==== 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 TRANSFERASE 23-OCT-05 2BE9 . COMPND 2 MOLECULE: ASPARTATE CARBAMOYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SULFOLOBUS ACIDOCALDARIUS; . AUTHOR D.DE VOS,S.N.SAVVIDES,J.J.VAN BEEUMEN . 441 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20787.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 309 70.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 47 10.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 47 10.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 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 . 38 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 54 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 109 24.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 2 1 1 3 0 1 1 0 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 1 3 2 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 . 1 0 2 1 2 1 0 1 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 1 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 0 A M 0 0 160 0, 0.0 2,-0.1 0, 0.0 290,-0.1 0.000 360.0 360.0 360.0 145.6 95.3 36.4 75.2 2 1 A L + 0 0 11 1,-0.2 3,-0.1 288,-0.1 9,-0.0 -0.368 360.0 136.3 -61.8 135.2 92.6 35.6 72.6 3 2 A K + 0 0 95 1,-0.6 2,-0.4 111,-0.1 -1,-0.2 0.253 61.7 35.9-139.4 -79.6 90.7 38.5 71.1 4 3 A H - 0 0 43 109,-0.2 2,-0.8 111,-0.1 -1,-0.6 -0.688 65.5-154.9 -81.3 133.9 90.2 38.6 67.4 5 4 A I B +a 115 0A 0 109,-2.7 111,-3.3 -2,-0.4 121,-0.2 -0.769 44.7 131.0-108.3 89.1 89.6 35.1 65.9 6 5 A I + 0 0 30 -2,-0.8 2,-0.3 1,-0.3 -1,-0.2 0.816 64.2 25.5-109.3 -36.6 90.7 35.5 62.3 7 6 A S S > S- 0 0 18 -3,-0.2 3,-1.9 117,-0.1 -1,-0.3 -0.922 71.5-119.9-125.6 152.8 93.1 32.6 61.6 8 7 A A G > S+ 0 0 0 -2,-0.3 3,-1.6 1,-0.3 -1,-0.1 0.815 114.1 71.4 -53.3 -27.0 93.5 29.1 62.9 9 8 A Y G 3 S+ 0 0 68 1,-0.3 -1,-0.3 -3,-0.0 -4,-0.0 0.713 77.3 76.3 -65.0 -21.6 97.0 30.5 63.7 10 9 A N G < S+ 0 0 55 -3,-1.9 2,-0.3 2,-0.0 -1,-0.3 0.722 85.3 78.7 -56.9 -24.9 95.5 32.7 66.5 11 10 A F < - 0 0 1 -3,-1.6 2,-0.2 -4,-0.3 3,-0.0 -0.702 66.8-155.0 -91.3 137.2 95.3 29.6 68.7 12 11 A S > - 0 0 44 -2,-0.3 4,-2.1 1,-0.1 5,-0.2 -0.606 35.5-106.8 -93.8 167.8 98.2 28.1 70.5 13 12 A R H > S+ 0 0 90 1,-0.2 4,-2.1 -2,-0.2 5,-0.2 0.910 123.1 53.9 -57.7 -42.0 98.3 24.4 71.5 14 13 A D H > S+ 0 0 128 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.873 107.0 48.8 -58.7 -42.2 97.7 25.6 75.1 15 14 A E H > S+ 0 0 38 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.908 