==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 10-MAR-09 3GK7 . COMPND 2 MOLECULE: 4-HYDROXYBUTYRATE COA-TRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CLOSTRIDIUM AMINOBUTYRICUM; . AUTHOR A.MESSERSCHMIDT,S.MACIEIRA,M.VELARDE . 894 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32926.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 613 68.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 136 15.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 48 5.4 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 . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.4 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 . 65 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 123 13.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 178 19.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.4 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 6 0 4 4 6 4 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 6 10 2 6 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 PARALLEL BRIDGES PER LADDER . 5 4 4 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 . 6 0 2 1 3 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 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 M > 0 0 131 0, 0.0 4,-0.8 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0-121.0 31.7 -59.4 12.9 2 2 A D H >> + 0 0 142 2,-0.2 4,-1.5 1,-0.1 3,-0.6 0.897 360.0 57.6 -61.5 -41.5 33.1 -56.1 13.9 3 3 A W H 3> S+ 0 0 27 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.825 96.3 58.7 -63.0 -36.5 30.4 -54.6 11.7 4 4 A K H 3> S+ 0 0 113 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.864 106.7 49.1 -62.6 -36.9 27.5 -56.3 13.5 5 5 A K H < S+ 0 0 20 -4,-2.7 3,-0.7 1,-0.2 4,-0.5 0.944 115.1 45.4 -58.7 -52.4 25.2 -51.7 13.3 8 8 A E H >< S+ 0 0 144 -4,-2.4 3,-0.9 1,-0.2 -1,-0.2 0.887 111.0 52.8 -63.1 -39.3 23.6 -52.7 16.6 9 9 A D H 3< S+ 0 0 137 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.747 112.9 45.7 -64.8 -24.6 25.3 -49.9 18.6 10 10 A R T << S+ 0 0 85 -4,-1.2 166,-2.4 -3,-0.7 2,-0.3 0.362 84.1 113.0-104.9 3.0 24.0 -47.3 16.2 11 11 A T B < +a 176 0A 51 -3,-0.9 2,-0.2 -4,-0.5 166,-0.2 -0.621 40.0 141.6 -78.3 133.6 20.4 -48.5 15.9 12 12 A C - 0 0 27 164,-2.9 166,-0.4 -2,-0.3 2,-0.2 -0.856 49.4 -73.5-154.7-175.3 17.8 -46.1 17.4 13 13 A T > - 0 0 72 -2,-0.2 4,-2.6 164,-0.1 5,-0.1 -0.537 41.0-113.9 -88.4 161.1 14.3 -44.7 16.9 14 14 A A H > S+ 0 0 13 1,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.914 118.3 53.7 -57.5 -44.4 13.4 -42.1 14.3 15 15 A D H 4 S+ 0 0 94 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.855 111.5 44.9 -62.2 -36.5 12.7 -39.5 17.0 16 16 A E H >4 S+ 0 0 110 2,-0.1 3,-1.2 1,-0.1 -1,-0.2 0.915 109.7 56.2 -69.9 -43.6 16.2 -40.1 18.5 17 17 A A H >< S+ 0 0 0 -4,-2.6 3,-2.0 1,-0.2 -2,-0.2 0.911 100.7 56.1 -54.5 -47.7 17.9 -40.0 15.1 18 18 A V G >< S+ 0 0 1 -4,-2.0 3,-1.4 1,-0.3 -1,-0.2 0.579 85.8 79.6 -71.6 -8.0 16.6 -36.5 14.1 19 19 A K G < S+ 0 0 139 -3,-1.2 -1,-0.3 -4,-0.3 -2,-0.2 0.603 78.6 74.1 -70.3 -10.2 18.1 -35.0 17.2 20 20 A S G < S+ 0 0 32 -3,-2.0 2,-0.4 -4,-0.2 -1,-0.2 0.681 80.7 87.0 -71.4 -20.9 21.4 -35.1 15.2 21 21 A I < - 0 0 7 -3,-1.4 2,-0.3 -4,-0.1 32,-0.0 -0.674 63.6-173.6 -79.6 132.9 20.0 -32.2 13.2 22 22 A K > - 0 0 134 -2,-0.4 3,-2.2 1,-0.1 28,-0.1 -0.891 35.5 -74.3-126.2 161.0 20.7 -28.7 14.6 23 23 A S T 3 S+ 0 0 65 26,-0.3 29,-0.2 -2,-0.3 30,-0.1 -0.176 118.0 23.9 -50.6 135.0 19.7 -25.1 13.8 24 24 A G T 3 S+ 0 0 46 27,-1.6 -1,-0.3 1,-0.3 29,-0.1 0.242 91.0 139.4 92.5 -14.0 21.5 -23.8 10.7 25 25 A D < - 0 0 5 -3,-2.2 29,-2.3 26,-0.2 2,-0.7 -0.259 53.2-132.4 -64.3 148.0 22.1 -27.3 9.3 26 26 A R E -b 54 0A 47 27,-0.2 91,-2.1 -3,-0.1 92,-1.7 -0.933 28.1-165.7 -94.6 114.7 21.8 -28.1 5.6 27 27 A V E -bc 55 118A 1 27,-3.6 29,-2.7 -2,-0.7 2,-0.4 -0.848 3.7-167.3-102.1 137.4 19.8 -31.3 5.5 28 28 A L E -bc 56 119A 3 90,-2.4 92,-2.7 -2,-0.4 2,-0.3 -0.993 8.7-147.5-125.8 132.9 19.6 -33.4 2.2 29 29 A F E - c 0 120A 0 27,-2.2 92,-0.2 -2,-0.4 29,-0.2 -0.763 30.5-103.1 -91.9 146.3 17.2 -36.2 1.5 30 30 A A - 0 0 0 90,-2.6 28,-0.1 -2,-0.3 -1,-0.1 -0.314 58.5 -78.5 -58.2 149.2 18.2 -39.1 -0.7 31 31 A H S > S- 0 0 4 3,-0.2 3,-2.3 107,-0.1 4,-0.2 -0.241 70.3 -55.1 -64.9 133.8 16.7 -38.9 -4.2 32 32 A C G > S+ 0 0 3 27,-1.0 3,-1.9 1,-0.3 29,-0.3 -0.060 128.5 18.7 52.4-115.1 13.1 -39.7 -5.2 33 33 A V G 3 S+ 0 0 1 237,-0.4 -1,-0.3 1,-0.3 104,-0.1 0.717 121.0 63.1 -68.1 -20.1 12.1 -43.3 -4.1 34 34 A A G < S+ 0 0 0 -3,-2.3 88,-2.0 102,-0.1 -4,-0.3 0.394 71.3 123.9 -84.9 3.0 15.0 -43.5 -1.6 35 35 A E < - 0 0 15 -3,-1.9 86,-0.1 86,-0.2 -4,-0.1 -0.491 66.6-127.8 -62.7 129.2 13.6 -40.6 0.5 36 36 A P > - 0 0 0 0, 0.0 4,-2.5 0, 0.0 3,-0.3 -0.701 24.1-172.3 -83.8 95.5 13.2 -42.0 4.1 37 