==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 25-AUG-00 1FO6 . COMPND 2 MOLECULE: N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: AGROBACTERIUM TUMEFACIENS; . AUTHOR W.-C.WANG,W.-H.HSU,F.-T.CHIEN,C.-Y.CHEN . 1208 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 38461.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 837 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 96 7.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 196 16.2 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 . 8 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 1.0 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 . 88 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 177 14.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 220 18.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 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 13 2 2 0 1 3 4 0 0 0 0 1 3 4 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 0 10 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 0 PARALLEL BRIDGES PER LADDER . 6 0 12 4 4 0 0 4 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 4 0 0 0 4 0 0 0 0 2 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 3 A R 0 0 106 0, 0.0 273,-2.9 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 -11.6 26.0 -7.7 24.9 2 4 A Q E +A 273 0A 148 271,-0.2 2,-0.3 272,-0.1 271,-0.2 -0.964 360.0 155.5-116.9 138.5 25.6 -5.6 28.1 3 5 A M E -A 272 0A 30 269,-2.3 269,-3.3 -2,-0.4 2,-0.6 -0.958 43.1-113.7-149.5 169.6 26.0 -1.9 28.4 4 6 A I E -A 271 0A 22 33,-0.3 35,-2.7 -2,-0.3 36,-1.3 -0.973 34.2-163.7-111.9 120.5 25.0 1.1 30.4 5 7 A L E -Ab 270 40A 0 265,-2.5 265,-2.5 -2,-0.6 2,-0.3 -0.796 8.0-171.9-100.8 141.1 22.8 3.4 28.4 6 8 A A E -Ab 269 41A 0 34,-2.8 36,-2.2 -2,-0.3 2,-0.4 -0.935 17.9-147.5-123.8 168.4 22.1 7.0 29.5 7 9 A V E -Ab 268 42A 0 261,-2.2 261,-2.2 -2,-0.3 2,-0.7 -0.979 8.8-155.8-134.6 134.8 20.0 9.9 28.4 8 10 A G E -A 267 0A 0 34,-3.2 259,-0.2 -2,-0.4 2,-0.2 -0.843 15.3-163.0-113.1 94.8 21.3 13.4 28.9 9 11 A Q E -A 266 0A 0 257,-2.6 257,-1.9 -2,-0.7 2,-0.4 -0.540 7.9-141.9 -72.9 147.0 18.3 15.6 29.1 10 12 A Q B -g 234 0B 0 223,-2.2 225,-3.3 255,-0.2 255,-0.1 -0.868 0.3-143.0-110.8 143.7 18.8 19.3 28.6 11 13 A G - 0 0 3 -2,-0.4 225,-0.2 223,-0.2 253,-0.2 -0.161 59.9 -46.5 -82.7 177.9 17.1 22.2 30.4 12 14 A P - 0 0 42 0, 0.0 2,-0.5 0, 0.0 -1,-0.2 -0.114 46.0-148.6 -50.8 159.1 16.2 25.2 