110.1 52.4 -70.8 -36.3 94.6 27.6 74.2 16 15 A L H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.917 108.2 49.2 -63.1 -43.7 93.1 24.6 72.2 17 16 A E H X S+ 0 0 68 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.920 111.9 50.4 -64.2 -40.6 93.5 22.2 75.1 18 17 A D H X S+ 0 0 75 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.889 110.0 50.0 -59.3 -43.6 91.8 24.7 77.3 19 18 A I H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.876 107.5 54.0 -65.1 -39.6 89.0 25.1 74.8 20 19 A F H X S+ 0 0 4 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.941 109.4 48.2 -60.3 -48.2 88.6 21.3 74.7 21 20 A A H X S+ 0 0 56 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.911 112.7 47.6 -58.0 -44.4 88.2 21.1 78.4 22 21 A L H X S+ 0 0 23 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.916 110.7 52.5 -66.0 -39.8 85.7 24.0 78.4 23 22 A T H X S+ 0 0 0 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.921 107.0 51.9 -58.6 -48.0 83.8 22.3 75.6 24 23 A D H X S+ 0 0 74 -4,-2.8 4,-1.5 1,-0.2 -2,-0.2 0.933 112.1 47.9 -50.0 -50.0 83.7 19.0 77.7 25 24 A K H < S+ 0 0 117 -4,-2.4 5,-0.5 1,-0.2 3,-0.2 0.927 114.4 43.6 -58.6 -47.8 82.2 21.1 80.5 26 25 A Y H < S+ 0 0 18 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.749 106.8 62.9 -73.0 -27.7 79.6 22.9 78.3 27 26 A S H < S+ 0 0 43 -4,-2.5 2,-2.5 1,-0.2 -1,-0.2 0.873 88.8 66.5 -56.8 -48.8 78.7 19.6 76.5 28 27 A K S < S- 0 0 111 -4,-1.5 2,-3.0 -3,-0.2 -1,-0.2 -0.507 102.0-140.4 -76.5 71.8 77.4 18.0 79.7 29 28 A N - 0 0 85 -2,-2.5 -3,-0.1 2,-0.1 -1,-0.1 -0.003 29.0-179.5 -51.8 53.1 74.7 20.7 79.4 30 29 A L > - 0 0 96 -2,-3.0 3,-0.7 -5,-0.5 -1,-0.1 -0.052 32.9-129.6 -51.6 149.4 74.4 21.7 83.1 31 30 A N T 3 S+ 0 0 168 1,-0.2 -1,-0.1 0, 0.0 -2,-0.1 0.289 99.2 67.7 -88.1 12.2 71.8 24.5 83.8 32 31 A D T 3 + 0 0 118 2,-0.1 -1,-0.2 3,-0.0 2,-0.1 -0.038 63.0 149.5-119.7 32.2 74.3 26.5 85.8 33 32 A T < - 0 0 38 -3,-0.7 2,-0.3 1,-0.1 -7,-0.0 -0.430 58.7-100.7 -64.0 137.3 76.8 27.6 83.1 34 33 A R - 0 0 203 1,-0.1 2,-2.3 -2,-0.1 3,-0.2 -0.454 26.2-133.7 -65.9 121.9 78.3 30.9 83.9 35 34 A K > + 0 0 115 -2,-0.3 3,-2.4 1,-0.2 -1,-0.1 -0.339 38.8 163.4 -77.9 64.0 76.6 33.8 82.0 36 35 A I T 3 S+ 0 0 37 -2,-2.3 -1,-0.2 1,-0.3 29,-0.1 0.649 72.2 51.7 -60.9 -18.3 79.9 35.5 80.8 37 36 A L T > S+ 0 0 0 27,-2.7 3,-2.2 24,-0.2 30,-0.3 0.236 76.0 138.5-102.1 13.8 78.0 37.5 78.1 38 37 A S T < S+ 0 0 85 -3,-2.4 28,-0.2 26,-0.4 3,-0.1 -0.363 76.9 12.4 -60.9 131.7 75.4 38.9 80.4 39 38 A G T 3 S+ 0 0 67 26,-0.6 2,-0.3 1,-0.3 -1,-0.3 0.579 108.8 113.3 74.7 10.3 74.7 42.6 79.6 40 39 A K < - 0 0 81 -3,-2.2 27,-2.9 25,-0.3 2,-0.5 -0.872 55.7-148.6-116.4 147.5 76.7 42.2 76.4 41 40 A T E -b 67 0A 32 -2,-0.3 50,-4.0 25,-0.2 51,-0.6 -0.971 8.5-166.2-115.9 119.5 75.5 42.4 72.8 42 41 A I E -bc 68 92A 1 25,-2.6 27,-1.6 -2,-0.5 2,-0.4 -0.910 13.1-145.2 -97.9 130.8 77.2 40.3 70.1 43 42 A S E -bc 69 93A 0 49,-2.6 51,-2.7 -2,-0.5 2,-0.7 -0.835 1.4-152.8 -97.8 135.5 76.4 41.3 66.5 44 43 A I E -bc 70 94A 0 25,-2.7 27,-2.3 -2,-0.4 2,-0.9 -0.912 14.5-175.1-108.6 101.0 76.3 38.5 63.9 45 44 A A E +bc 71 95A 0 49,-2.4 51,-1.6 -2,-0.7 2,-1.2 -0.788 6.5 175.2-105.6 87.3 77.2 40.2 60.5 46 45 A F E +bc 72 96A 0 25,-2.5 27,-2.1 -2,-0.9 51,-0.2 -0.697 8.7 166.5-101.4 83.0 76.7 37.6 57.9 47 46 A F S S+ 0 0 37 49,-1.6 50,-0.2 -2,-1.2 -1,-0.2 0.860 82.3 44.2 -62.3 -38.3 77.4 39.5 54.7 48 47 A E S S- 0 0 44 48,-1.5 2,-0.1 -3,-0.2 -1,-0.1 -0.948 107.4-121.1-101.9 124.0 77.5 36.2 53.0 49 48 A P + 0 0 79 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 -0.464 42.0 158.4 -69.6 140.8 74.6 34.1 54.4 50 49 A S > - 0 0 20 -2,-0.1 4,-2.0 -4,-0.1 5,-0.1 -0.701 15.6-172.2-153.1 112.8 75.0 30.8 56.2 51 50 A T H > S+ 0 0 96 -2,-0.2 4,-2.6 2,-0.2 5,-0.3 0.896 84.3 56.3 -73.5 -40.1 72.1 29.8 58.4 52 51 A R H > S+ 0 0 128 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.950 115.8 36.8 -53.3 -51.8 73.8 26.8 60.0 53 52 A T H > S+ 0 0 11 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.837 114.0 57.6 -75.7 -31.9 76.7 28.9 61.3 54 53 A Y H X S+ 0 0 36 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.963 110.8 42.2 -55.3 -51.7 74.5 31.8 62.1 55 54 A L H X S+ 0 0 92 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.828 109.2 58.6 -72.3 -35.5 72.4 29.8 64.4 56 55 A S H X S+ 0 0 17 -4,-1.8 4,-2.4 -5,-0.3 -1,-0.2 0.948 111.2 40.9 -57.3 -51.8 75.3 28.0 66.0 57 56 A F H X S+ 0 0 1 -4,-1.9 4,-3.0 2,-0.2 -2,-0.2 0.930 113.6 53.5 -66.4 -42.9 76.9 31.3 67.1 58 57 A Q H X S+ 0 0 61 -4,-2.4 4,-3.0 -5,-0.2 -2,-0.2 0.941 110.7 46.6 -56.6 -47.4 73.5 32.7 68.2 59 58 A K H X S+ 0 0 101 -4,-2.8 4,-3.0 2,-0.2 -1,-0.2 0.934 111.0 52.4 -62.0 -48.0 72.8 29.7 70.4 60 59 A A H X S+ 0 0 0 -4,-2.4 4,-0.9 2,-0.2 -1,-0.2 0.927 112.9 45.2 -45.2 -52.3 76.3 29.9 71.8 61 60 A I H ><>S+ 0 0 0 -4,-3.0 5,-2.2 1,-0.2 3,-0.8 0.926 111.9 50.6 -65.2 -45.2 75.7 33.5 72.7 62 61 A I H ><5S+ 0 0 82 -4,-3.0 3,-2.0 1,-0.2 -1,-0.2 