==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=17-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 14-DEC-11 4AC7 . COMPND 2 MOLECULE: UREASE SUBUNIT GAMMA; . SOURCE 2 ORGANISM_SCIENTIFIC: SPOROSARCINA PASTEURII; . AUTHOR S.BENINI,P.KOSIKOWSKA,M.CIANCI,A.GONZALEZ VARA,L.BERLICKI,S. . 792 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30450.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 544 68.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 62 7.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 89 11.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 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 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 60 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 101 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 170 21.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 1.9 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 3 0 3 2 0 2 2 3 0 1 0 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 3 2 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 5 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 . 4 3 1 1 1 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 X 0 0 246 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -35.8 -15.2 73.7 88.9 2 2 A H - 0 0 165 1,-0.2 2,-0.2 2,-0.0 0, 0.0 0.924 360.0-165.3 64.3 47.2 -15.7 75.2 85.4 3 3 A L - 0 0 72 4,-0.1 -1,-0.2 2,-0.1 0, 0.0 -0.418 4.9-154.1 -67.2 132.6 -12.5 77.2 85.6 4 4 A N > - 0 0 81 -2,-0.2 4,-2.0 1,-0.0 5,-0.2 -0.414 37.0 -90.9 -94.7 175.8 -12.1 80.0 83.0 5 5 A P H > S+ 0 0 95 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.900 125.1 48.6 -59.9 -40.2 -8.7 81.3 81.8 6 6 A A H > S+ 0 0 11 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.885 107.9 54.2 -65.4 -39.5 -8.4 84.0 84.4 7 7 A E H > S+ 0 0 89 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.926 110.2 48.0 -62.7 -42.9 -9.3 81.7 87.3 8 8 A K H X S+ 0 0 132 -4,-2.0 4,-0.6 1,-0.2 3,-0.3 0.920 114.2 46.1 -60.2 -44.7 -6.5 79.3 86.2 9 9 A E H >< S+ 0 0 30 -4,-2.1 3,-1.2 1,-0.2 4,-0.5 0.898 107.9 55.3 -64.5 -43.6 -4.0 82.2 85.9 10 10 A K H >X S+ 0 0 37 -4,-2.7 4,-1.7 1,-0.3 3,-0.6 0.717 91.5 71.4 -72.8 -19.8 -4.9 83.8 89.2 11 11 A L H 3X S+ 0 0 103 -4,-1.2 4,-2.3 -3,-0.3 -1,-0.3 0.859 93.7 59.4 -54.3 -37.0 -4.3 80.5 91.2 12 12 A Q H S+ 0 0 9 -3,-0.6 4,-2.5 -4,-0.5 28,-0.2 0.937 108.8 48.8 -65.7 -46.3 -0.7 84.6 92.2 14 14 A F H X S+ 0 0 92 -4,-1.7 4,-2.5 1,-0.2 -2,-0.2 0.927 112.7 48.8 -56.9 -47.4 -2.1 82.9 95.3 15 15 A L H X S+ 0 0 121 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.923 110.4 49.0 -60.4 -45.2 0.7 80.3 95.1 16 16 A A H X S+ 0 0 19 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.869 111.0 52.0 -63.6 -37.3 3.4 82.9 94.6 17 17 A S H X S+ 0 0 4 -4,-2.5 4,-2.7 20,-0.3 -2,-0.2 0.920 108.0 50.7 -63.7 -44.4 2.0 84.8 97.7 18 18 A E H X S+ 0 0 89 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.923 