==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 03-MAR-13 4JGT . COMPND 2 MOLECULE: 3-MERCAPTOPYRUVATE SULFURTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.KOUTMOS,K.YAMADA,P.K.YADAV,T.CHIKU,R.BANERJEE . 835 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37059.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 509 61.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 87 10.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 1.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.4 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 . 56 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 91 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 196 23.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 2.5 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 3 0 6 0 8 13 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 12 3 3 3 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 . 6 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 6 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 9 A S 0 0 66 0, 0.0 118,-1.8 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 95.8 126.8 -32.7 29.1 2 10 A H E -a 119 0A 46 116,-0.2 2,-0.3 118,-0.1 118,-0.2 -0.955 360.0-161.5 -92.5 127.9 128.6 -30.0 27.2 3 11 A V E -a 120 0A 8 116,-2.6 118,-2.5 -2,-0.5 2,-0.1 -0.866 10.5-128.0-111.7 148.5 131.6 -28.8 29.2 4 12 A S > - 0 0 40 -2,-0.3 4,-2.0 116,-0.2 5,-0.1 -0.370 25.8-109.4 -86.2 169.4 133.5 -25.5 28.6 5 13 A A H > S+ 0 0 1 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.866 123.6 56.1 -62.9 -37.3 137.2 -25.1 28.2 6 14 A Q H > S+ 0 0 110 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.870 105.3 51.9 -63.0 -39.0 137.2 -23.5 31.6 7 15 A W H > S+ 0 0 99 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.930 112.8 44.3 -63.2 -47.1 135.6 -26.7 33.0 8 16 A V H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.922 109.9 55.2 -67.2 -41.7 138.3 -28.9 31.4 9 17 A A H X S+ 0 0 11 -4,-3.0 4,-1.5 1,-0.2 -2,-0.2 0.903 112.3 43.5 -59.3 -41.3 141.1 -26.6 32.6 10 18 A E H X S+ 0 0 95 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.892 108.9 57.0 -68.7 -41.0 139.9 -26.9 36.2 11 19 A A H < S+ 0 0 20 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.884 108.0 49.5 -57.9 -38.5 139.3 -30.6 35.9 12 20 A L H < S+ 0 0 63 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.856 114.0 43.9 -64.5 -43.0 143.0 -30.9 34.9 13 21 A R H < S+ 0 0 176 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.786 126.6 30.4 -68.9 -30.0 144.2 -28.8 37.8 14 22 A A S < S- 0 0 40 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.1 -0.654 70.2-173.4-142.6 75.7 141.9 -30.6 40.3 15 23 A P - 0 0 104 0, 0.0 2,-0.4 0, 0.0 -3,-0.1 -0.263 23.2-129.0 -60.6 161.4 141.0 -34.2 39.8 16 24 A R > - 0 0 210 3,-0.4 3,-1.9 -5,-0.0 -2,-0.0 -0.975 32.7 -98.0-118.6 129.5 138.4 -35.7 42.2 17 25 A A T 3 S+ 0 0 111 -2,-0.4 -1,-0.0 1,-0.3 0, 0.0 -0.113 102.2 6.4 -52.4 130.1 139.2 -39.0 43.9 18 26 A G T 3 S+ 0 0 67 1,-0.0 -1,-0.3 0, 0.0 0, 0.0 0.408 116.5 79.9 84.2 0.7 137.8 -42.2 42.4 19 27 A Q < - 0 0 121 -3,-1.9 -3,-0.4 68,-0.0 68,-0.1 -0.466 64.8-174.0-140.0 64.5 136.5 -40.4 39.3 20 28 A P - 0 0 62 0, 0.0 68,-2.9 0, 0.0 2,-0.3 -0.204 18.8-129.4 -64.2 148.6 139.3 -39.7 36.8 21 29 A L E -b 88 0A 47 66,-0.2 2,-0.4 -10,-0.1 68,-0.2 -0.705 17.4-168.8 -86.8 140.3 139.0 -37.7 33.7 22 30 A Q E -b 89 0A 21 66,-2.0 68,-2.3 -2,-0.3 2,-0.3 -0.899 9.1-154.6-130.2 110.1 140.1 -39.0 30.3 23 31 A L E -b 90 0A 2 -2,-0.4 27,-1.8 25,-0.2 2,-0.4 -0.646 11.3-165.1 -73.1 134.3 140.3 -36.5 27.4 24 32 A L E -bc 91 50A 0 66,-2.6 68,-2.8 -2,-0.3 2,-0.7 -0.996 15.7-150.2-122.2 130.2 140.0 -38.0 24.0 25 33 A D E +bc 92 51A 3 25,-3.1 27,-3.2 -2,-0.4 68,-0.2 -0.896 19.2 175.6 -89.3 113.6 140.8 -36.3 20.7 26 34 A A + 0 0 0 66,-2.9 67,-0.2 -2,-0.7 28,-0.1 -0.116 16.7 158.4-110.7 29.0 138.5 -38.0 18.2 27 35 A S + 0 0 4 65,-0.1 2,-0.3 10,-0.1 27,-0.2 -0.293 8.3 164.5 -53.6 135.6 139.4 -35.8 15.3 28 36 A W - 0 0 19 25,-0.1 2,-0.3 9,-0.1 73,-0.1 -0.946 12.1-171.0-156.7 139.2 138.6 -37.4 12.0 29 37 A Y - 0 0 18 -2,-0.3 8,-0.1 6,-0.2 5,-0.0 -0.976 30.9-105.5-136.2 147.1 138.4 -35.9 8.5 30 38 A L > - 0 0 16 -2,-0.3 3,-1.9 1,-0.1 5,-0.4 -0.488 44.3-110.5 -59.2 140.8 137.2 -36.8 5.0 31 39 A P G > S+ 0 0 74 0, 0.0 3,-2.6 0, 0.0 -1,-0.1 0.844 111.2 69.2 -39.6 -46.8 140.3 -37.5 2.8 32 40 A K G 3 S+ 0 0 155 156,-0.3 157,-0.0 1,-0.3 -2,-0.0 0.624 87.6 65.4 -56.6 -17.6 139.8 -34.4 0.6 33 41 A L G < S- 0 0 79 -3,-1.9 -1,-0.3 2,-0.1 3,-0.1 0.707 98.1-140.3 -74.5 -19.6 140.7 -32.0 3.5 34 42 A G < + 0 0 40 -3,-2.6 2,-0.3 -4,-0.4 -2,-0.1 0.580 52.2 139.5 71.0 13.0 144.2 -33.5 3.4 35 43 A R - 0 0 39 -5,-0.4 2,-0.6 -4,-0.1 -1,-0.2 -0.626 46.9-148.8 -89.8 144.7 144.5 -33.5 7.2 36 44 A D > - 0 0 85 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 -0.937 11.0-165.4-110.8 107.9 146.1 -36.4 9.1 37 45 A A H > S+ 0 0 14 -2,-0.6 4,-1.6 1,-0.2 -1,-0.2 0.894 84.1 47.7 -65.0 -46.1 144.3 -36.5 12.4 38 46 A R H > S+ 0 0 92 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.888 112.2 48.7 -63.9 -43.0 146.8 -38.7 14.3 39 47 A R H > S+ 0 0 179 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.879 110.7 52.7 -65.5 -35.6 149.8 -36.7 13.2 40 48 A E H X S+ 0 0 44 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.849 104.2 55.0 -67.4 -31.1 148.0 -33.5 14.2 41 49 A F H < S+ 0 0 6 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.908 108.6 49.5 -64.6 -39.9 147.3 -35.0 17.7 42 50 A E H < S+ 0 0 34 -4,-1.8 95,-3.0 1,-0.2 -2,-0.2 0.747 108.9 52.2 -72.1 -28.3 151.1 -35.6 18.0 43 51 A E H < S- 0 0 72 -4,-1.5 2,-0.3 1,-0.3 -2,-0.2 0.901 131.5 -11.9 -68.2 -49.9 151.8 -32.0 17.0 44 52 A R < + 0 0 16 -4,-2.4 -1,-0.3 -5,-0.1 2,-0.3 -0.959 66.8 150.0-156.4 145.2 149.3 -30.7 19.6 45 53 A H B -E 135 0B 2 90,-1.9 90,-2.8 -2,-0.3 3,-0.1 -0.974 52.2 -81.0-158.6 165.6 146.7 -31.8 22.0 46 54 A I > - 0 0 0 -2,-0.3 3,-2.7 88,-0.2 88,-0.2 -0.490 65.8 -89.0 -72.0 136.6 145.2 -30.9 25.4 47 55 A P T 3 S+ 0 0 39 0, 0.0 -1,-0.1 0, 0.0 -24,-0.1 -0.174 114.1 18.3 -54.5 138.8 147.4 -32.3 28.2 48 56 A G T 3 S+ 0 0 48 1,-0.3 -25,-0.2 -3,-0.1 -2,-0.1 0.211 94.7 139.1 86.5 -12.5 146.5 -35.8 29.2 49 57 A A < - 0 0 0 -3,-2.7 2,-0.3 -27,-0.1 -1,-0.3 -0.255 36.3-160.0 -68.4 150.0 144.6 -36.4 26.0 50 58 A A E -c 24 0A 0 -27,-1.8 -25,-3.1 -3,-0.1 2,-0.6 -0.863 25.1-109.8-117.0 160.2 144.7 -39.6 24.1 51 59 A F E -c 25 0A 11 88,-0.4 2,-0.6 -2,-0.3 -25,-0.2 -0.815 24.1-160.6 -94.4 122.1 143.8 -40.1 20.4 52 60 A F - 0 0 0 -27,-3.2 2,-0.7 -2,-0.6 53,-0.1 -0.931 8.5-155.6-104.0 121.2 140.6 -42.0 19.7 53 61 A D >> - 0 0 34 -2,-0.6 4,-3.0 1,-0.1 3,-0.7 -0.855 9.1-167.0-107.6 108.2 140.6 -43.3 16.1 54 62 A I T 34 S+ 0 0 1 -2,-0.7 -1,-0.1 1,-0.3 12,-0.1 0.746 89.0 55.6 -69.3 -28.0 137.1 -43.9 14.8 55 63 A D T 34 S+ 0 0 64 1,-0.1 -1,-0.3 10,-0.1 11,-0.2 0.739 113.7 40.5 -76.8 -22.4 138.4 -45.8 11.8 56 64 A Q T <4 S+ 0 0 109 -3,-0.7 2,-1.9 1,-0.2 -2,-0.2 0.841 108.0 61.1 -88.4 -42.0 140.3 -48.2 14.1 57 65 A C S < S+ 0 0 0 -4,-3.0 2,-0.3 12,-0.1 -1,-0.2 -0.405 94.8 93.4 -82.2 67.3 137.6 -48.5 16.7 58 66 A S S S- 0 0 12 -2,-1.9 10,-0.2 -3,-0.2 12,-0.2 -0.896 87.4 -52.8-151.0 170.8 135.1 -50.0 14.2 59 67 A D - 0 0 61 8,-1.9 8,-0.2 -2,-0.3 7,-0.1 -0.286 42.8-152.6 -55.8 127.1 133.6 -53.1 12.7 60 68 A R S S+ 0 0 177 1,-0.1 -1,-0.2 3,-0.0 -3,-0.0 0.605 87.7 40.6 -79.3 -14.1 136.4 -55.3 11.5 61 69 A T S S+ 0 0 120 3,-0.0 -1,-0.1 0, 0.0 -2,-0.1 0.815 87.9 97.0-102.4 -43.8 134.5 -57.1 8.8 62 70 A S - 0 0 32 1,-0.1 5,-0.1 2,-0.0 4,-0.1 -0.100 66.5-140.2 -50.4 142.1 132.3 -54.4 7.1 63 71 A P S S+ 0 0 28 0, 0.0 687,-2.4 0, 0.0 688,-0.4 0.589 82.2 89.3 -76.7 -11.7 133.5 -52.8 3.9 64 72 A Y S > S- 0 0 26 685,-0.2 3,-0.6 686,-0.2 2,-0.1 -0.685 84.1-117.8 -86.7 140.3 132.2 -49.5 5.2 65 73 A D T 3 S+ 0 