1 40 42 A P H > S+ 0 0 110 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.888 115.2 55.5 -63.9 -30.8 25.0 14.9 5.4 41 43 A L H > S+ 0 0 70 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.918 105.7 49.6 -68.7 -42.8 21.7 13.2 6.3 42 44 A L H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.937 114.3 45.7 -58.3 -45.5 23.3 10.6 8.5 43 45 A L H < S+ 0 0 63 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.891 114.5 48.2 -71.3 -33.6 25.3 13.3 10.3 44 46 A Q H < S+ 0 0 140 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.925 116.6 43.1 -66.0 -45.9 22.2 15.5 10.7 45 47 A Y H < S+ 0 0 37 -4,-3.2 -2,-0.2 1,-0.3 -1,-0.2 0.772 127.5 27.3 -72.4 -35.3 20.2 12.5 12.0 46 48 A N X + 0 0 6 -4,-2.3 4,-2.4 -5,-0.2 -1,-0.3 -0.514 65.9 156.1-129.3 70.1 22.7 11.1 14.3 47 49 A P T 4 S+ 0 0 86 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.809 73.5 54.5 -69.8 -24.1 25.0 13.9 15.4 48 50 A V T 4 S+ 0 0 117 1,-0.1 -2,-0.1 -3,-0.1 -5,-0.0 0.941 130.2 5.0 -76.7 -49.6 26.0 12.1 18.6 49 51 A H T 4 S- 0 0 97 2,-0.1 -1,-0.1 -6,-0.0 3,-0.1 0.522 78.3-145.6-110.7 -22.2 27.3 8.8 17.3 50 52 A K < + 0 0 103 -4,-2.4 2,-0.3 1,-0.2 -7,-0.1 0.707 56.2 127.6 65.2 31.7 27.1 9.2 13.5 51 53 A K - 0 0 106 2,-0.1 -1,-0.2 -9,-0.1 13,-0.2 -0.768 51.0 -88.5-120.8 159.6 26.2 5.5 13.0 52 54 A I S S+ 0 0 16 -2,-0.3 -45,-0.2 -3,-0.1 13,-0.1 -0.593 81.2 69.3-100.0 155.6 23.5 3.4 11.3 53 55 A P + 0 0 4 0, 0.0 11,-0.8 0, 0.0 2,-0.4 0.528 55.4 165.1 -78.3 151.7 20.9 2.3 11.7 54 56 A V E -AC 6 63A 0 -48,-1.9 -48,-3.4 9,-0.2 2,-0.5 -0.996 20.8-156.9-123.9 130.3 18.7 5.3 11.8 55 57 A L E -AC 5 62A 0 7,-2.4 7,-3.1 -2,-0.4 2,-0.5 -0.901 9.4-163.7 -96.4 130.0 15.0 4.8 11.4 56 58 A V E -AC 4 61A 7 -52,-3.4 -52,-3.1 -2,-0.5 2,-0.5 -0.964 8.2-178.6-122.2 113.1 13.2 8.0 10.1 57 59 A H E > S-AC 3 60A 41 3,-2.4 3,-2.6 -2,-0.5 -54,-0.2 -0.956 75.7 -14.1-113.2 126.1 9.4 8.3 10.5 58 60 A G T 3 S- 0 0 45 -56,-2.2 -1,-0.2 -2,-0.5 -55,-0.1 0.846 129.8 -55.4 49.2 38.4 7.7 11.3 9.2 59 61 A G T 3 S+ 0 0 55 -57,-0.5 -1,-0.3 1,-0.2 -56,-0.1 0.428 114.1 119.3 77.9 2.3 11.1 13.0 8.9 60 62 A K E < -C 57 0A 131 -3,-2.6 -3,-2.4 2,-0.0 2,-0.2 -0.879 56.2-140.4-106.9 119.3 11.9 12.4 12.6 61 63 A P E -C 56 0A 56 0, 0.0 2,-0.4 0, 0.0 -5,-0.2 -0.558 13.4-165.8 -83.3 144.1 14.9 10.2 13.2 62 64 A I E -C 55 0A 25 -7,-3.1 -7,-2.4 -2,-0.2 2,-0.2 -0.990 12.4-159.5-128.9 122.3 15.4 7.5 15.9 63 65 A C E +C 54 0A 31 -2,-0.4 -9,-0.2 -9,-0.2 -11,-0.1 -0.670 50.7 55.0-100.5 159.1 18.9 6.2 16.6 64 66 A E > - 0 0 51 -11,-0.8 4,-3.1 -2,-0.2 3,-0.4 0.800 68.2-126.6 83.8 113.2 20.1 3.0 18.2 65 67 A S H > S+ 0 0 3 1,-0.3 4,-2.5 2,-0.2 5,-0.1 0.838 109.2 48.2 -52.7 -44.7 19.0 -0.4 16.9 66 68 A T H > S+ 0 0 24 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.906 113.4 47.7 -68.1 -35.0 17.7 -1.6 20.3 67 69 A I H > S+ 0 0 92 -3,-0.4 4,-2.4 1,-0.2 -2,-0.2 0.894 108.9 54.3 -74.6 -36.3 15.8 1.6 20.9 68 70 A I H X S+ 0 0 0 -4,-3.1 4,-2.8 2,-0.2 -2,-0.2 0.923 105.1 54.3 -59.9 -44.5 14.4 1.4 17.4 69 71 A L H X S+ 0 0 2 -4,-2.5 4,-1.7 -5,-0.2 -2,-0.2 0.926 109.1 47.6 -57.1 -44.5 13.1 -2.1 18.1 70 72 A E H X S+ 0 0 40 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.921 110.1 53.0 -62.5 -41.1 11.2 -0.8 21.2 71 73 A Y H X S+ 0 0 49 -4,-2.4 4,-2.5 1,-0.2 5,-0.3 0.932 107.4 51.8 -60.0 -43.6 9.8 2.0 19.2 72 74 A L H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.879 109.2 50.3 -58.7 -39.4 8.5 -0.4 16.6 73 75 A D H < S+ 0 0 12 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.825 113.0 45.6 -66.7 -41.3 6.8 -2.4 19.4 74 76 A E H < S+ 0 0 133 -4,-2.0 -2,-0.2 -5,-0.1 -1,-0.2 0.827 120.2 38.8 -70.9 -32.7 5.1 0.7 20.8 75 77 A T H < S+ 0 0 57 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.2 0.825 128.8 29.3 -93.5 -23.4 3.9 2.0 17.4 76 78 A W < + 0 0 102 -4,-2.4 -1,-0.3 -5,-0.3 -2,-0.1 -0.733 69.3 178.3-133.3 79.9 3.0 -1.3 15.8 77 79 A P + 0 0 93 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.705 46.4 106.7 -66.3 -15.9 1.9 -3.6 18.6 78 80 A E S S+ 0 0 72 1,-0.2 -2,-0.1 -54,-0.1 0, 0.0 -0.339 89.3 12.0 -63.9 137.2 1.0 -6.5 16.3 79 81 A N S S- 0 0 99 1,-0.1 -1,-0.2 2,-0.0 -3,-0.0 0.982 92.1-148.2 59.9 63.8 3.6 -9.3 16.6 80 82 A P - 0 0 55 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 -0.331 19.3-160.4 -62.9 138.5 5.4 -7.9 19.7 81 83 A L S S+ 0 0 10 -12,-0.2 70,-2.5 69,-0.1 71,-0.3 0.649 76.4 73.0 -85.3 -24.0 9.1 -8.6 20.0 82 84 A L S S- 0 0 9 68,-0.2 7,-0.1 69,-0.1 2,-0.0 -0.742 91.4-109.9 -92.8 140.3 8.9 -7.8 23.8 83 85 A P - 0 0 31 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 -0.348 21.7-134.6 -51.2 150.3 7.4 -10.2 26.3 84 86 A S S S+ 0 0 112 -4,-0.1 -2,-0.0 4,-0.1 3,-0.0 0.754 81.6 84.6 -83.5 -34.1 4.1 -8.9 27.7 85 87 A D S > S- 0 0 73 1,-0.1 4,-2.8 2,-0.0 5,-0.2 -0.607 77.8-136.5 -72.8 136.1 4.8 -9.7 31.4 86 88 A P H > S+ 0 0 99 0, 0.0 4,-2.0 0, 0.0 -1,-0.1 0.872 102.7 49.5 -68.8 -37.8 6.8 -7.0 33.1 87 89 A H H > S+ 0 0 133 2,-0.2 4,-1.8 1,-0.2 5,-0.2 0.929 113.5 47.3 -57.6 -45.6 9.2 -9.3 34.9 88 90 A E H > S+ 0 0 117 