==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 18-JUL-12 4G64 . COMPND 2 MOLECULE: INOSITOL MONOPHOSPHATASE FAMILY PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS; . AUTHOR S.BHATTACHARYYA,D.DUTTA,A.K.GHOSH,A.K.DAS . 522 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22318.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 373 71.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 4.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 101 19.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 28 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 60 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 146 28.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.5 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 2 0 1 2 2 3 2 1 0 0 0 0 1 2 0 0 0 0 0 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 3 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 0 PARALLEL BRIDGES PER LADDER . 3 1 3 6 0 2 4 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 . 2 0 0 2 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 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 2 A T 0 0 176 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -19.7 -24.8 -24.7 41.1 2 3 A D - 0 0 164 1,-0.0 2,-0.3 0, 0.0 0, 0.0 -0.674 360.0-141.8 -70.2 135.9 -26.2 -21.5 39.3 3 4 A K - 0 0 101 -2,-0.3 2,-0.3 3,-0.0 -1,-0.0 -0.694 5.0-134.4-102.5 153.1 -23.2 -19.1 39.2 4 5 A T >> - 0 0 70 -2,-0.3 4,-1.7 1,-0.1 3,-0.7 -0.726 33.8-109.3 -92.9 157.5 -23.1 -15.3 39.6 5 6 A L H 3> S+ 0 0 34 -2,-0.3 4,-2.7 1,-0.2 5,-0.1 0.820 121.4 60.0 -50.4 -33.0 -21.1 -13.3 37.1 6 7 A Q H 3> S+ 0 0 99 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.897 104.6 47.9 -63.9 -41.9 -18.7 -12.7 40.0 7 8 A Q H <> S+ 0 0 99 -3,-0.7 4,-1.3 2,-0.2 -1,-0.2 0.833 112.5 48.4 -69.0 -32.2 -18.1 -16.4 40.3 8 9 A I H X S+ 0 0 10 -4,-1.7 4,-2.3 2,-0.2 3,-0.4 0.949 108.9 54.2 -72.6 -47.4 -17.5 -16.8 36.6 9 10 A D H X S+ 0 0 13 -4,-2.7 4,-3.0 1,-0.3 5,-0.2 0.842 105.5 52.3 -50.2 -41.0 -15.1 -13.9 36.6 10 11 A K H X S+ 0 0 131 -4,-1.7 4,-1.9 1,-0.2 -1,-0.3 0.887 108.6 51.6 -70.3 -35.5 -13.0 -15.4 39.3 11 12 A L H X S+ 0 0 34 -4,-1.3 4,-1.9 -3,-0.4 -2,-0.2 0.913 114.3 42.2 -63.7 -46.5 -12.8 -18.7 37.3 12 13 A I H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.940 113.6 51.8 -65.5 -44.1 -11.6 -16.9 34.1 13 14 A C H X S+ 0 0 23 -4,-3.0 4,-2.1 1,-0.3 -2,-0.2 0.902 112.2 46.6 -63.8 -38.6 -9.2 -14.5 35.9 14 15 A S H X S+ 0 0 49 -4,-1.9 4,-1.5 -5,-0.2 -1,-0.3 0.876 109.8 53.3 -70.6 -35.6 -7.6 -17.4 37.6 15 16 A W H X S+ 0 0 14 -4,-1.9 4,-0.9 1,-0.2 -2,-0.2 0.909 109.7 49.5 -64.5 -39.7 -7.4 -19.4 34.3 16 17 A L H X S+ 0 0 1 -4,-2.5 4,-0.9 1,-0.2 3,-0.5 0.884 106.9 54.6 -66.8 -41.3 -5.6 -16.4 32.7 17 18 A K H < S+ 0 0 86 -4,-2.1 3,-0.4 1,-0.2 4,-0.4 0.830 105.6 52.1 -62.0 -32.6 -3.2 -16.1 35.5 18 19 A Q H >X S+ 0 0 95 -4,-1.5 3,-0.9 1,-0.2 4,-0.6 0.708 95.0 69.0 -83.6 -12.0 -2.2 -19.7 35.1 19 20 A I H >X S+ 0 0 2 -4,-0.9 4,-2.2 -3,-0.5 3,-1.2 0.852 86.7 70.2 -63.3 -33.7 -1.6 -19.2 31.4 20 21 A D H 3< S+ 0 0 33 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.2 0.873 97.0 52.2 -45.9 -39.5 1.3 -17.1 32.8 21 22 A N H <4 S+ 0 0 135 -3,-0.9 -1,-0.3 -4,-0.4 4,-0.2 0.744 115.6 36.1 -71.7 -26.2 2.8 -20.5 33.7 22 23 A V H S+ 0 0 63 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.896 108.1 45.9 -58.8 -35.6 7.0 -18.9 28.2 25 26 A Q H > S+ 0 0 136 -3,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.866 110.7 54.1 -70.9 -36.3 7.6 -22.6 27.3 26 27 A L H < S+ 0 0 18 -4,-1.2 -1,-0.2 1,-0.2 -3,-0.1 0.874 110.4 46.3 -64.5 -38.2 5.3 -22.2 24.3 27 28 A I H >< S+ 0 0 33 -4,-2.7 3,-1.8 1,-0.2 -1,-0.2 0.886 106.0 61.1 -67.9 -33.9 7.3 -19.2 23.1 28 29 A M H 3< S+ 0 0 140 -4,-1.7 -2,-0.2 1,-0.3 -1,-0.2 0.860 115.9 30.9 -66.4 -34.4 10.5 -21.2 23.7 29 30 A E T 3< S+ 0 0 132 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 -0.173 91.3 160.7-115.3 36.3 9.6 -23.9 21.2 30 31 A M < - 0 0 47 -3,-1.8 2,-0.3 13,-0.1 -3,-0.1 -0.312 14.4-178.8 -57.1 131.4 7.6 -21.5 19.0 31 32 A T - 0 0 96 -5,-0.1 13,-1.3 -2,-0.1 2,-0.3 -0.986 9.7-151.5-133.2 149.3 6.9 -22.6 15.4 32 33 A T E +A 43 0A 65 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.884 14.0 175.6-122.1 146.3 5.1 -20.7 12.8 33 34 A E E -A 42 0A 104 9,-2.3 9,-1.8 -2,-0.3 2,-0.2 -0.940 29.7-112.2-136.5 169.3 3.0 -21.5 9.7 34 35 A T E -A 41 0A 85 -2,-0.3 7,-0.2 7,-0.2 4,-0.1 -0.650 23.7-178.2 -88.8 155.0 1.0 -19.7 7.1 35 36 A K S S+ 0 0 87 5,-2.9 -1,-0.2 2,-0.6 6,-0.1 0.544 79.7 3.7-108.7 -83.7 -2.8 -20.0 7.0 36 37 A R S S- 0 0 206 1,-0.2 2,-0.3 4,-0.2 5,-0.1 0.869 129.5 -36.4 -73.2 -41.1 -4.3 -18.0 4.0 37 38 A H S > S- 0 0 101 3,-0.3 3,-1.9 0, 0.0 -2,-0.6 -0.899 85.3 -55.6-172.1-177.6 -1.0 -16.7 2.4 38 39 A R T 3 S+ 0 0 60 1,-0.3 -2,-0.0 -2,-0.3 3,-0.0 0.691 129.8 43.2 -51.2 -37.4 2.5 -15.4 3.4 39 40 A F T 3 S+ 0 0 116 1,-0.1 2,-0.5 2,-0.1 -1,-0.3 0.028 95.0 90.0-100.9 25.0 1.4 -12.6 5.8 40 41 A D < - 0 0 37 -3,-1.9 -5,-2.9 2,-0.0 -3,-0.3 -0.803 63.7-178.5-132.2 92.7 -1.3 -14.7 7.5 41 42 A L E +A 34 