==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 02-SEP-09 3IVX . COMPND 2 MOLECULE: PANTOTHENATE SYNTHETASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR H.L.SILVESTRE,A.W.HUNG,S.WEN,A.CIULLI,T.L.BLUNDELL,C.ABELL . 565 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23308.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 393 69.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 53 9.4 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 . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 42 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 64 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 170 30.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.1 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 3 0 0 0 0 0 2 2 0 5 1 0 2 0 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 4 0 2 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 PARALLEL BRIDGES PER LADDER . 3 0 1 0 0 0 1 0 1 1 1 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 1 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 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 I 0 0 133 0, 0.0 3,-0.1 0, 0.0 16,-0.1 0.000 360.0 360.0 360.0 122.4 -5.1 21.8 20.0 2 4 A P - 0 0 30 0, 0.0 2,-0.1 0, 0.0 10,-0.0 -0.203 360.0 -70.6 -69.5 170.0 -2.8 24.4 18.5 3 5 A A - 0 0 65 2,-0.0 2,-0.4 1,-0.0 18,-0.1 -0.425 48.7-171.9 -62.3 132.7 -3.9 26.7 15.6 4 6 A F - 0 0 41 -2,-0.1 94,-0.1 -3,-0.1 5,-0.0 -0.970 5.5-165.6-126.8 118.2 -4.2 25.0 12.2 5 7 A H > - 0 0 101 -2,-0.4 3,-1.5 92,-0.2 5,-0.0 -0.892 18.9-136.9-103.5 107.1 -4.8 27.1 9.2 6 8 A P T 3 S+ 0 0 86 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 -0.214 87.5 25.5 -56.9 148.7 -6.0 25.0 6.2 7 9 A G T 3 S+ 0 0 68 1,-0.2 2,-0.3 88,-0.1 88,-0.0 0.335 110.8 87.9 78.3 -7.9 -4.5 25.9 2.8 8 10 A E S < S- 0 0 118 -3,-1.5 2,-0.8 89,-0.1 -1,-0.2 -0.770 87.6 -99.7-118.4 163.5 -1.3 27.3 4.5 9 11 A L - 0 0 27 -2,-0.3 2,-0.5 -3,-0.1 89,-0.2 -0.795 37.9-168.2 -83.8 109.6 2.0 25.8 5.8 10 12 A N E -a 98 0A 10 87,-2.3 89,-2.3 -2,-0.8 2,-0.5 -0.908 5.4-157.1 -99.4 123.7 1.6 25.3 9.5 11 13 A V E -a 99 0A 63 -2,-0.5 2,-0.4 87,-0.2 89,-0.2 -0.914 11.2-176.8-110.8 121.5 4.9 24.6 11.2 12 14 A Y E +a 100 0A 14 87,-2.7 89,-2.7 -2,-0.5 -2,-0.0 -0.956 16.9 177.1-118.1 133.7 5.0 22.7 14.6 13 15 A S + 0 0 62 -2,-0.4 90,-0.4 87,-0.2 -1,-0.1 0.758 62.9 82.4 -98.0 -35.5 8.1 22.0 16.7 14 16 A A S >> S- 0 0 41 1,-0.2 4,-1.7 88,-0.1 3,-0.6 -0.549 71.4-143.7 -73.7 126.6 6.4 20.3 19.7 15 17 A P H 3> S+ 0 