28.3 13 15 A I - 0 0 0 -3,-0.1 38,-0.3 36,-0.1 2,-0.1 -0.999 19.9-138.4-131.5 109.0 18.6 26.9 25.9 14 16 A A > - 0 0 40 -2,-0.5 3,-1.1 36,-0.1 36,-0.4 -0.488 21.4-114.6 -65.8 154.7 18.0 30.6 25.6 15 17 A R T 3 S+ 0 0 90 1,-0.3 35,-0.1 -2,-0.1 -1,-0.1 0.887 120.3 44.2 -55.0 -34.0 18.1 32.3 22.1 16 18 A A T 3 S+ 0 0 89 2,-0.1 -1,-0.3 33,-0.1 2,-0.2 0.552 84.9 110.3 -85.6 -15.3 21.2 34.2 23.3 17 19 A E S < S- 0 0 50 -3,-1.1 33,-0.2 1,-0.1 2,-0.2 -0.558 70.4-126.6 -59.4 139.5 22.9 31.2 25.0 18 20 A T > - 0 0 66 -2,-0.2 4,-2.6 1,-0.1 5,-0.3 -0.431 11.4-118.4 -87.7 164.6 25.9 30.4 22.8 19 21 A R H > S+ 0 0 58 1,-0.3 4,-2.9 2,-0.2 5,-0.3 0.913 118.9 56.5 -62.5 -42.3 26.9 27.1 21.2 20 22 A E H > S+ 0 0 139 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.930 108.3 46.2 -54.5 -49.8 30.1 27.3 23.4 21 23 A Q H > S+ 0 0 94 -3,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.872 113.9 48.3 -59.3 -40.0 27.9 27.6 26.5 22 24 A V H X S+ 0 0 0 -4,-2.6 4,-2.1 2,-0.2 5,-0.2 0.923 110.3 51.4 -63.2 -46.2 25.6 24.7 25.4 23 25 A V H X S+ 0 0 5 -4,-2.9 4,-2.5 -5,-0.3 -1,-0.2 0.878 105.5 55.2 -58.4 -41.7 28.6 22.5 24.6 24 26 A G H X S+ 0 0 28 -4,-1.8 4,-1.7 -5,-0.3 -1,-0.2 0.883 107.2 51.1 -59.4 -41.2 30.0 23.2 28.1 25 27 A R H X S+ 0 0 41 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.895 110.0 49.5 -63.8 -32.8 26.6 21.9 29.5 26 28 A L H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.906 108.6 52.9 -68.1 -42.1 26.9 18.7 27.4 27 29 A L H X S+ 0 0 41 -4,-2.5 4,-1.7 2,-0.2 -1,-0.2 0.901 105.8 53.3 -57.7 -47.5 30.4 18.2 28.6 28 30 A D H X S+ 0 0 113 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.927 108.5 50.9 -61.0 -37.8 29.3 18.4 32.2 29 31 A M H X S+ 0 0 8 -4,-1.8 4,-2.6 1,-0.2 -2,-0.2 0.888 107.1 52.8 -67.9 -29.4 26.7 15.7 31.5 30 32 A L H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.821 106.5 53.4 -71.5 -33.1 29.3 13.4 30.0 31 33 A T H X S+ 0 0 90 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.928 111.6 46.2 -63.1 -48.1 31.4 13.8 33.2 32 34 A N H X S+ 0 0 66 -4,-2.2 4,-0.9 1,-0.2 -2,-0.2 0.970 112.2 50.2 -57.5 -41.8 28.4 12.7 35.2 33 35 A A H ><>S+ 0 0 0 -4,-2.6 5,-2.4 1,-0.2 3,-1.0 0.918 106.3 55.5 -65.8 -41.0 27.7 9.8 32.8 34 36 A A H ><5S+ 0 0 39 -4,-2.3 3,-1.9 1,-0.2 -1,-0.2 0.951 102.9 56.1 -55.8 -40.4 31.3 8.7 33.1 35 37 A S H 3<5S+ 0 0 68 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.616 108.0 49.5 -65.3 -21.1 30.9 