0 69 -2,-0.3 -10,-0.1 1,-0.2 -9,-0.1 -0.422 85.6 8.2 -75.6 154.0 134.4 -47.4 7.3 66 74 A H T 3 S+ 0 0 0 -11,-0.2 2,-0.3 1,-0.2 -1,-0.2 0.779 76.2 160.3 36.6 49.9 133.7 -46.6 11.0 67 75 A M < - 0 0 37 -3,-0.6 -8,-1.9 -8,-0.2 -1,-0.2 -0.623 58.1 -79.2 -76.3 149.3 130.7 -48.8 11.4 68 76 A L - 0 0 14 -2,-0.3 -10,-0.2 -10,-0.2 -1,-0.1 -0.265 51.8-130.2 -52.6 135.1 130.0 -49.4 15.1 69 77 A P - 0 0 3 0, 0.0 -10,-0.2 0, 0.0 2,-0.1 -0.239 28.0 -89.3 -75.9 169.2 132.3 -52.0 16.5 70 78 A G > - 0 0 42 -12,-0.2 4,-2.5 1,-0.1 5,-0.1 -0.386 42.0-109.0 -62.8 160.5 131.3 -55.0 18.6 71 79 A A H > S+ 0 0 29 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.878 117.0 52.3 -63.9 -40.5 131.2 -54.4 22.3 72 80 A E H > S+ 0 0 156 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.934 112.0 46.8 -63.6 -44.7 134.2 -56.5 23.2 73 81 A H H > S+ 0 0 19 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.919 111.9 50.5 -61.7 -44.7 136.3 -54.6 20.6 74 82 A F H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 5,-0.2 0.912 111.9 47.4 -61.3 -41.5 135.0 -51.3 21.9 75 83 A A H X S+ 0 0 14 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.910 112.1 49.6 -67.9 -47.0 135.9 -52.2 25.5 76 84 A E H X S+ 0 0 77 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.921 115.0 44.6 -51.3 -50.1 139.4 -53.5 24.6 77 85 A Y H X S+ 0 0 20 -4,-2.5 4,-1.1 2,-0.2 -2,-0.2 0.937 114.9 45.2 -67.9 -47.3 140.1 -50.3 22.6 78 86 A A H ><>S+ 0 0 0 -4,-2.8 5,-2.1 -5,-0.2 3,-0.5 0.907 111.9 53.9 -64.5 -38.6 138.7 -47.8 25.2 79 87 A G H ><5S+ 0 0 4 -4,-2.5 3,-2.2 1,-0.3 65,-2.2 0.926 104.7 53.4 -61.9 -44.0 140.5 -49.6 28.0 80 88 A R H 3<5S+ 0 0 165 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.726 104.9 56.8 -65.2 -20.4 143.8 -49.4 26.2 81 89 A L T <<5S- 0 0 26 -4,-1.1 -1,-0.3 -3,-0.5 -2,-0.2 0.287 127.1-101.1 -89.7 8.0 143.1 -45.6 26.0 82 90 A G T < 5S+ 0 0 11 -3,-2.2 2,-0.6 1,-0.3 -3,-0.2 0.688 75.6 139.4 88.5 19.6 142.8 -45.5 29.8 83 91 A V < + 0 0 1 -5,-2.1 -1,-0.3 61,-0.2 2,-0.2 -0.864 23.6 173.9 -99.1 120.3 139.0 -45.4 30.1 84 92 A G > - 0 0 8 -2,-0.6 3,-2.2 -64,-0.1 62,-0.2 -0.711 50.7 -88.9-112.1 173.0 137.6 -47.5 32.9 85 93 A A T 3 S+ 0 0 81 60,-1.3 31,-0.2 1,-0.3 61,-0.1 0.829 128.0 47.3 -44.3 -40.0 134.1 -47.9 34.3 86 94 A A T 3 S+ 0 0 58 2,-0.1 2,-0.3 -65,-0.0 -1,-0.3 0.459 88.5 115.0 -84.8 -3.2 134.7 -44.9 36.7 87 95 A T < - 0 0 8 -3,-2.2 2,-0.8 -68,-0.1 -66,-0.2 -0.549 60.0-144.0 -81.8 129.5 136.2 -42.6 34.1 88 96 A H E -b 21 0A 34 -68,-2.9 -66,-2.0 -2,-0.3 2,-0.4 -0.850 26.1-151.9 -86.1 111.9 134.5 -39.4 33.1 89 97 A V E -bd 22 117A 0 27,-2.5 29,-2.0 -2,-0.8 