0.914 106.9 55.4 -54.9 -45.8 72.2 32.9 74.1 63 62 A N H 3<5S+ 0 0 48 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.735 107.8 50.9 -60.6 -24.2 73.6 30.1 76.3 64 63 A L T <<5S- 0 0 0 -4,-0.9 -27,-2.7 -3,-0.8 -26,-0.4 0.231 122.1-103.8 -99.6 7.5 76.1 32.6 77.7 65 64 A G T < 5S+ 0 0 24 -3,-2.0 -26,-0.6 1,-0.3 -25,-0.3 0.465 74.0 140.8 84.9 2.1 73.5 35.3 78.6 66 65 A G < - 0 0 7 -5,-2.2 2,-0.3 -28,-0.2 -1,-0.3 -0.375 49.8-124.8 -74.8 154.0 74.3 37.6 75.6 67 66 A D E -b 41 0A 96 -27,-2.9 -25,-2.6 -30,-0.3 2,-0.5 -0.768 25.3-141.6 -90.6 147.3 71.9 39.6 73.4 68 67 A V E +b 42 0A 39 -2,-0.3 2,-0.3 -27,-0.2 -25,-0.2 -0.947 26.6 162.6-118.5 126.0 72.0 39.0 69.7 69 68 A I E +b 43 0A 67 -27,-1.6 -25,-2.7 -2,-0.5 2,-0.3 -0.921 24.2 120.7-123.5 158.5 71.7 41.5 66.9 70 69 A G E -b 44 0A 39 -2,-0.3 2,-0.3 -27,-0.3 -25,-0.2 -0.995 40.6-121.6 173.1-172.9 72.7 40.9 63.3 71 70 A F E -b 45 0A 60 -27,-2.3 -25,-2.5 -2,-0.3 2,-0.4 -0.985 6.2-150.9-152.5 156.1 71.9 40.6 59.6 72 71 A S E -b 46 0A 65 -2,-0.3 -25,-0.2 -27,-0.2 2,-0.1 -0.953 61.7 -1.2-135.8 116.5 72.1 38.1 56.8 73 72 A G 0 0 24 -27,-2.1 -25,-0.1 -2,-0.4 -27,-0.1 -0.218 360.0 360.0 99.5 176.2 72.5 39.2 53.1 74 73 A E 0 0 144 -2,-0.1 -1,-0.2 -27,-0.1 -3,-0.0 -0.192 360.0 360.0 43.5 360.0 72.8 42.5 51.1 75 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 76 81 A G 0 0 136 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 61.2 77.4 50.8 48.3 77 82 A E - 0 0 120 1,-0.1 0, 0.0 2,-0.0 0, 0.0 -0.584 360.0-114.2 -71.8 120.1 78.7 51.0 51.9 78 83 A N > - 0 0 26 -2,-0.4 4,-1.7 1,-0.1 5,-0.1 -0.041 14.3-124.9 -14.8 133.5 82.2 50.1 52.7 79 84 A L H > S+ 0 0 13 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.949 114.0 56.0 -60.6 -47.3 83.1 47.1 54.9 80 85 A A H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.944 107.2 47.2 -50.2 -54.0 85.1 49.6 57.1 81 86 A D H > S+ 0 0 71 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.868 111.3 52.0 -57.7 -38.3 82.0 51.8 57.6 82 87 A T H X S+ 0 0 9 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.932 109.1 49.5 -63.6 -44.2 79.9 48.8 58.5 83 88 A I H X S+ 0 0 0 -4,-2.9 4,-1.8 1,-0.2 -2,-0.2 0.911 109.0 52.4 -63.4 -39.6 82.5 47.6 61.0 84 89 A R H X S+ 0 0 97 -4,-2.5 4,-0.9 -5,-0.2 -1,-0.2 0.879 108.7 51.9 -60.5 -38.7 82.5 51.1 62.6 85 90 A M H >X S+ 0 0 51 -4,-2.0 4,-1.6 2,-0.2 3,-1.0 0.933 106.2 52.4 -64.1 -46.9 78.7 50.9 62.9 86 91 A L H 3X S+ 0 0 5 -4,-2.4 4,-1.8 1,-0.3 -1,-0.2 0.851 101.7 61.7 -62.9 -31.7 