8.5 36.9 36 38 A R T <<5S- 0 0 7 -3,-1.0 -1,-0.3 -4,-0.9 -2,-0.2 0.128 118.6-105.7-108.0 17.2 28.0 6.1 36.5 37 39 A G T < 5 + 0 0 28 -3,-1.9 -33,-0.3 1,-0.2 -3,-0.2 0.718 57.6 171.6 78.8 16.7 29.7 3.7 34.1 38 40 A V < - 0 0 6 -5,-2.4 -1,-0.2 -6,-0.2 -33,-0.2 -0.387 21.2-178.4 -67.4 145.2 27.7 4.9 31.0 39 41 A N S S+ 0 0 49 -35,-2.7 50,-2.6 1,-0.3 2,-0.3 0.734 73.0 20.6-111.0 -22.6 28.8 3.5 27.6 40 42 A F E -bc 5 89A 5 -36,-1.3 -34,-2.8 48,-0.2 2,-0.4 -0.992 65.3-165.8-149.3 135.1 26.3 5.4 25.3 41 43 A I E -bc 6 90A 0 48,-2.3 50,-1.9 -2,-0.3 2,-0.6 -0.970 11.5-145.1-128.6 135.1 24.4 8.6 26.0 42 44 A V E -bc 7 91A 0 -36,-2.2 -34,-3.2 -2,-0.4 50,-0.1 -0.877 17.6-166.7 -96.8 123.5 21.4 10.0 24.0 43 45 A F - 0 0 0 48,-2.5 189,-0.3 -2,-0.6 -34,-0.1 -0.559 28.3 -82.8-104.2 166.5 21.1 13.8 23.8 44 46 A P > - 0 0 1 0, 0.0 49,-1.5 0, 0.0 3,-0.7 -0.028 42.7 -89.4 -66.7 171.2 18.1 15.9 22.6 45 47 A E T 3 S+ 0 0 3 187,-0.6 149,-0.2 1,-0.3 65,-0.1 -0.619 112.6 5.2 -72.5 145.4 16.8 16.9 19.2 46 48 A L T > S+ 0 0 2 63,-0.4 3,-1.0 -2,-0.3 -1,-0.3 0.924 85.3 169.7 48.5 53.0 18.3 20.3 18.0 47 49 A A T < + 0 0 0 46,-2.1 -1,-0.2 -3,-0.7 47,-0.1 0.362 56.2 63.4 -79.4 -8.0 20.5 20.2 21.0 48 50 A L T 3 S+ 0 0 2 45,-0.2 2,-0.3 18,-0.1 -1,-0.3 0.479 106.6 22.7 -91.8 -11.2 22.8 23.1 20.2 49 51 A T S < S- 0 0 9 -3,-1.0 -34,-0.1 -27,-0.1 -36,-0.1 -0.956 90.9 -76.4-141.6 174.5 20.4 26.0 20.1 50 52 A T - 0 0 1 -36,-0.4 2,-1.8 -2,-0.3 -36,-0.1 -0.165 66.6 -88.0 -62.3 168.5 17.1 27.2 21.4 51 53 A F > - 0 0 7 -38,-0.3 3,-1.3 1,-0.2 -1,-0.1 -0.530 51.0-177.2 -85.4 86.1 14.1 25.7 19.5 52 54 A F G > + 0 0 0 -2,-1.8 3,-2.4 1,-0.3 -1,-0.2 0.716 64.0 82.0 -65.5 -12.4 14.0 28.3 16.7 53 55 A P G 3 S+ 0 0 0 0, 0.0 90,-2.6 0, 0.0 -1,-0.3 0.591 76.0 77.4 -73.8 -2.0 10.9 26.9 14.8 54 56 A R G < S+ 0 0 11 -3,-1.3 87,-1.7 88,-0.2 2,-0.3 0.569 92.5 60.2 -77.3 -10.2 8.8 28.7 17.4 55 57 A W S < S- 0 0 57 -3,-2.4 2,-0.7 85,-0.1 88,-0.1 -0.912 81.3-124.4-118.7 161.5 9.4 32.0 15.5 56 58 A H - 0 0 71 -2,-0.3 2,-0.4 86,-0.0 -2,-0.0 -0.859 30.6-156.6-100.9 115.6 8.7 33.2 12.0 57 59 A F + 0 0 16 -2,-0.7 3,-0.1 1,-0.1 -2,-0.0 -0.759 25.0 171.8 -94.1 134.9 12.0 34.3 10.5 58 60 A T + 0 0 130 -2,-0.4 2,-1.0 1,-0.1 -1,-0.1 0.739 68.0 76.8-107.8 -28.9 12.1 36.9 7.6 59 61 A D >> - 0 0 83 1,-0.2 4,-2.2 2,-0.1 3,-1.3 -0.651 66.2-162.2 -82.8 106.0 15.9 37.3 7.6 60 62 A E H 3> S+ 0 0 102 -2,-1.0 4,-2.4 1,-0.3 -1,-0.2 