2,-0.4 -0.709 13.6-170.7 -90.8 134.4 135.3 -39.3 29.4 90 98 A V E -bd 23 118A 0 -68,-2.3 -66,-2.6 -2,-0.4 2,-0.4 -0.993 8.8-162.0-128.2 126.6 135.5 -35.9 27.7 91 99 A I E +bd 24 119A 0 27,-2.3 29,-2.4 -2,-0.4 2,-0.3 -0.861 16.3 159.1-117.2 137.7 135.8 -35.8 23.9 92 100 A Y E -b 25 0A 0 -68,-2.8 -66,-2.9 -2,-0.4 2,-0.3 -0.849 17.7-156.9-138.0 177.2 137.0 -33.1 21.6 93 101 A D - 0 0 0 5,-0.4 31,-2.4 -2,-0.3 32,-0.4 -0.925 25.3-124.2-147.1 169.9 138.3 -32.7 18.0 94 102 A A + 0 0 12 -2,-0.3 5,-0.1 29,-0.2 29,-0.0 0.006 55.5 147.2-105.0 26.3 140.4 -30.0 16.3 95 103 A S > - 0 0 1 3,-0.2 3,-1.2 1,-0.1 30,-0.3 -0.180 58.9-122.9 -65.2 153.7 137.9 -29.3 13.4 96 104 A D T 3 S+ 0 0 63 1,-0.2 -1,-0.1 29,-0.1 315,-0.0 0.810 112.7 58.4 -62.0 -30.5 137.6 -25.9 11.8 97 105 A Q T 3 S- 0 0 60 1,-0.1 2,-0.6 116,-0.0 -1,-0.2 0.506 115.6-113.5 -81.6 -5.2 133.8 -26.0 12.7 98 106 A G S < S+ 0 0 0 -3,-1.2 -5,-0.4 24,-0.1 2,-0.3 -0.425 96.0 22.3 104.5 -59.7 134.6 -26.4 16.5 99 107 A L + 0 0 3 -2,-0.6 -5,-0.0 24,-0.1 22,-0.0 -0.975 65.6 143.7-137.7 139.1 133.2 -29.9 16.8 100 108 A Y S S+ 0 0 19 -2,-0.3 148,-0.2 -72,-0.0 4,-0.1 0.610 80.6 11.9-135.5 -63.9 132.8 -32.3 13.9 101 109 A S S > S+ 0 0 0 2,-0.1 4,-1.0 -73,-0.1 3,-0.4 0.473 104.1 86.6-104.4 -9.3 133.5 -35.9 14.7 102 110 A A H >> S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 3,-0.8 0.928 83.5 58.5 -60.6 -41.5 133.6 -35.7 18.5 103 111 A P H 3> S+ 0 0 0 0, 0.0 4,-3.0 0, 0.0 -1,-0.2 0.846 98.5 60.9 -59.8 -31.2 129.8 -36.1 18.9 104 112 A R H 3> S+ 0 0 0 -3,-0.4 4,-2.1 2,-0.2 -2,-0.2 0.913 107.3 43.2 -58.3 -43.8 130.1 -39.5 17.1 105 113 A V H S+ 0 0 0 -4,-2.5 5,-2.8 2,-0.2 -1,-0.2 0.943 111.9 47.7 -62.8 -41.7 130.2 -44.3 24.6 110 118 A R H ><5S+ 0 0 16 -4,-2.0 3,-1.9 1,-0.2 -2,-0.2 0.943 109.4 53.3 -61.5 -45.4 126.5 -43.8 25.4 111 119 A A H 3<5S+ 0 0 0 -4,-2.6 40,-2.2 1,-0.3 -1,-0.2 0.809 107.8 51.5 -60.8 -31.9 125.5 -46.7 23.0 112 120 A F T 3<5S- 0 0 1 -4,-1.8 37,-1.8 38,-0.2 -1,-0.3 0.330 127.7 -96.4 -91.6 11.0 128.0 -49.0 24.8 113 121 A G T < 5S+ 0 0 44 -3,-1.9 2,-0.7 35,-0.2 -3,-0.2 0.559 85.4 123.0 94.3 14.4 126.6 -48.2 28.2 114 122 A H < + 0 0 15 -5,-2.8 -1,-0.2 -6,-0.2 -2,-0.1 -0.855 26.3 171.4-112.9 103.9 128.9 -45.5 29.5 115 123 A H + 0 0 138 -2,-0.7 2,-2.0 1,-0.1 -1,-0.1 0.664 55.4 91.1 -90.4 -13.6 126.9 -42.4 30.3 116 124 A A + 0 0 44 -31,-0.2 -27,-2.5 -29,-0.1 2,-0.3 -0.552 65.3 120.2 -81.7 76.5 129.7 -40.3 32.1 117 125 A V E + d 0 89A 5 -2,-2.0 2,-0.3 -29,-0.2 -27,-0.2 -0.993 35.9 175.2-151.0 133.1 130.7 -38.7 28.8 118 126 A S E - 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