111.9 48.3 -58.5 -43.7 2.1 81.6 99.8 19 19 A L H X S+ 0 0 46 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.929 113.3 46.9 -58.7 -49.2 5.8 81.0 98.7 20 20 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.869 108.9 54.2 -65.8 -39.3 6.7 84.6 99.5 21 21 A L H X S+ 0 0 75 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.885 107.9 50.7 -63.2 -37.5 4.9 84.5 102.9 22 22 A R H X S+ 0 0 100 -4,-1.9 4,-1.4 -5,-0.2 -2,-0.2 0.910 110.2 49.9 -66.4 -38.1 6.9 81.4 103.8 23 23 A R H <>S+ 0 0 30 -4,-1.9 5,-2.0 1,-0.2 3,-0.2 0.911 111.9 47.5 -64.4 -44.0 10.1 83.3 102.9 24 24 A K H ><5S+ 0 0 81 -4,-2.5 3,-2.0 1,-0.2 -2,-0.2 0.921 107.3 57.8 -62.0 -43.1 9.1 86.3 105.0 25 25 A A H 3<5S+ 0 0 88 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.799 103.3 52.3 -62.0 -30.4 8.3 84.0 107.9 26 26 A R T 3<5S- 0 0 169 -4,-1.4 -1,-0.3 -3,-0.2 -2,-0.2 0.362 128.4 -95.2 -92.6 11.6 11.8 82.6 108.0 27 27 A G T < 5S+ 0 0 66 -3,-2.0 2,-0.3 1,-0.3 -3,-0.2 0.498 72.9 144.3 102.9 9.0 13.3 86.1 108.1 28 28 A L < - 0 0 83 -5,-2.0 2,-0.4 1,-0.1 -1,-0.3 -0.567 51.3-123.8 -84.3 139.5 14.1 87.0 104.5 29 29 A K - 0 0 83 -2,-0.3 40,-0.3 40,-0.1 2,-0.1 -0.670 42.1-119.2 -70.8 129.2 13.8 90.5 103.1 30 30 A L B -a 69 0A 0 38,-2.7 40,-2.9 -2,-0.4 43,-0.1 -0.423 21.0-138.4 -82.5 152.6 11.5 90.1 100.1 31 31 A N > - 0 0 7 38,-0.2 4,-2.5 -2,-0.1 5,-0.2 -0.206 36.1 -82.3 -97.5-174.4 12.3 90.9 96.5 32 32 A Y H > S+ 0 0 49 758,-2.3 4,-2.5 2,-0.2 5,-0.2 0.959 124.5 39.0 -62.5 -57.6 10.3 92.5 93.7 33 33 A P H > S+ 0 0 25 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.894 116.4 53.2 -66.4 -31.5 8.1 89.6 92.5 34 34 A E H > S+ 0 0 13 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.937 111.0 46.1 -61.6 -48.1 7.6 88.3 96.1 35 35 A A H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 5,-0.3 0.918 113.2 48.7 -61.3 -45.9 6.4 91.7 97.2 36 36 A V H X S+ 0 0 9 -4,-2.5 4,-2.6 -5,-0.2 5,-0.2 0.938 110.8 51.8 -62.1 -42.6 4.1 92.1 94.2 37 37 A A H X S+ 0 0 10 -4,-2.7 4,-2.6 -5,-0.2 -20,-0.3 0.920 109.4 48.8 -59.4 -46.6 2.6 88.6 94.8 38 38 A I H X S+ 0 0 8 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.943 114.9 43.4 -61.2 -47.9 1.8 89.2 98.5 39 39 A I H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.912 114.2 51.1 -67.2 -39.7 0.1 92.5 97.9 40 40 A T H X S+ 0 0 1 -4,-2.6 4,-2.2 -5,-0.3 -2,-0.2 0.942 111.1 46.5 -63.1 -46.5 -1.8 91.2 94.8 41 41 A S H X S+ 0 0 8 -4,-2.6 4,-3.0 1,-0.2 5,-0.3 0.905 108.6 57.3 -64.4 -37.0 -3.1 88.1 96.6 42 42 A F H X S+ 0 0 68 -4,-2.1 4,-2.1 -5,-0.3 -1,-0.2 0.924 108.1 47.3 -56.3 -47.0 -4.1 90.4 99.5 43 43 A I H X S+ 0 0 1 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.931 112.9 47.6 -61.9 -47.3 -6.3 92.5 97.2 44 44 A M H X S+ 0 0 20 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.920 113.4 47.4 -66.2 -39.8 -8.0 89.4 95.6 45 45 A E H X S+ 0 0 91 -4,-3.0 4,-1.9 1,-0.2 -1,-0.2 0.856 109.2 55.6 -67.7 -32.8 -8.7 87.8 98.9 46 46 A G H X>S+ 0 0 