0 22 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.900 103.2 55.1 -52.0 -40.7 5.6 16.6 19.2 16 18 A G H 3> S+ 0 0 40 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.822 104.4 54.8 -62.9 -34.3 2.4 17.2 21.3 17 19 A D H <> S+ 0 0 64 -3,-0.6 4,-2.5 2,-0.2 5,-0.2 0.958 112.3 39.8 -63.5 -51.9 1.3 20.0 18.9 18 20 A V H X S+ 0 0 0 -4,-1.7 4,-3.1 1,-0.2 -2,-0.2 0.895 114.6 55.0 -69.0 -33.0 1.5 18.0 15.7 19 21 A A H X S+ 0 0 31 -4,-2.4 4,-2.4 -5,-0.3 -1,-0.2 0.908 110.7 45.4 -61.8 -41.8 0.0 14.9 17.5 20 22 A D H X S+ 0 0 67 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.935 115.7 44.6 -71.6 -46.1 -3.0 17.0 18.6 21 23 A V H X S+ 0 0 2 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.924 112.8 52.8 -61.3 -46.0 -3.5 18.6 15.2 22 24 A S H X S+ 0 0 0 -4,-3.1 4,-2.4 -5,-0.2 -2,-0.2 0.943 112.2 44.2 -56.2 -49.4 -3.1 15.2 13.5 23 25 A R H X S+ 0 0 110 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.896 112.0 52.4 -65.7 -42.6 -5.7 13.5 15.7 24 26 A A H X S+ 0 0 26 -4,-2.5 4,-0.8 1,-0.2 -1,-0.2 0.938 111.5 47.5 -57.6 -47.4 -8.1 16.4 15.4 25 27 A L H ><>S+ 0 0 14 -4,-2.8 5,-1.9 1,-0.2 3,-1.0 0.906 108.6 53.9 -59.4 -45.6 -7.8 16.3 11.5 26 28 A R H ><5S+ 0 0 73 -4,-2.4 3,-1.2 1,-0.3 -1,-0.2 0.847 105.6 54.0 -60.0 -35.8 -8.3 12.5 11.5 27 29 A L H 3<5S+ 0 0 115 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.686 102.8 57.2 -72.9 -18.8 -11.5 12.8 13.5 28 30 A T T <<5S- 0 0 99 -3,-1.0 -1,-0.3 -4,-0.8 -2,-0.2 0.294 127.3 -98.0 -92.1 8.8 -12.9 15.3 10.9 29 31 A G T < 5S+ 0 0 63 -3,-1.2 2,-0.2 1,-0.3 -3,-0.2 0.335 80.0 135.2 93.0 -5.5 -12.4 12.7 8.1 30 32 A R < - 0 0 63 -5,-1.9 2,-0.5 28,-0.1 -1,-0.3 -0.533 51.7-132.9 -75.9 142.5 -9.1 13.9 6.7 31 33 A R E -b 58 0A 87 26,-1.2 28,-2.6 -2,-0.2 2,-0.5 -0.855 18.6-134.5 -96.8 132.1 -6.5 11.2 6.1 32 34 A V E -b 59 0A 0 -2,-0.5 119,-2.7 26,-0.2 120,-1.3 -0.730 18.6-167.6 -95.9 126.3 -3.1 12.0 7.4 33 35 A M E -bc 60 152A 0 26,-2.8 28,-3.3 -2,-0.5 2,-0.5 -0.918 5.9-156.1-112.0 133.8 -0.1 11.4 5.1 34 36 A L E -bc 61 153A 1 118,-2.3 120,-2.5 -2,-0.4 28,-0.2 -0.955 13.4-176.5-115.0 128.7 3.5 11.4 6.5 35 37 A V E -b 62 0A 0 26,-2.5 28,-2.0 -2,-0.5 2,-0.4 -0.920 17.6-158.7-117.0 100.1 6.6 12.1 4.5 36 38 A P E +b 63 0A 4 0, 0.0 2,-0.3 0, 0.0 28,-0.1 -0.690 21.8 163.4 -84.1 129.5 9.6 11.7 6.8 37 39 A T E -b 64 0A 4 26,-1.9 28,-1.8 -2,-0.4 3,-0.1 -0.891 47.8-136.3-137.9 164.2 12.7 13.5 5.7 38 40 A M - 0 0 12 1,-0.5 26,-0.1 -2,-0.3 28,-0.1 -0.018 60.7-118.2-106.8 25.5 16.1 14.7 7.1 39 41 A G