==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 06-JAN-10 3LA4 . COMPND 2 MOLECULE: UREASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CANAVALIA ENSIFORMIS; . AUTHOR K.PONNURAJ . 837 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32628.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 568 67.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 63 7.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 93 11.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 7 0.8 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 0.1 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 . 66 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 107 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 176 21.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 1.7 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 5 2 0 2 3 2 2 0 2 0 2 0 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 4 3 3 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 PARALLEL BRIDGES PER LADDER . 1 4 6 4 1 0 1 2 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 . 5 2 0 3 0 0 0 0 0 1 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 0 190 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -28.6 -84.7 -41.6 90.2 2 2 A K - 0 0 204 1,-0.2 2,-0.3 0, 0.0 0, 0.0 0.941 360.0-165.1 53.4 52.3 -85.1 -40.2 86.7 3 3 A L - 0 0 73 4,-0.1 -1,-0.2 2,-0.0 0, 0.0 -0.521 8.6-146.1 -74.0 129.9 -81.9 -38.2 87.1 4 4 A S >> - 0 0 25 -2,-0.3 4,-1.8 1,-0.1 3,-0.6 -0.491 33.3 -99.4 -86.4 163.5 -81.3 -35.4 84.6 5 5 A P H 3> S+ 0 0 108 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.893 122.8 53.0 -52.3 -43.2 -77.8 -34.7 83.5 6 6 A R H 3> S+ 0 0 106 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.843 105.5 53.5 -64.0 -33.7 -77.5 -31.7 85.8 7 7 A E H <> S+ 0 0 93 -3,-0.6 4,-1.7 2,-0.2 -1,-0.2 0.918 109.6 48.2 -66.5 -41.6 -78.5 -33.7 88.9 8 8 A V H X S+ 0 0 82 -4,-1.8 4,-1.6 1,-0.2 -2,-0.2 0.923 113.1 49.5 -62.3 -43.4 -75.8 -36.3 88.1 9 9 A E H X S+ 0 0 30 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.888 109.4 50.0 -59.5 -49.3 -73.4 -33.4 87.7 10 10 A K H X S+ 0 0 32 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.792 105.5 57.5 -64.9 -27.5 -74.4 -31.8 91.0 11 11 A L H X S+ 0 0 97 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.905 107.1 49.0 -68.0 -38.8 -74.0 -35.1 92.8 12 12 A G H X S+ 0 0 37 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.920 110.2 50.6 -64.3 -43.6 -70.4 -35.1 91.6 13 13 A L H X S+ 0 0 9 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.928 110.2 50.0 -59.0 -45.7 -70.0 -31.6 92.8 14 14 A H H X S+ 0 0 51 -4,-2.5 4,-2.9 1,-0.2 -1,-0.2 0.913 107.7 53.9 -59.3 -43.6 -71.4 -32.6 96.2 15 15 A N H X S+ 0 0 92 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.907 109.8 47.1 -57.3 -44.4 -68.9 -35.5 96.3 16 16 A A H X S+ 0 0 23 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.912 112.0 51.5 -64.1 -41.4 -66.0 -33.2 95.8 17 17 A G H X S+ 0 0 0 -4,-2.5 4,-2.1 20,-0.3 -2,-0.2 0.900 109.1 49.6 -61.9 -40.7 -67.5 -30.9 98.4 18 18 A Y H X S+ 0 0 84 -4,-2.9 4,-2.5 2,-0.2 -1,-0.2 0.887 107.7 53.9 -66.5 -38.9 -67.7 -33.8 100.9 19 19 A L H X S+ 0 0 28 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.938 109.9 48.5 -58.4 -45.7 -64.1 -34.8 100.2 20 20 A A H X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.879 109.8 52.4 -61.6 -39.6 -63.2 -31.2 101.0 21 21 A Q H X S+ 0 0 2 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.897 109.0 48.5 -64.9 -42.4 -65.2 -31.3 104.2 22 22 A K H X S+ 0 0 96 -4,-2.5 4,-1.0 2,-0.2 -2,-0.2 0.910 112.9 48.3 -65.2 -41.4 -63.5 -34.5 105.4 23 23 A R H ><>S+ 0 0 38 -4,-2.2 5,-2.4 -5,-0.2 3,-0.9 0.940 112.3 48.6 -63.2 -45.0 -60.1 -33.0 104.7 24 24 A L H ><5S+ 0 0 0 -4,-2.7 3,-2.1 1,-0.3 -2,-0.2 0.907 104.7 61.9 -59.1 -41.9 -61.1 -29.8 106.5 25 25 A A H 3<5S+ 0 0 16 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.760 104.0 46.7 -58.1 -29.1 -62.3 -32.0 109.4 26 26 A R T <<5S- 0 0 171 -4,-1.0 -1,-0.3 -3,-0.9 -2,-0.2 0.348 128.4 -95.4 -96.1 7.8 -58.9 -33.4 110.0 27 27 A G T < 5 + 0 0 11 -3,-2.1 98,-0.4 1,-0.3 -3,-0.2 0.610 67.9 158.3 93.9 12.2 -57.3 -30.0 109.9 28 28 A V < - 0 0 37 -5,-2.4 2,-0.9 -6,-0.2 -1,-0.3 -0.497 43.2-129.8 -71.3 136.0 -56.2 -29.8 106.2 29 29 A R - 0 0 60 -2,-0.2 41,-0.3 41,-0.1 42,-0.1 -0.801 34.9-131.4 -86.6 109.0 -55.7 -26.3 104.8 30 30 A L B -a 70 0A 0 39,-2.2 41,-2.7 -2,-0.9 44,-0.2 -0.246 12.5-136.7 -65.7 146.8 -57.7 -26.5 101.6 31 31 A N > - 0 0 2 39,-0.2 4,-2.5 805,-0.1 5,-0.2 -0.388 39.4 -83.8 -93.2 176.8 -56.4 -25.4 98.2 32 32 A Y H > S+ 0 0 53 802,-0.6 4,-2.3 1,-0.2 5,-0.2 0.901 126.8 48.3 -44.9 -56.7 -58.3 -23.4 95.7 33 33 A T H > S+ 0 0 30 801,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.887 113.5 46.3 -56.3 -44.9 -60.1 -26.4 94.1 34 34 A E H > S+ 0 0 13 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.881 110.2 54.1 -68.1 -37.9 -61.2 -27.9 97.4 35 35 A A H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.927 109.8 47.2 -62.0 -45.9 -62.4 -24.5 98.7 36 36 A V H X S+ 0 0 7 -4,-2.3 4,-2.7 -5,-0.2 5,-0.3 0.938 112.0 50.5 -60.5 -47.8 -64.7 -24.0 95.7 37 37 A A H X S+ 0 0 7 -4,-2.1 4,-2.1 -5,-0.2 -20,-0.3 0.913 113.5 45.1 -57.6 -45.8 -66.1 -27.5 96.0 38 38 A L H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.950 115.2 45.1 -65.4 -50.9 -66.9 -27.1 99.7 39 39 A I H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.920 115.4 47.0 -61.0 -45.7 -68.5 -23.6 99.4 40 40 A A H X S+ 0 0 0 -4,-2.7 4,-1.8 -5,-0.2 -1,-0.2 0.903 113.0 49.6 -63.8 -41.5 -70.5 -24.5 96.3 41 41 A S H X S+ 0 0 0 -4,-2.1 4,-2.2 -5,-0.3 -1,-0.2 0.879 109.2 52.0 -65.5 -37.8 -71.7 -27.7 97.9 42 42 A Q H X S+ 0 0 1 -4,-2.4 4,-2.7 2,-0.2 5,-0.3 0.895 106.1 53.7 -66.6 -39.1 -72.7 -26.0 101.1 43 43 A I H X S+ 0 0 1 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.917 109.4 49.7 -61.3 -40.7 -74.8 -23.4 99.2 44 44 A M H X S+ 0 0 21 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.920 110.9 49.4 -63.8 -42.5 -76.6 -26.3 97.5 45 45 A E H X S+ 0 0 53 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.906 110.3 48.5 -64.1 -43.9 -77.3 -28.0 100.9 46 46 A Y H X>S+ 0 0 21 -4,-2.7 4,-1.0 1,-0.2 5,-0.8 0.877 110.6 52.6 -64.3 -35.5 -78.6 -24.9 102.6 47 47 A A H ><5S+ 0 0 2 -4,-2.0 3,-0.7 -5,-0.3 -1,-0.2 