2 -4,-2.1 5,-2.2 -5,-0.3 4,-0.5 0.885 106.1 49.9 -65.3 -39.2 -10.1 91.1 100.2 47 47 A A H ><5S+ 0 0 1 -4,-2.1 3,-1.2 1,-0.2 -2,-0.2 0.915 109.4 52.1 -61.3 -42.8 -12.5 91.3 97.3 48 48 A R H 3<5S+ 0 0 187 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.861 105.5 55.4 -61.7 -36.9 -13.5 87.7 98.2 49 49 A D H 3<5S- 0 0 118 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.599 121.5-109.6 -68.9 -17.1 -14.1 88.9 101.7 50 50 A G T <<5 + 0 0 37 -3,-1.2 -3,-0.2 -4,-0.5 -2,-0.1 0.592 64.0 152.0 94.4 16.2 -16.5 91.6 100.4 51 51 A K < - 0 0 60 -5,-2.2 -1,-0.2 1,-0.1 2,-0.2 -0.249 46.0-107.5 -66.8 160.5 -14.4 94.6 101.1 52 52 A T > - 0 0 69 1,-0.1 4,-2.0 34,-0.1 5,-0.2 -0.504 21.4-113.3 -85.0 161.4 -14.9 97.7 98.9 53 53 A V H > S+ 0 0 45 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.930 120.1 53.5 -56.7 -43.1 -12.5 98.9 96.2 54 54 A A H > S+ 0 0 59 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.915 106.6 51.0 -61.8 -42.8 -11.9 102.0 98.4 55 55 A M H > S+ 0 0 85 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.910 111.6 48.0 -58.9 -42.5 -11.0 99.9 101.5 56 56 A L H X S+ 0 0 1 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.837 104.5 57.9 -73.7 -33.3 -8.5 97.9 99.5 57 57 A M H < S+ 0 0 79 -4,-2.2 39,-0.2 2,-0.2 -1,-0.2 0.840 115.2 40.0 -58.6 -34.9 -6.9 101.0 98.0 58 58 A E H >< S+ 0 0 133 -4,-1.3 3,-1.5 -3,-0.2 -2,-0.2 0.937 117.8 45.0 -76.0 -56.3 -6.2 102.1 101.6 59 59 A E H >< S+ 0 0 55 -4,-3.0 3,-2.3 1,-0.3 4,-0.2 0.825 100.7 68.3 -63.1 -35.5 -5.3 98.7 103.1 60 60 A G G >< S+ 0 0 0 -4,-2.4 3,-0.6 1,-0.3 4,-0.3 0.711 92.3 61.6 -58.8 -19.9 -3.0 97.8 100.2 61 61 A K G < S+ 0 0 73 -3,-1.5 39,-0.3 -4,-0.2 -1,-0.3 0.420 105.8 46.7 -84.0 -1.0 -0.6 100.5 101.3 62 62 A H G < S+ 0 0 152 -3,-2.3 -1,-0.2 -4,-0.1 -2,-0.2 0.211 82.5 90.7-126.1 13.1 -0.0 98.8 104.7 63 63 A V S < S+ 0 0 37 -3,-0.6 2,-0.4 1,-0.3 -2,-0.1 0.914 99.5 16.5 -76.9 -44.5 0.6 95.2 103.8 64 64 A L - 0 0 4 -4,-0.3 36,-0.3 34,-0.3 -1,-0.3 -0.979 69.8-159.3-130.0 141.9 4.4 95.5 103.5 65 65 A T > - 0 0 64 -2,-0.4 3,-2.2 34,-0.1 4,-0.4 -0.685 39.9 -94.9-113.1 172.8 6.7 98.2 104.7 66 66 A R G > S+ 0 0 97 34,-0.4 3,-1.3 1,-0.3 7,-0.1 0.829 122.2 60.2 -63.1 -31.4 10.2 99.1 103.6 67 67 A D G 3 S+ 0 0 113 1,-0.2 -1,-0.3 -38,-0.0 4,-0.1 0.611 98.7 60.5 -69.2 -11.2 11.9 97.0 106.3 68 68 A D G < S+ 0 0 31 -3,-2.2 -38,-2.7 -39,-0.1 2,-0.3 0.589 105.6 52.0 -85.6 -13.1 10.1 93.9 104.8 69 69 A V B < S-a 30 0A 9 -3,-1.3 -38,-0.2 -4,-0.4 3,-0.1 -0.810 88.2 -91.7-129.4 162.1 11.8 94.2 101.4 70 70 A M > - 0 0 37 -40,-2.9 3,-1.8 -2,-0.3 -1,-0.1 -0.201 60.5 -72.9 -67.8 161.7 15.2 94.5 99.8 71 71 A E T 3 S+ 0 0 87 1,-0.2 -1,-0.2 2,-0.1 -4,-0.0 -0.274 119.4 14.9 -53.9 133.8 16.9 97.8 99.0 72 72 A G T 3> S+ 0 0 0 -3,-0.1 4,-1.4 33,-0.1 -1,-0.2 0.177 93.4 107.2 87.2 -18.4 15.2 99.6 96.0 73 73 A V H <> S+ 0 0 0 -3,-1.8 4,-1.2 1,-0.2 3,-0.3 0.903 75.3 54.8 -63.0 -40.0 12.1 97.4 96.0 74 74 A P H 4 S+ 0 0 