S S+ 0 0 2 24,-0.4 -1,-0.5 1,-0.1 3,-0.1 -0.251 82.2 113.3 69.5-158.6 15.5 18.0 5.2 40 42 A A - 0 0 1 1,-0.1 -1,-0.1 -3,-0.1 -2,-0.1 0.973 68.1-151.9 55.2 54.7 17.8 19.3 2.3 41 43 A L + 0 0 13 42,-0.2 2,-0.2 3,-0.1 -1,-0.1 -0.314 24.4 174.3 -74.4 135.4 14.8 18.7 0.1 42 44 A H >> - 0 0 26 -3,-0.1 4,-1.8 525,-0.1 3,-0.8 -0.732 52.7 -79.8-123.6-179.2 15.1 17.9 -3.6 43 45 A E H 3> S+ 0 0 79 1,-0.2 4,-1.7 -2,-0.2 5,-0.1 0.741 125.5 63.6 -53.8 -28.3 12.7 16.9 -6.4 44 46 A G H 3> S+ 0 0 0 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.928 104.3 45.2 -63.8 -47.5 12.8 13.3 -5.0 45 47 A H H <> S+ 0 0 2 -3,-0.8 4,-2.3 2,-0.2 3,-0.2 0.880 109.4 56.6 -57.7 -41.5 11.2 14.4 -1.8 46 48 A L H X S+ 0 0 6 -4,-1.8 4,-2.7 1,-0.2 -2,-0.2 0.848 102.2 55.7 -64.8 -30.8 8.7 16.6 -3.8 47 49 A A H X S+ 0 0 19 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.843 107.0 50.0 -64.6 -37.4 7.6 13.4 -5.6 48 50 A L H X S+ 0 0 1 -4,-1.2 4,-2.1 -3,-0.2 -2,-0.2 0.942 111.4 48.9 -64.0 -49.2 6.9 11.8 -2.2 49 51 A V H X S+ 0 0 2 -4,-2.3 4,-3.1 1,-0.2 -2,-0.2 0.918 110.9 50.2 -53.9 -47.9 4.8 15.0 -1.3 50 52 A R H X S+ 0 0 75 -4,-2.7 4,-1.6 2,-0.2 -1,-0.2 0.910 108.2 51.9 -62.7 -38.7 3.0 14.8 -4.6 51 53 A A H < S+ 0 0 12 -4,-2.1 4,-0.3 1,-0.2 -1,-0.2 0.891 114.2 44.6 -62.5 -40.7 2.1 11.1 -4.1 52 54 A A H >< S+ 0 0 0 -4,-2.1 3,-1.3 1,-0.2 -2,-0.2 0.895 108.6 56.5 -69.5 -44.2 0.7 12.0 -0.7 53 55 A K H 3< S+ 0 0 118 -4,-3.1 5,-0.3 1,-0.2 -1,-0.2 0.805 101.2 60.1 -56.0 -33.3 -1.1 15.1 -2.0 54 56 A R T 3< S+ 0 0 180 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.592 75.5 101.6 -81.6 -9.6 -3.0 12.9 -4.5 55 57 A V S X S- 0 0 11 -3,-1.3 3,-1.9 -4,-0.3 -24,-0.1 -0.625 90.2-102.6 -71.6 124.2 -4.6 10.6 -1.8 56 58 A P T 3 S+ 0 0 95 0, 0.0 -25,-0.2 0, 0.0 -1,-0.1 -0.216 98.7 3.7 -59.4 134.1 -8.2 12.0 -1.7 57 59 A G T 3 S+ 0 0 50 1,-0.2 -26,-1.2 -4,-0.1 -3,-0.1 0.604 96.4 158.0 72.1 11.7 -9.0 14.2 1.4 58 60 A S E < -b 31 0A 16 -3,-1.9 2,-0.4 -5,-0.3 -26,-0.2 -0.299 35.8-157.5 -70.1 149.7 -5.4 14.0 2.5 59 61 A V E -b 32 0A 0 -28,-2.6 -26,-2.8 37,-0.0 2,-0.6 -0.992 22.9-139.7-116.1 133.2 -3.6 16.4 4.8 60 62 A V E -b 33 0A 5 -2,-0.4 38,-1.5 -28,-0.2 2,-0.5 -0.857 16.1-169.6-104.5 125.5 0.2 16.1 4.3 61 63 A V E -bd 34 98A 0 -28,-3.3 -26,-2.5 -2,-0.6 2,-0.5 -0.950 4.6-167.0-105.7 121.7 2.6 16.2 7.2 62 64 A V E -bd 35 99A 0 36,-3.1 38,-2.4 -2,-0.5 2,-0.4 -0.952 8.8-154.8-108.2 120.9 6.3 16.6 6.2 63 65 A S E -bd 36 100A 0 -28,-2.0 -26,-1.9 -2,-0.5 2,-0.4 -0.796 8.1-169.0 -94.2 