==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CYCLO-LIGASE 28-MAR-95 1DTS . COMPND 2 MOLECULE: DETHIOBIOTIN SYNTHETASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR W.HUANG,Y.LINDQVIST,G.SCHNEIDER . 220 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10432.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 154 70.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 15.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 2.7 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 . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 17 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 66 30.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.8 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 0 0 0 2 1 0 1 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 3 1 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 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 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 1 A S 0 0 72 0, 0.0 2,-0.3 0, 0.0 110,-0.2 0.000 360.0 360.0 360.0 159.4 12.9 40.3 26.2 2 2 A K E -a 111 0A 92 108,-2.5 110,-2.5 2,-0.0 2,-0.4 -0.712 360.0-165.2 -77.8 144.2 13.6 39.8 22.5 3 3 A R E -a 112 0A 49 -2,-0.3 2,-0.3 108,-0.2 110,-0.2 -0.994 13.1-179.9-137.7 141.8 10.4 38.5 21.0 4 4 A Y E -a 113 0A 13 108,-1.8 110,-3.3 -2,-0.4 2,-0.4 -0.998 18.9-144.1-141.3 141.4 9.8 36.8 17.6 5 5 A F E -ab 114 141A 5 135,-3.1 137,-2.8 -2,-0.3 2,-0.5 -0.889 17.3-152.3-100.9 135.9 6.7 35.5 15.9 6 6 A V E +ab 115 142A 0 108,-3.1 110,-1.2 -2,-0.4 2,-0.3 -0.934 19.2 170.2-110.1 130.9 7.2 32.3 13.7 7 7 A T E - b 0 143A 2 135,-2.3 137,-2.6 -2,-0.5 2,-0.2 -0.960 21.7-137.3-135.9 152.1 4.9 31.6 10.8 8 8 A G E - b 0 144A 7 110,-0.4 112,-0.4 -2,-0.3 137,-0.2 -0.623 14.0-132.2-104.5 165.1 5.1 29.0 8.0 9 9 A T S S+ 0 0 13 135,-1.7 2,-0.3 1,-0.3 136,-0.1 0.681 90.5 1.1 -84.0 -27.8 4.5 29.4 4.3 10 10 A D S > S- 0 0 69 134,-0.3 3,-1.3 108,-0.1 -1,-0.3 -0.970 81.4 -98.7-153.0 166.5 2.3 26.3 4.1 11 11 A T T 3 S+ 0 0 127 -2,-0.3 3,-0.5 1,-0.3 4,-0.3 0.827 115.9 51.1 -59.3 -36.6 1.0 23.7 6.5 12 12 A E T 3 S+ 0 0 138 1,-0.2 -1,-0.3 2,-0.1 0, 0.0 0.106 76.5 104.6 -94.2 27.1 3.6 21.0 5.7 13 13 A V S < S- 0 0 3 -3,-1.3 -1,-0.2 131,-0.1 -2,-0.1 0.458 89.7-114.9 -90.7 1.7 6.7 23.2 6.2 14 14 A G >> + 0 0 18 -3,-0.5 4,-2.0 3,-0.1 3,-1.1 0.815 47.8 172.1 67.8 40.5 7.8 21.7 9.6 15 15 A K H 3> S+ 0 0 32 1,-0.3 4,-2.2 -4,-0.3 5,-0.1 0.846 75.3 47.0 -52.1 -43.0 