==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ACYLPHOSPHATASE 08-NOV-96 2ACY . COMPND 2 MOLECULE: ACYLPHOSPHATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR M.M.G.M.THUNNISSEN,P.NORDLUND . 98 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5817.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 67 68.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 5.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 28 28.6 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 1.0 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 . 5 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 6 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 20 20.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 2.0 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 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 1 0 1 1 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 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 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 A 0 0 64 0, 0.0 2,-0.2 0, 0.0 6,-0.0 0.000 360.0 360.0 360.0 140.1 11.9 6.8 -0.6 2 2 A E > + 0 0 117 53,-0.1 3,-0.9 56,-0.0 2,-0.3 -0.616 360.0 42.0-127.0-171.2 8.7 6.8 1.5 3 3 A G T 3 S- 0 0 37 1,-0.2 53,-2.4 -2,-0.2 54,-0.4 -0.582 120.1 -21.0 79.2-134.3 5.1 6.0 1.0 4 4 A D T 3 S+ 0 0 142 -2,-0.3 -1,-0.2 50,-0.2 2,-0.1 0.359 95.1 118.5 -96.3 1.7 4.3 2.9 -1.1 5 5 A T < - 0 0 63 -3,-0.9 50,-3.1 49,-0.1 2,-0.4 -0.499 69.2-118.7 -65.7 142.0 7.5 2.5 -3.1 6 6 A L E -A 54 0A 48 80,-0.5 80,-2.5 48,-0.2 2,-0.3 -0.719 37.4-180.0 -89.5 130.8 9.0 -0.9 -2.1 7 7 A I E -AB 53 85A 3 46,-3.0 46,-2.1 -2,-0.4 2,-0.4 -0.872 19.9-155.3-129.9 162.3 12.4 -1.0 -0.4 8 8 A S E +AB 52 84A 13 76,-2.0 76,-2.2 -2,-0.3 2,-0.3 -0.985 18.9 173.8-131.3 138.5 14.8 -3.6 1.0 9 9 A V E -A 51 0A 0 42,-2.0 42,-2.4 -2,-0.4 2,-0.3 -0.992 24.1-135.5-149.5 145.7 17.4 -2.8 3.6 10 10 A D E -AB 50 81A 38 71,-2.9 71,-2.4 -2,-0.3 2,-0.3 -0.760 27.3-170.0 -99.2 146.9 19.9 -4.9 5.7 11 11 A Y E -AB 49 80A 7 38,-2.3 38,-1.7 -2,-0.3 2,-0.3 -0.951 19.5-171.1-139.5 158.2 20.2 -4.3 9.4 12 12 A E E -AB 48 79A 52 67,-1.7 67,-2.8 -2,-0.3 2,-0.4 -0.959 14.6-156.4-147.2 128.2 22.4 -5.2 12.4 13 13 A I E -AB 47 