139.1 8.7 15.9 9.0 64 66 A I E +b 37 0A 27 36,-2.7 2,-0.3 -2,-0.4 -26,-0.2 -0.947 26.5 140.4-125.6 111.4 12.2 17.4 8.9 65 67 A F - 0 0 12 -28,-1.8 2,-1.0 -2,-0.4 -26,-0.1 -0.918 43.9-145.1-155.5 119.6 14.6 16.0 11.5 66 68 A V - 0 0 24 -2,-0.3 -28,-0.1 -28,-0.1 -2,-0.0 -0.778 31.4-143.6 -88.7 106.4 18.3 15.2 11.2 67 69 A N > - 0 0 1 -2,-1.0 3,-1.7 1,-0.2 4,-0.2 -0.615 15.0-163.3 -86.9 107.5 18.3 12.2 13.4 68 70 A P G > S+ 0 0 37 0, 0.0 3,-1.3 0, 0.0 -1,-0.2 0.755 83.0 70.7 -59.2 -20.8 21.6 12.0 15.4 69 71 A M G 3 S+ 0 0 12 1,-0.3 67,-0.3 67,-0.2 68,-0.2 0.640 93.4 53.5 -75.7 -14.4 20.9 8.4 16.3 70 72 A Q G < S+ 0 0 20 -3,-1.7 2,-0.4 66,-0.3 -1,-0.3 0.334 92.2 88.9-101.8 7.1 21.5 7.1 12.7 71 73 A F < - 0 0 32 -3,-1.3 4,-0.1 -4,-0.2 59,-0.0 -0.841 50.7-179.3-104.5 142.8 25.0 8.7 12.4 72 74 A G + 0 0 71 -2,-0.4 -1,-0.2 2,-0.1 3,-0.1 0.981 48.8 59.9 -59.9 -90.4 28.2 6.9 13.4 73 75 A A S S- 0 0 69 1,-0.2 -1,-0.0 0, 0.0 2,-0.0 -0.455 84.5 -88.9-161.6 -40.2 30.7 8.5 13.0 74 76 A G S S+ 0 0 68 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 0.529 108.5 6.3 90.7 105.7 32.5 11.7 14.0 75 77 A G S > S+ 0 0 40 1,-0.1 4,-2.5 -3,-0.1 5,-0.2 -0.008 100.5 95.0 90.3 -33.2 31.7 14.5 11.6 76 78 A D H > S+ 0 0 79 -2,-0.4 4,-1.1 2,-0.2 -1,-0.1 0.922 89.8 47.4 -56.0 -48.1 29.0 12.9 9.5 77 79 A L H >4 S+ 0 0 56 1,-0.2 3,-0.9 2,-0.2 -1,-0.2 0.964 115.9 44.0 -56.4 -56.0 26.3 14.4 11.8 78 80 A D H 34 S+ 0 0 139 1,-0.2 -2,-0.2 3,-0.0 -1,-0.2 0.823 114.0 51.8 -57.9 -33.7 27.9 17.8 11.6 79 81 A A H 3< S+ 0 0 59 -4,-2.5 -1,-0.2 2,-0.1 -2,-0.2 0.613 78.3 118.6 -82.3 -15.1 28.5 17.6 7.8 80 82 A Y S << S- 0 0 30 -4,-1.1 2,-0.1 -3,-0.9 -40,-0.1 -0.260 76.8-103.1 -57.6 133.7 24.9 16.7 6.9 81 83 A P - 0 0 9 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.386 37.9-170.4 -64.4 132.8 23.4 19.3 4.6 82 84 A R + 0 0 120 -2,-0.1 -43,-0.1 -3,-0.1 -44,-0.0 -0.977 21.2 155.1-127.2 114.5 21.1 21.7 6.4 83 85 A T > + 0 0 40 -2,-0.5 4,-2.3 1,-0.1 -42,-0.2 -0.429 6.2 161.5-138.1 61.1 19.0 24.1 4.2 84 86 A P H > S+ 0 0 78 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.783 72.3 54.8 -50.4 -42.4 15.9 24.9 6.3 85 87 A D H > S+ 0 0 140 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.955 111.6 42.5 -67.4 -50.8 14.9 28.1 4.4 86 88 A D H > S+ 0 0 104 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.917 111.6 58.5 -56.4 -45.8 14.8 26.3 1.0 87 89 A D H X S+ 0 0 4 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.945 108.9 41.1 -51.7 -57.2 13.0 23.3 2.6 88 90 A L