78.7 47.6 64.6 87 92 A N H 3< S+ 0 0 34 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.813 102.7 50.4 -60.5 -33.9 81.2 49.0 67.1 88 93 A N H << S+ 0 0 129 -3,-1.0 -1,-0.2 -4,-0.9 -2,-0.2 0.939 119.2 37.7 -62.4 -43.4 78.5 51.5 68.2 89 94 A Y H < S+ 0 0 138 -4,-1.6 2,-0.2 2,-0.0 -2,-0.2 0.603 116.6 27.7 -88.6 -15.3 75.9 48.8 68.6 90 95 A S < - 0 0 5 -4,-1.8 -48,-0.2 -5,-0.1 22,-0.1 -0.832 55.9-128.9-149.6 173.4 77.8 45.8 70.1 91 96 A D S S+ 0 0 56 -50,-4.0 2,-0.3 1,-0.3 -49,-0.2 0.319 93.5 7.8-112.2 1.8 80.6 44.3 72.2 92 97 A G E -c 42 0A 0 -51,-0.6 -49,-2.6 20,-0.2 2,-0.4 -0.917 65.6-138.0-174.2 155.2 81.8 41.7 69.6 93 98 A I E -cd 43 114A 1 20,-2.7 22,-2.9 -2,-0.3 2,-0.6 -0.993 6.2-167.0-128.4 133.1 81.3 40.9 66.0 94 99 A V E -cd 44 115A 0 -51,-2.7 -49,-2.4 -2,-0.4 2,-0.4 -0.979 27.3-177.8-111.5 114.4 81.0 37.5 64.4 95 100 A M E -cd 45 116A 0 20,-2.7 22,-3.6 -2,-0.6 2,-0.4 -0.908 25.9-171.8-122.2 146.5 81.3 37.9 60.6 96 101 A R E +c 46 0A 22 -51,-1.6 -49,-1.6 -2,-0.4 -48,-1.5 -0.997 22.6 172.9-124.9 133.9 81.1 35.8 57.5 97 102 A H E - d 0 119A 14 21,-2.8 23,-3.3 -2,-0.4 5,-0.1 -0.986 40.5-131.9-145.0 149.2 82.0 37.5 54.2 98 103 A K S S+ 0 0 110 -2,-0.3 2,-0.5 21,-0.2 23,-0.1 0.642 85.4 84.6 -75.5 -15.2 82.6 36.6 50.5 99 104 A Y S > S- 0 0 46 21,-0.2 3,-1.6 22,-0.1 4,-0.2 -0.775 83.7-118.5 -96.9 130.8 86.0 38.5 50.3 100 105 A D B 3 S+f 402 0B 15 301,-1.3 303,-3.0 -2,-0.5 304,-0.3 -0.424 99.7 19.4 -62.4 133.0 89.2 36.9 51.5 101 106 A G T 3> S+ 0 0 0 18,-0.2 4,-2.4 327,-0.2 -1,-0.3 0.530 83.3 128.1 87.7 9.3 90.8 38.8 54.3 102 107 A A H <> S+ 0 0 0 -3,-1.6 4,-2.8 1,-0.2 5,-0.1 0.908 74.1 46.7 -67.3 -37.9 87.6 40.5 55.3 103 108 A S H > S+ 0 0 0 -4,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.890 110.4 52.2 -70.0 -41.2 87.9 39.4 58.9 104 109 A R H > S+ 0 0 76 2,-0.2 4,-0.8 1,-0.2 -2,-0.2 0.944 113.7 43.9 -58.1 -48.7 91.5 40.5 59.2 105 110 A F H >X S+ 0 0 6 -4,-2.4 4,-1.5 1,-0.2 3,-1.1 0.930 112.5 52.7 -62.9 -46.2 90.7 43.9 57.9 106 111 A A H >X S+ 0 0 0 -4,-2.8 4,-2.0 1,-0.3 3,-0.6 0.931 106.3 53.3 -54.6 -47.1 87.6 44.2 60.1 107 112 A S H 3< S+ 0 0 13 -4,-2.8 -1,-0.3 1,-0.2 -2,-0.2 0.694 106.5 54.0 -64.9 -18.3 89.6 43.4 63.1 108 113 A E H << S+ 0 0 94 -3,-1.1 -1,-0.2 -4,-0.8 -2,-0.2 0.780 113.2 40.9 -83.8 -31.2 92.0 46.2 62.2 109 114 A I H << S+ 0 0 47 -4,-1.5 -2,-0.2 -3,-0.6 2,-0.2 0.775 106.7 84.0 -78.7 -28.8 89.2 48.8 62.0 110 115 A S < - 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