7.2 25.1 11.4 16 16 A T H 3> S+ 0 0 18 2,-0.2 4,-2.6 1,-0.2 -1,-0.3 0.787 105.2 60.6 -75.7 -20.2 7.8 23.6 14.9 17 17 A V H <> S+ 0 0 28 -3,-1.1 4,-2.1 2,-0.2 -2,-0.2 0.962 110.3 42.7 -63.9 -48.9 10.9 21.8 13.7 18 18 A A H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.903 111.9 54.6 -65.1 -37.3 12.2 25.3 13.0 19 19 A S H X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.2 -2,-0.2 0.901 109.5 46.3 -63.5 -37.2 10.8 26.6 16.3 20 20 A C H X S+ 0 0 15 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.919 112.0 52.1 -70.9 -35.5 12.7 23.9 18.3 21 21 A A H X S+ 0 0 0 -4,-2.1 4,-2.5 -5,-0.2 -2,-0.2 0.932 110.9 47.7 -65.0 -41.4 15.8 24.7 16.3 22 22 A L H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.902 112.9 47.0 -65.7 -43.7 15.4 28.4 17.1 23 23 A L H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.887 111.7 51.6 -66.7 -37.5 14.9 27.8 20.8 24 24 A Q H X S+ 0 0 46 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.935 110.9 47.0 -64.1 -44.9 17.8 25.4 21.0 25 25 A A H X S+ 0 0 10 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.925 111.4 51.5 -66.4 -38.4 20.1 28.0 19.4 26 26 A A H <>S+ 0 0 0 -4,-2.4 5,-2.0 1,-0.2 -1,-0.2 0.906 110.7 49.2 -64.8 -35.9 18.8 30.7 21.7 27 27 A K H ><5S+ 0 0 123 -4,-2.2 3,-2.3 1,-0.2 -1,-0.2 0.932 108.0 53.2 -67.8 -46.1 19.5 28.5 24.8 28 28 A A H 3<5S+ 0 0 88 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.810 103.8 57.8 -60.8 -28.8 23.0 27.7 23.5 29 29 A A T 3<5S- 0 0 61 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.509 125.2-102.6 -78.1 -2.4 23.6 31.5 23.3 30 30 A G T < 5S+ 0 0 68 -3,-2.3 2,-0.3 1,-0.3 -3,-0.2 0.702 71.9 144.4 91.9 16.7 22.8 31.8 27.0 31 31 A Y < - 0 0 67 -5,-2.0 2,-0.8 78,-0.0 -1,-0.3 -0.685 55.3-125.6 -88.4 143.3 19.2 33.2 26.8 32 32 A R - 0 0 124 -2,-0.3 78,-1.9 31,-0.1 79,-1.8 -0.863 47.9-161.5 -82.0 109.8 16.5 32.3 29.3 33 33 A T E -c 111 0A 0 -2,-0.8 31,-1.6 76,-0.2 2,-0.4 -0.724 24.8-178.0-108.9 154.1 14.0 31.1 26.7 34 34 A A E -c 112 0A 0 77,-2.0 79,-2.5 -2,-0.3 2,-0.3 -0.997 16.5-145.6-148.8 135.4 10.3 30.4 26.5 35 35 A G E -c 113 0A 0 -2,-0.4 2,-0.4 23,-0.2 79,-0.2 -0.792 17.8-168.7 -92.9 147.6 8.1 29.1 23.8 36 36 A Y E +c 114 0A 0 77,-2.0 79,-2.8 -2,-0.3 36,-0.2 -0.964 18.5 170.0-144.2 119.6 4.6 30.5 23.6 37 37 A K - 0 0 7 34,-2.9 37,-0.3 -2,-0.4 79,-0.1 -0.822 10.5-175.7-127.0 87.3 1.8 29.2 21.4 38 38 A P S S+ 0 0 0 0, 0.0 36,-2.2 0, 0.0 2,-0.4 0.848 71.5 33.3 -53.4 -39.3 -1.3 31.1 