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.893 110.2 52.5 -68.2 -35.2 9.9 -11.2 31.6 89 91 A R H X S+ 0 0 75 -4,-2.8 4,-3.2 1,-0.2 -1,-0.2 0.854 107.9 52.8 -59.9 -47.4 10.4 -7.9 29.7 90 92 A A H X S+ 0 0 53 -4,-2.0 4,-1.7 -5,-0.2 -1,-0.2 0.870 109.7 46.9 -56.9 -43.7 12.9 -6.8 32.3 91 93 A V H X S+ 0 0 63 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.902 113.2 49.2 -67.4 -41.1 14.9 -10.1 31.9 92 94 A A H X S+ 0 0 12 -4,-2.5 4,-2.3 1,-0.2 3,-0.5 0.974 110.0 51.0 -61.5 -44.3 14.8 -9.7 28.1 93 95 A R H X S+ 0 0 94 -4,-3.2 4,-2.6 1,-0.3 5,-0.2 0.852 105.1 59.0 -58.9 -37.4 15.9 -6.1 28.4 94 96 A F H X S+ 0 0 120 -4,-1.7 4,-2.3 2,-0.2 -1,-0.3 0.916 108.0 43.5 -56.6 -45.3 18.8 -7.3 30.6 95 97 A W H X S+ 0 0 22 -4,-1.6 4,-2.5 -3,-0.5 5,-0.2 0.860 111.7 53.5 -76.8 -29.5 20.1 -9.6 27.9 96 98 A V H X S+ 0 0 11 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.967 112.8 43.9 -62.2 -49.7 19.7 -7.0 25.2 97 99 A K H X S+ 0 0 131 -4,-2.6 4,-3.3 1,-0.2 -2,-0.2 0.898 111.6 55.8 -60.1 -43.7 21.7 -4.6 27.3 98 100 A F H X S+ 0 0 27 -4,-2.3 4,-2.0 -5,-0.2 -1,-0.2 0.929 109.4 43.9 -56.5 -50.1 24.2 -7.3 28.0 99 101 A I H X S+ 0 0 10 -4,-2.5 4,-0.9 2,-0.2 -1,-0.2 0.891 113.2 52.8 -68.3 -32.7 24.9 -8.1 24.4 100 102 A E H >< S+ 0 0 59 -4,-2.4 3,-0.9 -5,-0.2 4,-0.3 0.980 112.7 44.9 -60.4 -50.2 25.1 -4.3 23.7 101 103 A D H 3< S+ 0 0 105 -4,-3.3 -2,-0.2 1,-0.2 -1,-0.2 0.771 123.6 34.3 -61.7 -34.9 27.7 -3.9 26.5 102 104 A K H >< S+ 0 0 98 -4,-2.0 3,-2.5 -5,-0.2 4,-0.3 0.351 82.8 107.4-102.3 2.0 29.7 -7.0 25.4 103 105 A G T XX + 0 0 19 -3,-0.9 3,-1.5 -4,-0.9 4,-1.3 0.775 65.6 73.1 -64.8 -23.6 29.4 -6.8 21.7 104 106 A T H 3> S+ 0 0 85 -4,-0.3 4,-1.6 1,-0.2 -1,-0.3 0.697 81.5 74.4 -52.7 -21.6 32.9 -5.7 21.2 105 107 A A H <> S+ 0 0 6 -3,-2.5 4,-0.5 1,-0.2 19,-0.3 0.817 99.8 42.9 -77.5 -20.7 34.0 -9.2 22.1 106 108 A I H X> S+ 0 0 8 -3,-1.5 4,-1.0 -4,-0.3 3,-0.7 0.935 114.8 48.7 -74.6 -50.0 32.9 -10.4 18.7 107 109 A W H 3X S+ 0 0 51 -4,-1.3 4,-0.5 1,-0.3 -2,-0.2 0.636 101.4 62.5 -79.9 -9.8 34.3 -7.5 16.8 108 110 A N H >< S+ 0 0 50 -4,-1.6 3,-0.5 2,-0.2 -1,-0.3 0.821 97.4 57.0 -84.8 -30.9 37.8 -7.6 18.4 109 111 A I H X< S+ 0 0 0 -3,-0.7 3,-1.1 -4,-0.5 -1,-0.2 0.911 102.4 59.8 -53.8 -42.4 38.5 -11.0 17.0 110 112 A F H 3< S+ 0 0 3 -4,-1.0 -1,-0.2 1,-0.2 -2,-0.2 0.795 112.5 34.2 -60.6 -30.0 37.8 -9.5 13.6 111 113 A R T << S+ 0 0 113 -4,-0.5 2,-0.3 -3,-0.5 -1,-0.2 0.045 103.2 77.8-124.8 32.8 40.6 -6.9 13.9 112 114 A T < - 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