H X S+ 0 0 40 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.833 112.3 56.7 -62.8 -35.9 10.0 25.3 3.9 89 91 A A H X S+ 0 0 48 -4,-1.7 4,-2.9 -5,-0.2 -1,-0.2 0.919 107.6 48.6 -57.6 -48.5 9.8 27.3 0.7 90 92 A Q H X S+ 0 0 54 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.898 110.7 50.4 -60.6 -40.2 9.5 24.1 -1.3 91 93 A L H <>S+ 0 0 0 -4,-2.0 5,-2.3 2,-0.2 4,-0.5 0.923 110.9 48.7 -66.3 -43.6 6.8 22.8 1.0 92 94 A R H ><5S+ 0 0 145 -4,-2.6 3,-1.7 1,-0.2 -2,-0.2 0.954 110.5 52.0 -56.4 -49.6 4.9 26.1 0.7 93 95 A A H 3<5S+ 0 0 84 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.903 110.4 48.7 -53.5 -43.1 5.3 25.9 -3.1 94 96 A E T 3<5S- 0 0 39 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.454 115.1-114.7 -80.2 -3.9 3.9 22.3 -3.1 95 97 A G T < 5 + 0 0 36 -3,-1.7 -3,-0.2 -4,-0.5 -35,-0.2 0.696 53.1 167.1 79.3 19.1 0.8 23.3 -0.9 96 98 A V < - 0 0 3 -5,-2.3 -1,-0.2 -6,-0.2 3,-0.1 -0.445 23.3-160.8 -65.4 134.1 1.9 21.2 2.1 97 99 A E + 0 0 26 -37,-0.5 -87,-2.3 1,-0.2 2,-0.4 0.666 68.3 40.8 -93.3 -18.5 -0.2 22.1 5.2 98 100 A I E -ad 10 61A 0 -38,-1.5 -36,-3.1 -89,-0.2 2,-0.4 -0.977 51.1-179.9-136.7 124.4 2.0 20.7 8.0 99 101 A A E -ad 11 62A 0 -89,-2.3 -87,-2.7 -2,-0.4 2,-0.6 -0.982 14.3-158.5-111.2 136.8 5.8 20.7 8.6 100 102 A F E +ad 12 63A 0 -38,-2.4 -36,-2.7 -2,-0.4 -87,-0.2 -0.960 16.4 171.7-116.2 113.3 6.9 19.0 11.8 101 103 A T - 0 0 37 -89,-2.7 -36,-0.1 -2,-0.6 -38,-0.1 -0.638 12.8-175.6-126.7 71.5 10.4 20.2 12.8 102 104 A P - 0 0 11 0, 0.0 2,-0.1 0, 0.0 -88,-0.1 -0.314 23.2-118.5 -72.9 155.0 11.1 18.9 16.2 103 105 A T > - 0 0 76 -90,-0.4 4,-1.6 1,-0.1 5,-0.2 -0.450 24.3-115.2 -77.4 158.8 14.2 19.7 18.3 104 106 A T H > S+ 0 0 76 1,-0.2 4,-2.9 2,-0.2 3,-0.1 0.915 118.0 55.8 -59.1 -43.1 16.7 16.9 19.3 105 107 A A H 4 S+ 0 0 71 1,-0.2 -1,-0.2 2,-0.2 6,-0.1 0.875 106.8 49.1 -56.2 -41.1 15.7 17.6 23.0 106 108 A A H 4 S+ 0 0 33 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.843 116.8 41.3 -70.6 -32.3 12.0 17.0 22.2 107 109 A M H < S+ 0 0 1 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.841 130.6 24.4 -82.1 -37.0 12.7 13.7 20.4 108 110 A Y >< + 0 0 30 -4,-2.9 3,-2.0 -5,-0.2 -1,-0.2 -0.385 66.5 150.5-127.1 54.8 15.4 12.4 22.8 109 111 A P T 3 S+ 0 0 91 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.770 85.7 38.8 -62.4 -20.0 14.7 14.0 26.2 110 112 A D T 3 S- 0 0 88 1,-0.4 -5,-0.1 -3,-0.1 2,-0.1 0.198 109.8-128.5-110.8 17.0 16.1 10.9 27.9 111 113 A G < - 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