==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 20-DEC-05 2FFZ . COMPND 2 MOLECULE: PHOSPHOLIPASE C; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS CEREUS; . AUTHOR A.B.BENFIELD,N.M.ANTIKAINEN,S.F.MARTIN . 245 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10709.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 180 73.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 10 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 128 52.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.2 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 1 0 2 0 1 0 1 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 W 0 0 3 0, 0.0 146,-0.1 0, 0.0 145,-0.1 0.000 360.0 360.0 360.0 165.6 0.2 20.9 9.9 2 2 A S + 0 0 5 144,-0.4 12,-2.1 1,-0.1 13,-0.2 -0.268 360.0 172.5 -70.1 157.9 1.1 24.0 11.9 3 3 A A + 0 0 1 9,-0.2 9,-0.2 10,-0.2 52,-0.1 -0.231 29.2 136.0-160.0 50.1 0.1 27.6 10.9 4 4 A Q + 0 0 86 7,-2.2 2,-0.5 1,-0.1 8,-0.2 0.645 62.8 54.7 -81.7 -17.5 1.2 29.6 14.0 5 5 A D S S- 0 0 59 6,-0.4 3,-0.4 3,-0.3 10,-0.2 -0.980 71.4-149.4-121.1 124.4 2.8 32.5 12.1 6 6 A K S S+ 0 0 77 -2,-0.5 46,-0.2 1,-0.2 -1,-0.1 0.895 92.7 12.7 -58.7 -46.4 0.8 34.4 9.5 7 7 A H S S+ 0 0 83 45,-0.0 2,-0.4 42,-0.0 -1,-0.2 0.087 111.7 82.0-123.7 26.2 3.6 35.4 7.2 8 8 A K - 0 0 137 -3,-0.4 3,-0.4 1,-0.1 -3,-0.3 -0.997 59.2-150.8-133.5 135.0 6.6 33.4 8.3 9 9 A E S > S+ 0 0 50 -2,-0.4 3,-1.6 1,-0.2 7,-0.2 0.690 78.9 93.8 -73.6 -20.8 7.5 29.8 7.5 10 10 A G T 3 S+ 0 0 51 1,-0.3 -1,-0.2 -6,-0.0 3,-0.0 0.877 109.8 4.3 -35.9 -64.9 9.3 29.3 10.8 11 11 A V T 3 S+ 0 0 52 -3,-0.4 -7,-2.2 1,-0.1 -6,-0.4 -0.178 115.1 90.0-119.1 37.9 6.3 27.9 12.6 12 12 A N <> + 0 0 0 -3,-1.6 4,-2.2 -9,-0.2 3,-0.3 -0.728 41.2 171.5-135.1 84.5 3.9 27.7 9.7 13 13 A S H > S+ 0 0 0 -2,-0.3 4,-2.7 1,-0.2 -10,-0.2 0.802 80.2 59.9 -62.5 -30.4 4.2 24.3 7.9 14 14 A H H > S+ 0 0 2 -12,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.905 108.0 42.8 -65.5 -42.0 1.2 25.2 5.8 15 15 A L H > S+ 0 0 3 -3,-0.3 4,-3.1 -13,-0.2 -2,-0.2 0.897 113.3 54.1 -69.1 -40.5 2.8 28.3 4.3 16 16 A W H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.929 108.0 49.0 -58.9 -46.9 6.0 26.3 3.9 17 17 A I H X S+ 0 0 2 -4,-2.7 4,-1.9 2,-0.2 -1,-0.2 0.927 