78A 0 34,-2.8 34,-1.7 -2,-0.3 2,-0.3 -0.907 7.8-165.8-113.6 137.6 21.5 -4.3 16.0 14 14 A F E + B 0 77A 44 63,-2.9 62,-2.6 -2,-0.4 63,-1.9 -0.914 43.6 55.3-124.2 148.6 24.0 -4.0 18.9 15 15 A G E S- B 0 75A 33 -2,-0.3 2,-1.2 30,-0.3 60,-0.2 -0.991 109.1 -16.3 136.3-142.3 23.6 -3.8 22.7 16 16 A K E S+ B 0 74A 141 58,-2.7 58,-2.0 -2,-0.4 30,-0.1 -0.780 88.4 133.3 -98.7 89.4 21.9 -6.2 25.1 17 17 A V + 0 0 1 -2,-1.2 2,-0.3 28,-0.4 3,-0.2 0.342 41.6 73.5-125.4 7.0 20.0 -8.0 22.2 18 18 A Q S S+ 0 0 70 -3,-0.2 29,-0.1 1,-0.2 28,-0.0 -0.870 95.0 23.0-119.8 153.6 20.3 -11.8 22.7 19 19 A G S S+ 0 0 83 -2,-0.3 -1,-0.2 1,-0.1 -2,-0.0 0.719 100.3 93.5 66.2 22.0 18.6 -13.9 25.4 20 20 A V S S- 0 0 18 -3,-0.2 52,-0.5 51,-0.0 53,-0.2 0.044 106.4 -98.4-131.7 23.7 15.8 -11.2 25.7 21 21 A F S > S+ 0 0 160 51,-0.1 4,-2.2 50,-0.1 5,-0.2 0.764 75.2 144.3 64.1 27.5 13.2 -12.5 23.2 22 22 A F H > + 0 0 4 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.910 66.1 50.6 -62.8 -44.9 14.5 -10.1 20.5 23 23 A R H > S+ 0 0 63 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.927 111.6 47.2 -64.4 -43.6 13.9 -12.5 17.6 24 24 A K H > S+ 0 0 135 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.929 114.8 45.5 -63.3 -44.3 10.3 -13.3 18.6 25 25 A Y H X S+ 0 0 110 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.870 111.9 52.5 -67.5 -34.7 9.4 -9.6 19.1 26 26 A T H X S+ 0 0 0 -4,-2.4 4,-2.7 -5,-0.2 5,-0.2 0.927 110.1 47.9 -66.8 -43.8 11.1 -8.6 15.9 27 27 A Q H X S+ 0 0 35 -4,-2.3 4,-2.4 1,-0.2 5,-0.2 0.924 111.5 50.6 -64.9 -39.9 9.2 -11.1 13.9 28 28 A A H X S+ 0 0 60 -4,-2.2 4,-1.9 -5,-0.2 -1,-0.2 0.906 112.1 46.4 -65.1 -39.3 5.9 -10.1 15.5 29 29 A E H X S+ 0 0 13 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.917 111.5 52.3 -69.8 -39.4 6.5 -6.5 14.7 30 30 A G H <>S+ 0 0 0 -4,-2.7 5,-3.1 1,-0.2 4,-0.4 0.926 112.3 45.1 -61.6 -43.5 7.5 -7.2 11.2 31 31 A K H ><5S+ 0 0 116 -4,-2.4 3,-0.9 1,-0.2 -1,-0.2 0.875 108.9 56.3 -67.9 -35.5 4.3 -9.2 10.5 32 32 A K H 3<5S+ 0 0 150 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.862 109.8 46.1 -64.5 -32.6 2.2 -6.6 12.2 33 33 A L T 3<5S- 0 0 25 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.464 117.8-112.6 -87.6 -3.2 