22.6 39 39 A V E +g 74 0B 0 76,-0.4 2,-0.3 34,-0.1 36,-0.2 -0.979 66.6 165.1-126.9 128.6 -3.8 29.2 20.4 40 40 A A E -g 75 0B 0 34,-1.9 36,-2.3 -2,-0.4 2,-0.3 -0.998 8.9-176.6-141.2 134.8 -3.5 25.5 19.4 41 41 A S E +g 76 0B 25 -2,-0.3 36,-0.2 34,-0.2 37,-0.1 -0.966 59.7 62.6-127.8 152.8 -6.2 23.2 17.9 42 42 A G S S+ 0 0 24 34,-1.1 11,-0.4 -2,-0.3 2,-0.3 0.851 72.3 167.4 92.5 73.1 -5.6 19.5 17.2 43 43 A S - 0 0 9 34,-1.9 2,-0.3 9,-0.2 9,-0.2 -0.910 34.6-129.9-129.4 151.6 -5.0 18.2 20.7 44 44 A E B -H 51 0C 146 7,-2.7 7,-2.0 -2,-0.3 2,-0.2 -0.729 28.8-119.4 -92.6 143.9 -4.8 14.8 22.6 45 45 A K + 0 0 154 -2,-0.3 5,-0.2 5,-0.2 -1,-0.0 -0.557 39.4 166.0 -80.3 143.4 -6.7 14.1 25.8 46 46 A T - 0 0 59 3,-0.3 3,-0.1 -2,-0.2 0, 0.0 -0.894 53.5 -92.9-140.8 179.0 -4.6 13.3 28.9 47 47 A P S S+ 0 0 138 0, 0.0 3,-0.1 0, 0.0 -1,-0.0 0.803 128.3 47.4 -63.8 -26.1 -5.4 13.2 32.8 48 48 A E S S- 0 0 160 1,-0.4 2,-0.3 -3,-0.0 -3,-0.0 0.761 124.0 -95.8 -88.6 -22.0 -4.2 16.8 33.0 49 49 A G - 0 0 29 -3,-0.1 -1,-0.4 -5,-0.0 -3,-0.3 -0.925 67.9 -16.8 141.8-163.5 -6.3 18.0 30.0 50 50 A L - 0 0 47 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.568 55.7-174.6 -77.3 131.2 -5.7 18.7 26.3 51 51 A R B -H 44 0C 53 -7,-2.0 -7,-2.7 -2,-0.3 2,-0.5 -0.986 13.0-150.7-129.2 132.2 -2.1 18.9 25.2 52 52 A N > - 0 0 6 -2,-0.4 4,-2.3 -9,-0.2 5,-0.2 -0.905 17.0-133.4-103.0 138.5 -1.1 19.8 21.7 53 53 A S H > S+ 0 0 79 -2,-0.5 4,-2.4 -11,-0.4 5,-0.1 0.850 102.6 55.1 -66.2 -35.4 2.1 18.3 20.5 54 54 A D H > S+ 0 0 59 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.949 111.1 44.9 -64.4 -44.1 3.5 21.5 19.0 55 55 A A H > S+ 0 0 0 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.911 111.1 54.7 -68.0 -36.1 3.1 23.3 22.3 56 56 A L H X S+ 0 0 56 -4,-2.3 4,-2.9 1,-0.2 -1,-0.2 0.923 107.6 50.4 -56.1 -44.7 4.6 20.3 24.1 57 57 A A H X S+ 0 0 9 -4,-2.4 4,-1.3 2,-0.2 -1,-0.2 0.911 110.8 48.2 -62.6 -38.7 7.6 20.6 21.9 58 58 A L H X S+ 0 0 1 -4,-2.0 4,-0.6 2,-0.2 -23,-0.2 0.941 112.2 50.9 -67.2 -42.0 7.9 24.4 22.7 59 59 A Q H >< S+ 0 0 48 -4,-2.9 3,-1.4 1,-0.2 7,-0.2 0.949 111.8 44.4 -60.6 -52.1 7.6 23.6 26.4 60 60 A R H 3< S+ 0 0 176 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.738 112.8 53.5 -69.5 -19.9 10.3 20.9 26.4 61 61 A N H 3< S+ 0 0 25 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.480 86.6 99.9 -93.8 -1.7 12.6 23.1 24.3 62 62 A S S << S- 0 0 11 -3,-1.4 -28,-0.2 -4,-0.6 4,-0.1 -0.559 70.5-140.4 -81.2 