113.3 46.5 -60.3 -45.6 4.2 23.6 1.9 18 18 A V H X S+ 0 0 3 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.935 112.8 50.4 -62.1 -46.3 2.5 26.2 -0.4 19 19 A N H X S+ 0 0 16 -4,-3.1 4,-1.9 1,-0.2 -2,-0.2 0.884 111.3 47.4 -59.3 -42.1 5.8 28.0 -0.8 20 20 A R H X S+ 0 0 22 -4,-2.6 4,-1.6 2,-0.2 -1,-0.2 0.838 110.6 53.4 -69.3 -32.1 7.7 24.9 -1.8 21 21 A A H X S+ 0 0 0 -4,-1.9 4,-1.9 -5,-0.2 -2,-0.2 0.904 108.8 48.4 -67.5 -41.9 4.8 24.0 -4.2 22 22 A I H X S+ 0 0 3 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.867 107.8 56.0 -65.6 -36.4 5.2 27.4 -5.8 23 23 A D H X S+ 0 0 55 -4,-1.9 4,-2.8 2,-0.2 -1,-0.2 0.877 104.5 53.3 -62.3 -37.8 8.9 26.7 -6.0 24 24 A I H X S+ 0 0 0 -4,-1.6 4,-1.5 2,-0.2 -2,-0.2 0.930 107.8 49.9 -62.5 -45.2 8.2 23.5 -7.9 25 25 A M H < S+ 0 0 0 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.882 112.3 48.9 -60.6 -37.4 6.1 25.5 -10.4 26 26 A S H < S+ 0 0 51 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.904 108.9 51.2 -69.6 -41.7 9.0 27.9 -10.8 27 27 A R H < S+ 0 0 122 -4,-2.8 2,-0.5 133,-0.2 134,-0.3 0.748 91.6 92.3 -67.2 -23.7 11.6 25.2 -11.3 28 28 A N < + 0 0 12 -4,-1.5 4,-0.1 -5,-0.2 6,-0.0 -0.621 47.3 172.7 -77.5 122.0 9.4 23.6 -14.0 29 29 A T + 0 0 128 -2,-0.5 -1,-0.1 2,-0.1 -4,-0.0 0.298 68.7 54.0-111.1 8.9 10.4 25.0 -17.4 30 30 A T S S+ 0 0 126 3,-0.0 -1,-0.1 0, 0.0 -2,-0.1 0.637 119.5 14.5-117.3 -19.3 8.2 22.8 -19.7 31 31 A L S S+ 0 0 76 -6,-0.1 2,-0.4 1,-0.1 -2,-0.1 0.634 99.8 87.3-128.9 -25.4 4.6 23.1 -18.5 32 32 A V - 0 0 14 -7,-0.2 2,-0.8 -4,-0.1 -1,-0.1 -0.684 62.2-142.1 -91.5 129.3 4.2 26.0 -16.1 33 33 A K > - 0 0 146 -2,-0.4 3,-2.2 1,-0.1 4,-0.5 -0.778 16.5-148.4 -83.7 111.5 3.4 29.6 -17.3 34 34 A Q T 3> S+ 0 0 77 -2,-0.8 4,-1.8 1,-0.3 3,-0.3 0.641 89.0 76.0 -59.1 -16.4 5.5 31.6 -14.8 35 35 A D H 3> S+ 0 0 117 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.742 88.8 62.5 -67.1 -20.2 3.1 34.5 -14.8 36 36 A R H <> S+ 0 0 20 -3,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.901 104.0 44.8 -69.4 -41.8 1.0 32.3 -12.6 37 37 A V H > S+ 0 0 9 -4,-0.5 4,-2.1 -3,-0.3 -2,-0.2 0.864 108.3 60.2 -68.2 -34.3 3.7 32.3 -10.0 38 38 A A H X S+ 0 0 48 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.874 106.6 45.6 -60.7 -38.6 