0A 21 -2,-0.5 2,-0.3 -7,-0.2 -7,-0.2 -0.441 24.6 177.7-104.7 152.6 0.2 -16.5 10.5 42 43 A V E -A 33 0A 4 -9,-1.8 -9,-2.3 -2,-0.2 2,-0.3 -0.959 12.7-167.1-147.8 142.1 -0.6 -18.9 13.2 43 44 A T E > -A 32 0A 1 -2,-0.3 4,-2.0 -11,-0.2 -11,-0.2 -0.776 41.3-101.8-118.7 166.9 1.8 -20.4 15.9 44 45 A N H > S+ 0 0 29 -13,-1.3 4,-2.4 -2,-0.3 5,-0.3 0.702 121.6 64.5 -53.5 -24.8 1.7 -23.2 18.4 45 46 A V H > S+ 0 0 0 -14,-0.3 4,-2.3 2,-0.2 5,-0.4 0.972 102.6 45.7 -69.5 -49.0 1.0 -20.4 20.9 46 47 A D H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.945 117.1 44.9 -51.6 -52.9 -2.4 -19.6 19.2 47 48 A K H X S+ 0 0 92 -4,-2.0 4,-2.7 1,-0.2 -1,-0.2 0.907 115.1 44.8 -66.2 -45.8 -3.4 -23.3 19.0 48 49 A Q H X S+ 0 0 86 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.909 111.9 50.4 -65.9 -45.1 -2.4 -24.4 22.5 49 50 A I H X S+ 0 0 0 -4,-2.3 4,-2.0 -5,-0.3 -2,-0.2 0.947 115.8 45.5 -57.1 -47.9 -3.9 -21.4 24.3 50 51 A Q H X S+ 0 0 12 -4,-2.0 4,-2.2 -5,-0.4 -2,-0.2 0.922 111.1 50.3 -62.7 -47.3 -7.1 -22.0 22.4 51 52 A Q H X S+ 0 0 57 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.944 110.9 51.9 -55.5 -40.6 -7.2 -25.8 23.0 52 53 A Q H X S+ 0 0 48 -4,-2.7 4,-2.2 1,-0.3 -1,-0.2 0.863 108.0 49.4 -73.2 -33.1 -6.7 -25.2 26.7 53 54 A F H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 -1,-0.3 0.894 109.0 52.1 -67.8 -39.9 -9.5 -22.8 26.9 54 55 A Q H X S+ 0 0 75 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.933 111.3 48.3 -55.8 -47.2 -11.8 -25.2 25.1 55 56 A Q H X S+ 0 0 122 -4,-2.6 4,-1.3 1,-0.2 -2,-0.2 0.879 109.7 53.3 -61.0 -39.4 -10.7 -27.9 27.7 56 57 A F H X S+ 0 0 11 -4,-2.2 4,-1.1 2,-0.2 5,-0.5 0.914 109.4 48.0 -61.2 -44.0 -11.4 -25.3 30.5 57 58 A L H >X S+ 0 0 1 -4,-2.7 4,-2.7 1,-0.2 3,-0.7 0.952 107.7 56.1 -64.1 -42.6 -14.9 -24.8 29.2 58 59 A A H 3< S+ 0 0 59 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.788 113.5 37.9 -60.9 -31.2 -15.6 -28.5 28.9 59 60 A T H 3< S+ 0 0 111 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.545 132.1 23.1-101.0 -6.3 -14.8 -29.2 32.6 60 61 A Y H << S+ 0 0 88 -4,-1.1 -3,-0.2 -3,-0.7 -2,-0.2 0.682 133.2 27.9-121.7 -38.9 -16.3 -26.1 34.2 61 62 A F >< + 0 0 8 -4,-2.7 3,-1.6 -5,-0.5 -2,-0.1 -0.632 66.0 170.7-125.5 69.6 -18.9 -24.8 31.8 62 63 A P T 3 S+ 0 0 98 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.674 75.7 47.2 -69.5 -17.0 -20.2 -27.8 29.8 63 64 A E T 3 S+ 0 0 151 -6,-0.1 19,-0.3 2,-0.1 2,-0.2 0.562 92.1 101.0 -90.0 -9.6 -23.2 -26.2 28.0 64 65 A H < - 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