145.3 12.4 26.1 26.6 63 63 A S S S+ 0 0 39 -30,-0.3 2,-0.2 -2,-0.2 -1,-0.1 0.860 85.5 74.3 -76.0 -38.1 15.3 26.6 29.0 64 64 A L S S- 0 0 23 -31,-1.6 2,-0.8 1,-0.1 -2,-0.2 -0.428 92.6-115.7 -71.4 142.1 12.9 27.6 31.7 65 65 A Q + 0 0 161 -2,-0.2 2,-0.3 -31,-0.0 -2,-0.1 -0.742 48.4 177.6 -70.1 106.5 10.7 25.1 33.5 66 66 A L - 0 0 16 -2,-0.8 2,-0.1 -7,-0.2 -4,-0.1 -0.918 29.9-118.5-122.7 147.2 7.2 26.2 32.4 67 67 A D >> - 0 0 121 -2,-0.3 4,-1.2 1,-0.1 3,-0.6 -0.475 32.9-113.5 -76.0 157.9 3.7 24.9 33.1 68 68 A Y H >> S+ 0 0 12 1,-0.2 4,-2.7 2,-0.2 3,-0.9 0.912 113.5 53.6 -59.8 -47.3 1.7 23.8 30.1 69 69 A A H 34 S+ 0 0 65 1,-0.3 -1,-0.2 2,-0.2 5,-0.0 0.781 103.0 59.2 -65.8 -19.1 -1.0 26.5 30.3 70 70 A T H <4 S+ 0 0 42 -3,-0.6 -1,-0.3 1,-0.2 -2,-0.2 0.883 111.8 39.8 -73.3 -37.8 1.7 29.1 30.4 71 71 A V H << S+ 0 0 0 -4,-1.2 -34,-2.9 -3,-0.9 -2,-0.2 0.874 133.6 21.5 -76.4 -38.4 3.0 27.9 27.0 72 72 A N < + 0 0 2 -4,-2.7 -1,-0.2 -36,-0.2 -2,-0.2 -0.698 59.9 172.4-139.5 84.2 -0.5 27.3 25.6 73 73 A P S S+ 0 0 45 0, 0.0 2,-0.6 0, 0.0 -34,-0.1 0.870 75.7 48.6 -55.3 -41.2 -3.5 29.1 27.2 74 74 A Y E +g 39 0B 20 -36,-2.2 -34,-1.9 -37,-0.3 2,-0.5 -0.893 66.6 172.7-115.5 112.4 -6.0 28.0 24.5 75 75 A T E -g 40 0B 28 -2,-0.6 2,-0.4 -36,-0.2 -34,-0.2 -0.975 5.5-176.6-123.3 124.6 -6.1 24.4 23.6 76 76 A F E -g 41 0B 0 -36,-2.3 -34,-1.1 -2,-0.5 -33,-0.1 -0.925 20.5-145.8-123.1 144.7 -8.8 22.9 21.3 77 77 A A S S+ 0 0 26 -2,-0.4 -34,-1.9 -35,-0.2 -1,-0.1 0.968 76.5 74.9 -78.9 -50.1 -9.1 19.2 20.4 78 78 A E S S- 0 0 89 -36,-0.2 2,-2.1 -37,-0.1 -36,-0.3 -0.405 80.5-129.4 -69.4 133.8 -10.3 19.3 16.8 79 79 A P + 0 0 108 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.354 69.8 106.6 -76.5 62.0 -7.7 20.3 14.2 80 80 A T S S- 0 0 39 -2,-2.1 -4,-0.1 1,-0.1 0, 0.0 -0.663 82.4 -53.5-128.4-174.4 -9.7 23.0 12.4 81 81 A S >> - 0 0 32 -2,-0.2 4,-1.8 1,-0.1 3,-1.1 -0.375 49.2-126.9 -61.3 138.6 -9.6 26.8 12.3 82 82 A P H 3> S+ 0 0 1 0, 0.0 4,-2.9 0, 0.0 5,-0.3 0.881 108.1 58.3 -57.9 -39.2 -9.6 28.4 15.9 83 83 A H H 3> S+ 0 0 49 40,-1.7 4,-1.4 1,-0.2 5,-0.1 0.855 107.9 47.9 -63.0 -27.2 -12.6 30.7 15.1 84 84 A I H <> S+ 0 0 77 -3,-1.1 4,-2.7 39,-0.2 -1,-0.2 0.980 117.4 37.7 -75.9 -56.0 -14.7 27.6 14.2 85 85 A I H X S+ 0 0 4 -4,-1.8 4,-3.0 2,-0.2 6,-0.3 0.878 114.6 55.4 -69.9 -31.7 -13.9 25.5 17.3 86 86 A S H X>S+ 0 0 11 -4,-2.9 5,-2.0 -5,-0.3 4,-1.1 0.929 112.5 43.9 -59.4 -44.1 -13.9 28.5 19.6 87 87 A A H <5S+ 0 