3.9 36.0 -10.5 39 39 A Q H X S+ 0 0 25 -4,-1.6 4,-2.5 2,-0.2 -1,-0.2 0.890 108.3 54.9 -72.1 -42.1 0.3 36.5 -9.5 40 40 A L H < S+ 0 0 0 -4,-1.9 7,-0.2 1,-0.2 -2,-0.2 0.896 114.2 42.6 -57.7 -38.7 0.6 34.2 -6.5 41 41 A N H >< S+ 0 0 77 -4,-2.1 3,-1.4 1,-0.2 4,-0.2 0.860 109.0 57.4 -76.2 -35.7 3.4 36.5 -5.4 42 42 A E H 3< S+ 0 0 126 -4,-2.0 3,-0.3 1,-0.3 -2,-0.2 0.897 119.4 31.5 -61.2 -39.2 1.6 39.7 -6.3 43 43 A W T 3X S+ 0 0 53 -4,-2.5 4,-2.2 1,-0.2 3,-0.3 -0.059 81.9 127.1-109.1 32.8 -1.3 38.7 -4.0 44 44 A R H <> + 0 0 58 -3,-1.4 4,-3.0 1,-0.2 5,-0.3 0.843 66.2 61.4 -57.6 -38.0 0.9 36.8 -1.5 45 45 A T H > S+ 0 0 78 -3,-0.3 4,-2.0 -4,-0.2 -1,-0.2 0.941 110.6 39.0 -56.2 -49.5 -0.5 38.8 1.5 46 46 A E H > S+ 0 0 36 -3,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.878 113.7 55.1 -68.6 -39.5 -4.0 37.6 0.8 47 47 A L H X S+ 0 0 0 -4,-2.2 4,-2.1 -7,-0.2 -2,-0.2 0.948 112.5 43.6 -58.5 -47.4 -2.9 34.1 -0.0 48 48 A E H X S+ 0 0 15 -4,-3.0 4,-2.4 1,-0.2 5,-0.2 0.860 109.9 55.8 -66.7 -36.6 -1.1 33.9 3.3 49 49 A N H X S+ 0 0 49 -4,-2.0 4,-2.9 -5,-0.3 -1,-0.2 0.889 109.9 47.4 -62.2 -38.6 -4.0 35.4 5.1 50 50 A G H X S+ 0 0 0 -4,-2.4 4,-1.1 2,-0.2 -2,-0.2 0.898 111.0 49.8 -69.1 -41.4 -6.2 32.6 3.7 51 51 A I H < S+ 0 0 0 -4,-2.1 4,-0.3 -5,-0.2 -2,-0.2 0.890 118.9 39.2 -63.0 -40.8 -3.7 29.9 4.7 52 52 A Y H >< S+ 0 0 49 -4,-2.4 3,-1.4 1,-0.2 4,-0.4 0.877 106.2 63.1 -76.9 -42.8 -3.5 31.3 8.2 53 53 A A H >X S+ 0 0 4 -4,-2.9 4,-1.5 1,-0.3 3,-1.4 0.796 87.1 74.9 -55.6 -30.9 -7.2 32.2 8.7 54 54 A A T 3< S+ 0 0 0 -4,-1.1 -1,-0.3 1,-0.3 -2,-0.1 0.838 104.0 36.3 -52.1 -37.6 -8.2 28.5 8.3 55 55 A D T <4 S+ 0 0 25 -3,-1.4 -1,-0.3 -4,-0.3 -2,-0.2 0.404 120.4 45.9 -97.8 1.3 -6.8 27.7 11.8 56 56 A Y T <4 S+ 0 0 91 -3,-1.4 2,-0.3 -4,-0.4 -2,-0.2 0.540 104.5 32.6-125.3 -3.2 -7.8 30.9 13.6 57 57 A E S X S- 0 0 94 -4,-1.5 4,-1.9 -3,-0.0 5,-0.2 -0.988 78.0 -60.2-153.0 161.1 -11.4 32.1 12.9 58 58 A N T 4 S+ 0 0 75 -2,-0.3 -3,-0.0 1,-0.3 -2,-0.0 -0.496 105.4 18.2 -78.2 152.6 -14.9 31.0 12.0 59 59 A P T >4 S+ 0 0 73 0, 0.0 3,-1.7 0, 0.0 -1,-0.3 -0.986 124.3 56.2 -82.8 -11.6 -16.3 29.5 10.0 60 60 A Y T 34 S+ 0 0 25 1,-0.3 -2,-0.2 2,-0.1 8,-0.2 0.776 112.8 37.5 -48.1 -43.4 -13.0 28.0 8.9 61 61 A Y T 3X>S- 0 0 51 -4,-1.9 5,-2.9 -8,-0.2 4,-0.9 0.296 102.6-126.5-100.0 13.2 -11.9 26.5 12.3 62 62 A D T X45S- 0 0 36 -3,-1.7 3,-1.6 -5,-0.2 5,-0.3 0.903 71.6 -45.8 46.8 60.5 -15.4 25.4 13.3 63 63 A N T 345S- 0 0 120 1,-0.3 -1,-0.2 2,-0.1 -5,-0.0 0.904 111.3 -54.7 52.4 46.0 -15.6 27.0 16.7 64 64 A S T 345S+ 0 0 71 1,-0.1 -1,-0.3 -3,-0.1 -2,-0.2 0.621 123.4 100.8 65.5 15.7 -12.1 25.8 17.6 65 65 A T T <<5S- 0 0 49 -3,-1.6 -3,-0.2 -4,-0.9 -2,-0.1 0.585 70.7-150.6-101.0 -14.7 -12.9 22.1 16.9 66 66 A F > < + 0 0 66 -5,-2.9 3,-2.0 1,-0.1 -4,-0.2 0.736 40.6 151.4 51.1 28.0 -11.2 22.2 13.5 67 67 A A G > + 0 0 2 -5,-0.3 3,-1.4 1,-0.3 19,-0.3 0.844 65.6 58.5 -56.8 -35.6 -13.7 19.5 12.3 68 68 A S G 3 S+ 0 0 2 1,-0.3 -1,-0.3 17,-0.2 21,-0.2 0.553 94.0 69.0 -73.7 -3.7 -13.5 20.8 8.7 69 69 A H G < S+ 0 0 0 -3,-2.0 2,-0.3 16,-0.1 -1,-0.3 0.410 92.3 70.8 -93.3 2.4 -9.7 20.1 8.7 70 70 A F < + 0 0 9 -3,-1.4 16,-2.5 14,-0.2 17,-0.2 -0.867 50.3 169.3-119.7 153.6 -10.2 16.4 8.9 71 71 A Y - 0 0 5 57,-2.4 7,-0.2 -2,-0.3 60,-0.1 -0.744 19.1-156.9-165.1 110.9 -11.3 13.8 6.3 72 72 A D B >>> -A 77 0A 18 5,-2.8 4,-2.1 -2,-0.2 3,-0.6 -0.831 12.1-154.1 -90.8 114.5 -11.1 10.0 6.5 73 73 A P T 345S+ 0 0 13 0, 0.0 -1,-0.1 0, 0.0 108,-0.1 0.720 87.9 60.7 -62.2 -21.6 -11.3 8.8 2.9 74 74 A D T 345S+ 0 0 125 1,-0.2 107,-0.0 3,-0.1 -2,-0.0 0.845 124.4 14.7 -77.6 -33.6 -12.7 5.4 3.9 75 75 A N T <45S- 0 0 81 -3,-0.6 -1,-0.2 2,-0.2 3,-0.1 0.406 97.1-128.0-117.1 -2.2 -15.9 6.7 5.5 76 76 A G T <5 + 0 0 23 -4,-2.1 2,-0.2 1,-0.2 9,-0.1 0.706 67.7 119.6 63.3 22.9 -15.8 10.2 4.0 77 77 A K B < -A 72 0A 128 -5,-0.6 -5,-2.8 7,-0.1 -1,-0.2 -0.722 58.1-132.9-118.7 166.6 -16.2 11.8 7.5 78 78 A T - 0 0 8 5,-0.4 4,-0.1 2,-0.4 5,-0.1 -0.447 47.8 -88.4-101.2-178.2 -14.4 14.1 9.9 79 79 A Y S S+ 0 0 71 -12,-0.2 -12,-0.1 -2,-0.2 54,-0.1 0.541 109.9 67.4 -75.2 -6.1 -14.1 13.2 13.6 80 80 A I S > S- 0 0 59 -13,-0.1 3,-2.0 4,-0.1 -2,-0.4 -0.965 94.1-110.7-116.3 121.6 -17.4 14.8 14.7 81 81 A P T 3 S+ 0 0 95 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.181 97.8 5.9 -50.5 136.3 -20.6 13.2 13.5 82 82 A F T 3 S+ 0 0 219 1,-0.2 2,-0.1 -4,-0.1 -5,-0.0 0.354 97.9 132.1 72.1 -3.6 -22.5 15.3 11.0 83 83 A A < - 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