6 0, 0.0 3,-0.4 0, 0.0 25,-0.3 0.912 111.6 45.2 -58.2 -39.4 9.8 100.2 97.3 75 75 A E H 4 S+ 0 0 63 1,-0.2 -2,-0.2 -3,-0.1 30,-0.1 0.723 106.7 60.1 -79.1 -21.2 10.9 102.5 94.5 76 76 A M H < S+ 0 0 2 -4,-1.4 2,-0.9 -3,-0.3 -1,-0.2 0.723 95.2 69.7 -72.3 -25.5 10.5 99.7 91.9 77 77 A I < + 0 0 4 -4,-1.2 22,-0.4 -3,-0.4 -1,-0.2 -0.803 50.2 164.4-103.9 96.4 6.8 99.3 92.6 78 78 A D S S- 0 0 92 -2,-0.9 19,-2.9 1,-0.3 2,-0.3 0.856 72.1 -19.0 -77.0 -36.7 4.9 102.4 91.5 79 79 A D E -B 96 0B 63 17,-0.3 2,-0.4 18,-0.1 -1,-0.3 -0.978 53.4-139.1-163.2 162.3 1.6 100.6 91.7 80 80 A I E -B 95 0B 2 15,-1.9 15,-2.9 -2,-0.3 2,-0.4 -1.000 20.5-165.6-128.6 129.9 -0.0 97.2 91.9 81 81 A Q E +B 94 0B 23 -2,-0.4 615,-2.6 613,-0.3 2,-0.3 -0.946 11.6 167.5-119.9 139.9 -3.2 96.4 90.0 82 82 A A E -B 93 0B 1 11,-2.1 11,-2.8 -2,-0.4 2,-0.4 -0.990 21.0-150.8-150.7 141.4 -5.6 93.5 90.4 83 83 A E E +B 92 0B 10 613,-0.4 2,-0.3 -2,-0.3 9,-0.2 -0.942 27.3 159.2-109.7 138.1 -9.1 92.5 89.3 84 84 A A E -B 91 0B 14 7,-1.6 7,-2.0 -2,-0.4 2,-0.9 -0.953 46.7 -90.3-150.4 163.9 -11.3 90.2 91.3 85 85 A T E -B 90 0B 101 -2,-0.3 5,-0.3 5,-0.2 -2,-0.0 -0.728 43.6-173.7 -84.3 106.2 -14.9 89.3 91.8 86 86 A F E > -B 89 0B 8 3,-2.5 3,-2.0 -2,-0.9 -38,-0.1 -0.360 48.0 -91.8 -82.1 173.2 -16.5 91.6 94.4 87 87 A P T 3 S+ 0 0 109 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.840 132.8 47.9 -55.7 -30.2 -20.0 91.1 95.6 88 88 A D T 3 S- 0 0 111 1,-0.3 2,-0.1 0, 0.0 -3,-0.0 -0.102 126.3 -90.4-100.7 32.1 -21.0 93.5 92.8 89 89 A G E < S-B 86 0B 30 -3,-2.0 -3,-2.5 2,-0.1 -1,-0.3 -0.320 73.2 -18.3 93.1-177.3 -18.9 91.8 90.1 90 90 A T E +B 85 0B 78 -5,-0.3 2,-0.3 -3,-0.1 -5,-0.2 -0.449 64.6 173.1 -67.2 133.4 -15.4 92.2 88.8 91 91 A K E -B 84 0B 85 -7,-2.0 -7,-1.6 -2,-0.2 2,-0.5 -0.980 29.3-119.8-138.2 156.1 -13.7 95.5 89.7 92 92 A L E -B 83 0B 52 -2,-0.3 2,-0.5 -9,-0.2 -9,-0.2 -0.811 22.1-166.6 -93.8 128.5 -10.2 96.9 89.3 93 93 A V E -B 82 0B 0 -11,-2.8 -11,-2.1 -2,-0.5 2,-0.5 -0.977 1.5-170.2-111.0 128.2 -8.1 97.9 92.3 94 94 A T E -B 81 0B 26 -2,-0.5 2,-0.6 -13,-0.2 -13,-0.2 -0.984 5.7-161.7-114.9 122.7 -5.0 100.0 92.0 95 95 A V E -B 80 0B 0 -15,-2.9 -15,-1.9 -2,-0.5 2,-0.4 -0.933 16.3-146.9-100.8 116.9 -2.8 100.4 95.0 96 96 A H E S-B 79 0B 101 -2,-0.6 -17,-0.3 1,-0.2 -18,-0.1 -0.714 70.7 -12.7 -89.5 135.8 -0.5 103.4 94.5 97 97 A N S S- 0 0 93 -19,-2.9 -1,-0.2 -2,-0.4 -18,-0.1 0.914 76.1-175.5 41.8 62.2 3.0 103.4 96.0 98 98 A P + 0 0 0 0, 0.0 2,-0.5 0, 0.0 -34,-0.3 0.773 66.7 45.8 -63.9 -28.4 2.2 100.4 98.2 99 99 A I 0 0 4 -22,-0.4 -34,-0.1 -25,-0.3 -22,-0.1 -0.954 360.0 360.0-118.9 114.4 5.5 100.3 100.0 100 100 A S 0 0 116 -2,-0.5 -34,-0.4 -39,-0.3 -25,-0.1 -0.366 360.0 360.0 -76.6 360.0 6.7 103.7 101.3 101 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 102 5 B N 0 0 175 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 29.2 24.8 105.0 97.8 103 6 B Y - 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