0 77 -4,-1.4 3,-0.4 -5,-0.3 -2,-0.2 0.922 114.9 49.2 -73.2 -38.8 -17.4 29.4 18.4 88 88 A Q H <5S+ 0 0 142 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.917 116.3 41.5 -65.3 -43.0 -18.5 25.7 18.6 89 89 A E H <5S- 0 0 89 -4,-3.0 -1,-0.2 -5,-0.1 -2,-0.2 0.586 107.1-121.8 -80.5 -12.3 -17.1 25.3 22.2 90 90 A G T <5S+ 0 0 63 -4,-1.1 -3,-0.2 -3,-0.4 -4,-0.1 0.789 71.4 126.4 75.3 29.6 -18.4 28.7 23.5 91 91 A R < - 0 0 152 -5,-2.0 -1,-0.2 -6,-0.3 -2,-0.1 -0.868 50.9-146.7-124.7 98.5 -14.9 29.8 24.5 92 92 A P - 0 0 87 0, 0.0 2,-0.8 0, 0.0 33,-0.1 -0.325 15.0-128.3 -57.4 138.8 -13.9 33.3 23.0 93 93 A I - 0 0 14 31,-0.4 2,-0.6 -10,-0.0 3,-0.1 -0.840 30.5-150.9 -92.9 114.2 -10.2 33.7 22.2 94 94 A E > - 0 0 97 -2,-0.8 4,-2.0 1,-0.1 3,-0.3 -0.823 16.9-151.5 -94.2 122.5 -9.4 36.9 23.9 95 95 A S H > S+ 0 0 22 -2,-0.6 4,-2.9 1,-0.2 5,-0.2 0.891 99.6 54.6 -55.6 -41.9 -6.7 39.3 22.6 96 96 A L H > S+ 0 0 125 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.887 108.3 48.3 -65.1 -34.4 -6.0 40.5 26.2 97 97 A V H > S+ 0 0 65 -3,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.898 111.1 50.6 -71.7 -39.6 -5.4 36.9 27.5 98 98 A M H X S+ 0 0 0 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.957 115.5 43.5 -60.7 -47.2 -3.1 36.2 24.6 99 99 A S H X S+ 0 0 11 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.912 112.1 51.6 -67.8 -37.3 -1.2 39.5 25.4 100 100 A A H X S+ 0 0 57 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.900 107.1 54.6 -63.8 -38.8 -1.2 38.8 29.2 101 101 A G H X S+ 0 0 15 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.892 108.1 48.7 -65.8 -37.7 0.3 35.4 28.6 102 102 A L H X S+ 0 0 0 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.948 111.1 50.3 -66.4 -45.2 3.1 36.9 26.6 103 103 A R H X S+ 0 0 88 -4,-2.3 4,-1.2 2,-0.2 -2,-0.2 0.919 106.9 54.7 -55.9 -42.7 3.8 39.5 29.4 104 104 A A H >< S+ 0 0 36 -4,-2.6 3,-0.7 1,-0.3 -1,-0.2 0.931 109.4 48.1 -61.9 -40.8 3.9 36.7 32.0 105 105 A L H >X S+ 0 0 0 -4,-1.8 4,-2.8 1,-0.2 3,-1.4 0.866 105.5 59.7 -66.7 -34.1 6.6 35.0 29.9 106 106 A E H 3< S+ 0 0 49 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.693 96.6 60.2 -69.5 -19.1 8.5 38.3 29.6 107 107 A Q T << S+ 0 0 159 -4,-1.2 -1,-0.3 -3,-0.7 -2,-0.2 0.533 119.9 26.7 -85.2 0.9 8.9 38.6 33.4 108 108 A Q T <4 S+ 0 0 74 -3,-1.4 2,-0.3 1,-0.2 -2,-0.2 0.610 119.1 48.8-122.9 -36.8 10.8 35.3 33.4 109 109 A A < - 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