37 A P H > S+ 0 0 55 0, 0.0 4,-2.7 0, 0.0 5,-0.1 0.832 82.5 53.5 -62.9 -30.8 9.6 -41.2 5.0 38 38 A V H > S+ 0 0 36 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.888 112.6 43.9 -71.0 -37.4 10.0 -42.3 8.7 39 39 A L H > S+ 0 0 0 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.891 114.2 49.9 -70.1 -41.7 13.0 -40.0 9.2 40 40 A V H X S+ 0 0 14 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.930 110.3 51.2 -61.8 -45.9 11.2 -37.1 7.3 41 41 A E H X S+ 0 0 139 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.903 111.2 47.6 -54.3 -47.4 8.1 -37.6 9.5 42 42 A A H X S+ 0 0 4 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.880 110.4 51.8 -66.0 -39.7 10.2 -37.4 12.7 43 43 A M H < S+ 0 0 0 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.945 112.4 44.9 -62.0 -48.9 12.1 -34.3 11.5 44 44 A V H >< S+ 0 0 15 -4,-2.5 3,-1.5 1,-0.2 -2,-0.2 0.880 111.5 53.5 -62.4 -40.7 8.8 -32.5 10.8 45 45 A A H 3< S+ 0 0 80 -4,-2.5 3,-0.4 1,-0.3 -1,-0.2 0.863 109.4 49.1 -60.9 -34.3 7.4 -33.7 14.1 46 46 A N T >< S+ 0 0 39 -4,-1.9 3,-2.4 1,-0.2 4,-0.3 0.173 75.8 126.4 -89.3 17.3 10.4 -32.2 15.9 47 47 A A G X + 0 0 8 -3,-1.5 3,-1.9 1,-0.3 -1,-0.2 0.791 61.9 63.3 -48.9 -39.5 10.1 -28.9 14.0 48 48 A A G 3 S+ 0 0 100 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.679 93.7 63.9 -64.6 -18.1 10.1 -26.7 17.2 49 49 A A G < S+ 0 0 58 -3,-2.4 2,-0.4 -27,-0.0 -26,-0.3 0.601 97.9 71.1 -74.7 -14.1 13.7 -27.9 18.0 50 50 A Y < - 0 0 6 -3,-1.9 2,-0.4 -4,-0.3 3,-0.1 -0.852 53.6-170.0-117.7 142.7 15.0 -26.2 14.8 51 51 A K S S- 0 0 50 -2,-0.4 -27,-1.6 1,-0.1 23,-0.3 -0.996 77.2 -11.8-121.9 131.6 15.7 -22.7 13.5 52 52 A N S S+ 0 0 96 21,-1.9 2,-0.6 -2,-0.4 23,-0.2 0.880 75.6 169.0 50.2 53.6 16.6 -22.1 9.8 53 53 A V E - d 0 75A 0 21,-2.4 23,-2.4 -30,-0.1 2,-0.4 -0.871 29.1-137.8 -93.1 120.3 17.3 -25.7 8.8 54 54 A T E -bd 26 76A 21 -29,-2.3 -27,-3.6 -2,-0.6 2,-0.5 -0.660 15.3-161.6 -78.7 133.2 17.7 -25.9 5.0 55 55 A V E +bd 27 77A 0 21,-2.5 23,-3.0 -2,-0.4 2,-0.3 -0.963 14.8 179.1-119.3 113.8 16.0 -28.9 3.5 56 56 A S E +bd 28 78A 2 -29,-2.7 -27,-2.2 -2,-0.5 2,-0.3 -0.816 16.4 120.7-116.8 153.3 17.1 -29.9 -0.0 57 57 A H E - d 0 79A 1 21,-0.7 23,-2.8 -2,-0.3 24,-0.6 -0.936 44.6-115.5-178.9-170.2 16.2 -32.6 -2.5 58 58 A M S S- 0 0 3 1,-0.4 23,-0.2 -2,-0.3 25,-0.1 0.034 77.1 -1.5-116.3-135.7 14.9 -33.1 -6.0 59 59 A V S S- 0 0 31 21,-0.1 -27,-1.0 23,-0.1 -1,-0.4 -0.290 73.0-162.0 -58.0 140.1 11.7 -34.7 -7.2 60 60 A T - 0 0 7 -3,-0.1 25,-0.3 2,-0.1 26,-0.1 -0.980 33.9-171.3-129.9 142.6 9.6 -36.1 -4.2 61 61 A L S S+ 0 0 63 -2,-0.4 124,-0.1 -29,-0.3 -1,-0.1 0.291 70.2 96.5-101.4 2.8 6.8 -38.6 -3.8 62 62 A G S S- 0 0 27 -30,-0.1 23,-0.2 1,-0.1 -2,-0.1 -0.099 92.7 -97.5 -84.9-175.1 6.5 -37.5 -0.2 63 63 A K - 0 0 167 -26,-0.1 -1,-0.1 1,-0.0 -3,-0.0 0.601 37.2-144.1 -84.4 -12.2 4.2 -34.9 1.5 64 64 A G > + 0 0 1 1,-0.1 3,-1.7 2,-0.1 4,-0.3 0.788 41.1 156.2 52.3 34.2 6.7 -32.0 1.5 65 65 A E G > + 0 0 83 1,-0.3 3,-1.9 2,-0.2 6,-0.2 0.836 63.1 63.4 -59.7 -38.7 5.3 -30.8 4.8 66 66 A Y G 3 S+ 0 0 2 1,-0.3 -1,-0.3 4,-0.1 11,-0.2 0.643 96.9 61.9 -59.6 -18.7 8.5 -28.9 5.8 67 67 A S G < S+ 0 0 3 -3,-1.7 -1,-0.3 18,-0.2 -2,-0.2 0.549 78.7 107.7 -85.5 -10.0 7.9 -26.7 2.8 68 68 A K S X S- 0 0 62 -3,-1.9 3,-1.8 -4,-0.3 4,-0.1 -0.381 81.1-116.8 -70.7 148.2 4.5 -25.4 4.1 69 69 A P G > S+ 0 0 49 0, 0.0 3,-1.9 0, 0.0 4,-0.2 0.786 110.2 67.5 -60.6 -28.4 4.5 -21.7 5.3 70 70 A E G 3 S+ 0 0 144 1,-0.3 3,-0.3 2,-0.1 4,-0.1 0.741 103.1 48.5 -63.3 -19.6 3.6 -22.6 8.9 71 71 A Y G X> S+ 0 0 50 -3,-1.8 4,-2.7 -6,-0.2 3,-1.4 0.319 76.8 110.6 -96.8 6.0 7.1 -24.2 9.1 72 72 A K T <4 S+ 0 0 130 -3,-1.9 -1,-0.2 1,-0.3 -2,-0.1 0.710 75.3 52.7 -64.4 -21.4 9.1 -21.3 7.6 73 73 A E T 34 S+ 0 0 160 -3,-0.3 -21,-1.9 -4,-0.2 -1,-0.3 0.766 119.0 36.5 -79.0 -22.8 10.8 -20.3 10.9 74 74 A N T <4 S+ 0 0 32 -3,-1.4 -21,-2.4 -23,-0.3 2,-0.3 0.847 124.3 23.6 -96.5 -44.3 12.1 -23.9 11.3 75 75 A F E < -d 53 0A 3 -4,-2.7 2,-0.4 -23,-0.2 -21,-0.2 -0.920 53.3-158.7-124.2 149.3 12.8 -25.1 7.8 76 76 A T E -d 54 0A 32 -23,-2.4 -21,-2.5 -2,-0.3 2,-0.3 -0.962 23.3-140.0-122.1 112.6 13.7 -23.5 4.4 77 77 A F E -d 55 0A 3 -2,-0.4 19,-3.1 17,-0.3 2,-0.4 -0.542 18.7-174.7 -67.4 131.9 12.9 -25.8 1.5 78 78 A E E -de 56 96A 19 -23,-3.0 -21,-0.7 -2,-0.3 2,-0.2 -0.828 10.5-164.0-128.6 92.1 15.6 -25.5 -1.2 79 79 A G E -de 57 97A 0 17,-2.7 19,-2.9 -2,-0.4 -21,-0.2 -0.536 24.0-172.2 -80.2 139.3 14.6 -27.6 -4.1 80 80 A W S S+ 0 0 3 -23,-2.8 20,-0.4 1,-0.5 255,-0.3 0.379 94.1 9.0-102.0 -1.3 17.0 -28.6 -6.8 81 81 A F S S- 0 0 44 -24,-0.6 -1,-0.5 -23,-0.2 252,-0.3 -0.754 87.0-144.4-172.0 122.2 13.9 -29.9 -8.8 82 82 A T - 0 0 1 250,-2.7 -23,-0.1 -2,-0.2 249,-0.1 -0.491 15.9-177.1 -99.5 168.3 10.4 -29.2 -7.6 83 83 A S >> - 0 0 7 -2,-0.1 4,-2.8 -25,-0.1 3,-2.2 -0.909 47.7 -75.4-152.5 176.0 7.2 -31.2 -7.6 84 84 A P T 34 S+ 0 0 97 0, 0.0 4,-0.5 0, 0.0 -23,-0.1 0.811 125.6 50.4 -52.1 -36.2 3.5 -30.8 -6.7 85 85 A S T 34 S+ 0 0 24 -25,-0.3 -18,-0.2 1,-0.2 4,-0.1 0.605 125.5 24.8 -79.7 -10.0 4.0 -31.1 -2.9 86 86 A T T X> S+ 0 0 0 -3,-2.2 3,-0.9 -26,-0.1 4,-0.7 0.578 98.3 82.7-124.8 -17.0 6.8 -28.5 -2.8 87 87 A R H >X S+ 0 0 94 -4,-2.8 4,-1.7 1,-0.2 3,-0.7 0.810 82.4 67.0 -65.9 -29.6 6.3 -26.1 -5.7 88 88 A G H 3> S+ 0 0 33 -4,-0.5 4,-2.1 -5,-0.2 -1,-0.2 0.866 95.2 57.2 -55.0 -40.0 3.7 -24.0 -3.9 89 89 A S H <>>S+ 0 0 2 -3,-0.9 6,-2.7 2,-0.2 4,-1.2 0.805 104.2 52.1 -63.7 -31.6 6.4 -22.8 -1.4 90 90 A I H <<5S+ 0 0 24 -3,-0.7 3,-0.3 -4,-0.7 -1,-0.2 0.931 111.7 45.2 -73.3 -43.5 8.5 -21.4 -4.3 91 91 A A H <5S+ 0 0 56 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.862 112.6 53.2 -62.8 -36.2 5.6 -19.4 -5.7 92 92 A E H <5S- 0 0 89 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.716 111.9-119.2 -77.3 -24.2 4.7 -18.2 -2.2 93 93 A G T <5S+ 0 0 6 -4,-1.2 -3,-0.1 -3,-0.3 -4,-0.1 0.183 94.3 85.1 111.9 -17.3 8.2 -16.9 -1.4 94 94 A H S > - 0 0 2 735,-0.4 3,-1.2 -2,-0.3 4,-0.6 -0.521 28.8-126.3 -64.7 134.1 21.9 -29.6 -14.0 102 102 A F G >4 S+ 0 0 2 233,-2.4 3,-1.6 1,-0.3 234,-0.2 0.903 108.0 54.0 -48.8 -49.0 21.3 -33.2 -12.6 103 103 A H G 34 S+ 0 0 6 1,-0.3 4,-0.4 232,-0.3 -1,-0.3 0.758 105.3 55.5 -61.4 -25.2 24.8 -34.4 -13.7 104 104 A E G <> S+ 0 0 2 -3,-1.2 4,-2.2 1,-0.2 -1,-0.3 0.552 81.3 89.5 -85.3 -10.8 26.5 -31.5 -11.8 105 105 A V H S+ 0 0 0 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.902 110.8 52.6 -56.1 -39.5 27.7 -34.6 -7.2 107 107 A S H > S+ 0 0 20 -4,-0.4 4,-2.5 2,-0.2 6,-0.2 0.913 108.0 49.6 -60.4 -44.5 30.3 -32.0 -8.2 108 108 A L H <>S+ 0 0 0 -4,-2.2 6,-2.1 2,-0.2 5,-1.9 0.865 111.9 49.2 -65.4 -34.4 28.6 -29.2 -6.2 109 109 A I H ><5S+ 0 0 4 -4,-2.1 3,-1.6 -5,-0.2 -2,-0.2 0.957 112.0 48.0 -65.1 -49.0 28.4 -31.5 -3.2 110 110 A R H 3<5S+ 0 0 121 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.856 110.7 52.0 -59.0 -37.4 32.2 -32.3 -3.6 111 111 A K T 3<5S- 0 0 61 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.504 113.1-120.9 -75.5 -6.1 32.9 -28.6 -4.0 112 112 A D T X 5S+ 0 0 100 -3,-1.6 3,-0.5 -4,-0.3 -3,-0.2 0.641 86.2 114.9 66.5 18.6 31.0 -27.9 -0.7 113 113 A I T 3 - 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