0.912 106.1 53.8 -64.7 -40.7 -80.9 -24.4 99.5 48 48 A R H 3<5S+ 0 0 181 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.869 103.9 56.3 -60.9 -36.6 -82.1 -27.9 100.0 49 49 A D H 3<5S- 0 0 76 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.776 96.8-147.8 -66.6 -27.2 -83.0 -27.1 103.6 50 50 A G T <<5 + 0 0 33 -4,-1.0 -3,-0.1 -3,-0.7 -2,-0.1 0.707 67.6 106.2 67.4 22.7 -85.2 -24.2 102.3 51 51 A E < + 0 0 146 -5,-0.8 2,-0.4 2,-0.1 -4,-0.1 0.542 67.1 64.3-107.2 -10.6 -84.5 -22.0 105.3 52 52 A K S S- 0 0 69 -6,-0.6 -2,-0.1 -5,-0.1 2,-0.1 -0.917 70.2-138.4-119.5 143.3 -82.2 -19.5 103.7 53 53 A T > - 0 0 75 -2,-0.4 4,-2.3 1,-0.1 5,-0.2 -0.382 33.9-103.1 -88.0 170.5 -82.8 -17.0 100.9 54 54 A V H > S+ 0 0 45 1,-0.2 4,-1.6 2,-0.2 5,-0.2 0.934 124.6 51.1 -58.0 -46.0 -80.4 -16.2 98.1 55 55 A A H > S+ 0 0 66 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.873 109.0 50.7 -60.2 -40.1 -79.4 -13.0 99.9 56 56 A Q H >> S+ 0 0 87 1,-0.2 4,-2.9 2,-0.2 3,-0.6 0.909 110.2 48.6 -66.0 -41.5 -78.7 -14.8 103.1 57 57 A L H 3X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.3 -1,-0.2 0.778 99.7 65.0 -70.2 -25.7 -76.5 -17.4 101.5 58 58 A M H 3< S+ 0 0 54 -4,-1.6 39,-0.4 -5,-0.2 -1,-0.2 0.807 115.0 35.2 -64.3 -26.6 -74.5 -14.7 99.7 59 59 A X H X< S+ 0 0 129 -4,-0.7 3,-1.7 -3,-0.6 4,-0.3 0.898 114.6 52.0 -91.0 -50.9 -73.6 -13.8 103.3 60 60 A L H >< S+ 0 0 12 -4,-2.9 3,-2.3 1,-0.3 4,-0.3 0.860 101.8 64.7 -57.4 -36.9 -73.4 -17.2 105.0 61 61 A G G >< S+ 0 0 0 -4,-2.5 3,-0.5 1,-0.3 4,-0.4 0.712 96.2 57.3 -59.4 -20.3 -71.0 -18.3 102.2 62 62 A Q G < S+ 0 0 31 -3,-1.7 39,-0.8 1,-0.2 -1,-0.3 0.508 102.6 54.8 -87.9 -5.2 -68.5 -15.8 103.4 63 63 A H G < S+ 0 0 29 -3,-2.3 43,-4.3 -4,-0.3 47,-0.2 0.306 86.6 81.8-110.0 8.4 -68.4 -17.3 106.8 64 64 A L S < S+ 0 0 0 -3,-0.5 2,-0.4 -4,-0.3 46,-0.3 0.952 95.6 26.6 -78.6 -53.1 -67.5 -20.9 105.9 65 65 A L - 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0 0 10 -2,-0.4 2,-1.7 -41,-0.2 -41,-0.3 -0.350 34.1 -97.0 -85.2 170.5 -64.6 -19.7 109.4 106 106 A E >> - 0 0 97 -43,-4.3 4,-1.9 1,-0.2 3,-1.6 -0.700 45.1-170.7 -86.7 84.7 -67.7 -20.9 111.2 107 107 A L H 3> S+ 0 0 7 -2,-1.7 4,-1.5 1,-0.3 -1,-0.2 0.684 78.4 62.2 -54.9 -23.8 -66.7 -24.5 110.8 108 108 A Q H 34 S+ 0 0 143 2,-0.2 -1,-0.3 1,-0.2 4,-0.1 0.864 109.7 43.3 -70.9 -32.5 -70.0 -25.9 112.0 109 109 A E H X4 S+ 0 0 54 -3,-1.6 3,-1.2 2,-0.2 -2,-0.2 0.897 109.9 54.8 -76.3 -39.9 -71.5 -24.2 109.0 110 110 A A H 3< S+ 0 0 0 -4,-1.9 -2,-0.2 -46,-0.3 -1,-0.2 0.808 116.5 39.8 -61.3 -28.1 -68.7 -25.3 106.7 111 111 A L T >X S+ 0 0 7 -4,-1.5 3,-2.4 -5,-0.2 4,-0.5 0.343 85.5 142.5-101.5 2.5 -69.5 -28.9 107.8 112 112 A F T <4 S+ 0 0 53 -3,-1.2 -67,-0.1 1,-0.3 -3,-0.1 -0.147 74.2 8.5 -48.2 132.9 -73.3 -28.4 107.8 113 113 A G T 34 S+ 0 0 45 1,-0.1 -1,-0.3 -68,-0.0 -4,-0.1 0.398 106.1 94.6 76.1 -3.5 -75.1 -31.5 106.6 114 114 A S T <4 S- 0 0 12 -3,-2.4 -2,-0.2 2,-0.1 -1,-0.1 0.694 78.7-142.1 -91.1 -21.4 -71.9 -33.6 106.6 115 115 A L < + 0 0 161 -4,-0.5 -3,-0.1 1,-0.3 3,-0.0 0.625 53.6 142.4 66.8 13.4 -72.4 -35.1 110.1 116 116 A L - 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