3.6 -4.1 9.7 34 34 A G T < 5 + 0 0 58 -3,-0.9 -3,-0.2 -4,-0.4 2,-0.2 0.739 67.8 146.4 78.6 23.4 3.1 -6.4 6.7 35 35 A L < - 0 0 5 -5,-3.1 2,-0.3 -6,-0.2 -1,-0.2 -0.529 35.7-154.1 -91.5 160.7 6.9 -6.8 6.2 36 36 A V E +C 52 0A 14 16,-2.1 16,-2.0 -2,-0.2 2,-0.3 -0.813 46.4 83.8-123.0 168.0 8.8 -9.8 4.9 37 37 A G E -Cd 51 94A 0 56,-2.6 58,-2.6 -2,-0.3 2,-0.3 -0.989 63.0 -88.1 140.4-150.0 12.4 -10.6 5.6 38 38 A W E -Cd 50 95A 47 12,-2.1 12,-1.1 -2,-0.3 2,-0.3 -0.996 12.7-148.9-161.3 164.5 14.3 -12.3 8.4 39 39 A V E +Cd 49 96A 0 56,-1.9 58,-2.7 -2,-0.3 2,-0.3 -0.994 20.8 171.6-138.2 140.6 16.1 -12.0 11.8 40 40 A Q E -Cd 48 97A 55 8,-2.3 8,-2.9 -2,-0.3 2,-0.3 -0.994 31.5-122.9-151.4 145.8 19.0 -14.0 13.1 41 41 A N E -C 47 0A 40 56,-0.5 6,-0.2 -2,-0.3 2,-0.2 -0.679 32.0-147.7 -84.1 141.2 21.4 -14.0 16.0 42 42 A T > - 0 0 15 4,-2.5 3,-1.0 -2,-0.3 -1,-0.0 -0.585 24.6-110.9-103.3 172.3 25.0 -13.8 15.0 43 43 A D T 3 S+ 0 0 170 1,-0.2 -1,-0.1 -2,-0.2 -2,-0.0 0.379 111.2 69.8 -79.5 0.7 28.1 -15.4 16.8 44 44 A Q T 3 S- 0 0 154 2,-0.1 -1,-0.2 0, 0.0 3,-0.1 0.253 120.2 -98.8-106.0 16.1 29.2 -11.9 17.6 45 45 A G S < S+ 0 0 37 -3,-1.0 -28,-0.4 1,-0.3 -30,-0.3 0.598 89.8 110.0 81.4 13.6 26.5 -11.1 20.2 46 46 A T - 0 0 9 -32,-0.1 -4,-2.5 -30,-0.1 2,-0.4 -0.521 63.0-127.3-115.3 179.7 24.4 -9.1 17.6 47 47 A V E +AC 13 41A 0 -34,-1.7 -34,-2.8 -6,-0.2 2,-0.3 -0.990 31.8 170.8-127.3 135.6 21.2 -9.5 15.7 48 48 A Q E +AC 12 40A 64 -8,-2.9 -8,-2.3 -2,-0.4 2,-0.3 -0.907 11.8 119.8-140.3 171.2 21.0 -9.1 11.9 49 49 A G E -AC 11 39A 3 -38,-1.7 -38,-2.3 -2,-0.3 2,-0.3 -0.987 46.8 -92.9 166.8-160.0 18.6 -9.6 9.0 50 50 A Q E -AC 10 38A 35 -12,-1.1 -12,-2.1 -2,-0.3 2,-0.3 -0.978 20.7-150.6-145.4 156.0 16.8 -7.7 6.2 51 51 A L E -AC 9 37A 0 -42,-2.4 -42,-2.0 -2,-0.3 2,-0.3 -0.962 11.5-176.4-126.9 145.5 13.4 -6.1 5.8 52 52 A Q E +AC 8 36A 3 -16,-2.0 -16,-2.1 -2,-0.3 -44,-0.2 -0.996 33.4 83.1-141.8 136.4 11.4 -5.7 2.6 53 53 A G E S-A 7 0A 1 -46,-2.1 -46,-3.0 -2,-0.3 -18,-0.1 -0.968 78.2 -19.3 162.7-171.8 8.1 -3.8 2.1 54 54 A P E >> -A 6 0A 33 0, 0.0 4,-2.6 0, 0.0 3,-1.0 -0.400 63.9-119.1 -63.0 135.8 6.5 -0.4 1.5 55 55 A A H 3> S+ 0 0 0 -50,-3.1 4,-2.2 1,-0.3 -51,-0.2 0.802 110.7 53.6 -45.7 -44.0 8.9 2.4 2.4 56 56 A S H 3> S+ 0 0 45 -53,-2.4 4,-1.4 1,-0.2 -1,-0.3 0.864 111.6 44.2 -65.9 -36.3 6.6 3.8 5.1 57 57 A K H <> S+ 0 0 93 -3,-1.0 4,-2.2 -54,-0.4 -2,-0.2 0.903 111.2 53.6 -75.2 -40.7 6.3 0.5 6.9 58 58 A V H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.929 107.5 52.1 -59.4 -42.8 10.0 -0.2 6.6 59 59 A R H X S+ 0 0 48 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.878 107.3 50.5 -62.9 -36.9 10.8 3.1 8.2 60 60 A H H X S+ 0 0 98 -4,-1.4 4,-2.6 1,-0.2 -1,-0.2 0.918 111.6 50.4 -66.2 -39.2 8.6 2.6 11.2 61 61 A M H X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.893 107.4 53.3 -63.3 -39.1 10.3 -0.8 11.6 62 62 A Q H X S+ 0 0 16 -4,-2.5 4,-1.2 1,-0.2 -1,-0.2 0.912 109.8 47.6 -63.4 -38.9 13.7 0.9 11.4 63 63 A E H >X S+ 0 0 105 -4,-2.1 4,-2.2 2,-0.2 3,-0.6 0.938 110.6 51.8 -67.2 -42.4 12.6 3.2 14.2 64 64 A W H 3X>S+ 0 0 18 -4,-2.6 4,-1.9 1,-0.2 5,-1.4 0.905 109.6 50.4 -59.1 -41.4 11.3 0.2 16.2 65 65 A L H 3<5S+ 0 0 0 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.737 115.6 42.4 -69.3 -23.6 14.7 -1.5 15.7 66 66 A E H <<5S+ 0 0 87 -4,-1.2 -2,-0.2 -3,-0.6 -1,-0.2 0.740 130.7 19.0 -92.0 -29.7 16.6 1.6 16.9 67 67 A T H <5S+ 0 0 119 -4,-2.2 -3,-0.2 -5,-0.1 -2,-0.2 0.740 127.1 22.9-112.5 -37.1 14.4 2.6 19.8 68 68 A K T <5 + 0 0 136 -4,-1.9 5,-0.2 -5,-0.4 -3,-0.2 0.871 60.3 152.2-105.3 -68.5 12.2 -0.2 21.1 69 69 A G < - 0 0 3 -5,-1.4 -3,-0.1 5,-0.1 -52,-0.1 -0.207 68.9 -20.0 64.2-160.4 13.1 -3.9 20.5 70 70 A S S > S- 0 0 1 1,-0.1 3,-2.1 -53,-0.1 -48,-0.1 -0.461 77.3-101.7 -79.0 157.1 11.9 -6.4 23.0 71 71 A P T 3 S+ 0 0 96 0, 0.0 -1,-0.1 0, 0.0 -50,-0.1 0.822 119.6 37.9 -47.6 -41.9 10.9 -5.2 26.5 72 72 A K T 3 S+ 0 0 177 -52,-0.5 2,-0.1 2,-0.0 -51,-0.1 0.375 94.8 102.8 -97.7 8.4 14.1 -6.3 28.2 73 73 A S < - 0 0 17 -3,-2.1 2,-0.4 -53,-0.2 -56,-0.2 -0.455 56.2-152.4 -84.5 164.7 16.5 -5.5 25.4 74 74 A H E -B 16 0A 107 -58,-2.0 -58,-2.7 -2,-0.1 2,-0.6 -0.907 10.5-153.8-137.1 105.4 18.7 -2.4 25.5 75 75 A I E +B 15 0A 27 -2,-0.4 -60,-0.2 -60,-0.2 3,-0.1 -0.703 19.9 172.4 -84.4 117.9 19.6 -1.2 22.0 76 76 A D E - 0 0 112 -62,-2.6 2,-0.3 -2,-0.6 -61,-0.2 0.801 68.7 -1.7 -92.4 -31.8 22.9 0.7 21.9 77 77 A R E -B 14 0A 138 -63,-1.9 -63,-2.9 2,-0.0 2,-0.4 -0.990 51.6-159.7-159.4 147.3 23.1 1.0 18.1 78 78 A A E -B 13 0A 23 -2,-0.3 2,-0.4 -65,-0.2 -65,-0.2 -0.992 13.7-165.7-131.9 123.8 21.3 0.0 14.9 79 79 A S E -B 12 0A 22 -67,-2.8 -67,-1.7 -2,-0.4 2,-0.4 -0.921 1.8-166.0-113.4 133.7 23.2 0.0 11.6 80 80 A F E +B 11 0A 45 -2,-0.4 2,-0.3 -69,-0.2 -69,-0.2 -0.943 12.6 170.4-119.2 139.2 21.4 -0.1 8.2 81 81 A H E +B 10 0A 106 -71,-2.4 -71,-2.9 -2,-0.4 -2,-0.0 -0.941 49.8 26.8-143.1 168.0 23.1 -0.9 4.9 82 82 A N E + 0 0 108 -2,-0.3 2,-0.3 -73,-0.2 -1,-0.1 0.856 64.9 179.8 50.9 42.8 22.3 -1.7 1.3 83 83 A E E + 0 0 62 -74,-0.1 2,-0.3 -3,-0.1 -74,-0.2 -0.627 12.4 163.5 -74.5 133.7 19.0 0.1 1.2 84 84 A K E -B 8 0A 140 -76,-2.2 -76,-2.0 -2,-0.3 2,-0.3 -0.970 40.4-113.0-148.1 160.2 17.6 -0.2 -2.3 85 85 A V E -B 7 0A 96 -2,-0.3 2,-0.3 -78,-0.2 -78,-0.2 -0.738 37.4-173.7 -93.8 144.0 14.3 0.2 -4.2 86 86 A I - 0 0 34 -80,-2.5 -80,-0.5 -2,-0.3 3,-0.1 -0.948 28.4-147.3-137.5 158.0 12.8 -3.0 -5.6 87 87 A V S S+ 0 0 140 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.695 85.6 24.3 -97.4 -24.2 9.9 -3.9 -7.8 88 88 A K S S- 0 0 158 -82,-0.1 2,-0.3 0, 0.0 -1,-0.2 -0.972 83.9-107.6-139.5 153.7 9.0 -7.2 -6.3 89 89 A L - 0 0 72 -2,-0.3 -81,-0.0 1,-0.2 -37,-0.0 -0.629 17.0-158.5 -82.3 142.0 9.5 -8.8 -2.9 90 90 A D S S+ 0 0 116 -2,-0.3 2,-0.2 -54,-0.0 -1,-0.2 0.856 75.1 53.6 -84.3 -40.7 12.0 -11.6 -2.6 91 91 A Y - 0 0 69 1,-0.1 3,-0.1 -55,-0.0 -53,-0.0 -0.591 61.3-156.9 -95.3 157.8 10.7 -13.1 0.5 92 92 A T S S+ 0 0 139 -2,-0.2 2,-0.3 -55,-0.1 -1,-0.1 0.579 75.0 13.8-108.8 -10.1 7.2 -14.3 1.3 93 93 A D S S- 0 0 89 -56,-0.1 -56,-2.6 2,-0.0 2,-0.7 -0.894 79.6 -96.9-149.7-179.7 7.3 -14.2 5.0 94 94 A F E -d 37 0A 0 -58,-0.3 2,-0.3 -2,-0.3 -56,-0.2 -0.900 48.8-163.7-108.3 107.7 9.2 -12.9 8.0 95 95 A Q E -d 38 0A 94 -58,-2.6 -56,-1.9 -2,-0.7 2,-0.7 -0.638 25.8-141.7 -96.7 155.1 11.4 -15.7 9.3 96 96 A I E -d 39 0A 41 -2,-0.3 2,-0.5 -58,-0.2 -56,-0.2 -0.939 30.6-146.9-105.6 117.5 13.3 -16.3 12.4 97 97 A V E d 40 0A 35 -58,-2.7 -56,-0.5 -2,-0.7 -59,-0.0 -0.800 360.0 360.0 -94.8 124.3 16.6 -18.0 11.1 98 98 A K 0 0 197 -2,-0.5 -1,-0.2 -58,-0.1 -58,-0.0 0.632 360.0 360.0-121.5 360.0 18.1 -20.6 13.4