0.793 90.8 56.3 -62.1 -28.3 17.3 34.2 5.9 61 63 A A H 3> S+ 0 0 66 2,-0.2 4,-1.1 1,-0.2 -1,-0.3 0.801 106.2 50.0 -70.6 -35.6 20.7 35.0 7.4 62 64 A E H X> S+ 0 0 74 -3,-1.3 3,-0.8 2,-0.2 4,-0.5 0.967 110.6 50.0 -69.5 -38.5 19.2 34.9 10.9 63 65 A L H >< S+ 0 0 15 -4,-2.2 3,-1.8 1,-0.3 -2,-0.2 0.933 107.8 54.4 -64.6 -43.4 17.5 31.6 10.2 64 66 A D H >< S+ 0 0 37 -4,-2.4 3,-2.2 1,-0.3 -1,-0.3 0.750 90.5 72.8 -63.7 -31.9 20.8 30.1 8.9 65 67 A S H << S+ 0 0 66 -4,-1.1 -1,-0.3 -3,-0.8 -2,-0.2 0.771 91.2 60.7 -58.8 -19.0 22.7 30.9 12.1 66 68 A F T << S+ 0 0 18 -3,-1.8 29,-0.5 -4,-0.5 2,-0.3 0.495 94.9 82.4 -82.8 -0.3 20.8 28.1 13.9 67 69 A Y S < S- 0 0 10 -3,-2.2 2,-0.4 -4,-0.2 29,-0.2 -0.796 74.7-129.0-105.5 158.5 22.2 25.5 11.5 68 70 A E B -d 96 0A 18 27,-2.7 29,-2.5 -2,-0.3 3,-0.1 -0.756 11.1-168.7 -98.8 131.9 25.4 23.6 11.4 69 71 A T S S+ 0 0 113 -2,-0.4 2,-0.3 1,-0.2 -1,-0.1 0.332 79.2 15.1 -99.9 -6.5 27.3 23.6 8.1 70 72 A E S S- 0 0 107 28,-0.0 3,-0.5 0, 0.0 -1,-0.2 -0.968 84.8-104.8-156.0 163.8 29.6 20.9 9.4 71 73 A M S S+ 0 0 31 1,-0.5 2,-0.1 -2,-0.3 25,-0.0 -0.905 103.6 10.0-143.9 115.3 29.7 18.3 12.2 72 74 A P S S- 0 0 23 0, 0.0 -1,-0.5 0, 0.0 -4,-0.0 0.509 80.3-176.0 -87.8 156.7 31.5 19.0 14.3 73 75 A G > - 0 0 7 -3,-0.5 4,-2.0 -2,-0.1 3,-0.1 -0.269 52.9 -83.0 -84.9-163.6 32.7 22.5 13.7 74 76 A P T 4 S+ 0 0 92 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.894 130.1 53.1 -67.9 -42.6 35.3 24.0 16.0 75 77 A V T 4 S+ 0 0 73 1,-0.2 4,-0.2 2,-0.1 -52,-0.0 0.868 115.2 40.0 -65.6 -35.9 32.7 25.0 18.7 76 78 A V T >> S+ 0 0 2 1,-0.2 3,-1.2 -3,-0.1 4,-1.1 0.726 92.1 89.5 -88.5 -6.5 31.3 21.5 18.8 77 79 A R H 3X S+ 0 0 100 -4,-2.0 4,-2.9 1,-0.2 -1,-0.2 0.806 75.8 62.9 -64.0 -35.4 34.6 19.5 18.6 78 80 A P H 3> S+ 0 0 44 0, 0.0 4,-3.8 0, 0.0 5,-0.3 0.883 99.5 56.6 -56.6 -32.1 35.3 19.4 22.4 79 81 A L H <> S+ 0 0 0 -3,-1.2 4,-2.5 1,-0.2 5,-0.2 0.964 112.3 41.5 -61.7 -46.8 32.1 17.3 22.9 80 82 A F H X S+ 0 0 16 -4,-1.1 4,-1.8 2,-0.2 -1,-0.2 0.864 116.8 48.7 -65.7 -48.8 33.5 14.8 20.3 81 83 A E H X S+ 0 0 114 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.984 115.0 43.7 -60.8 -46.3 37.0 15.0 21.7 82 84 A T H X S+ 0 0 41 -4,-3.8 4,-2.5 1,-0.3 -2,-0.2 0.851 113.8 49.6 -70.8 -39.1 35.9 14.5 25.3 83 85 A A H X>S+ 0 0 2 -4,-2.5 5,-2.9 -5,-0.3 4,-0.5 0.859 111.6 48.6 -60.5 -44.1 33.4 11.7 24.6 84 86 A A H ><5S+ 0 0 36 -4,-1.8 3,-1.1 -5,-0.2 -2,-0.2 0.940 111.3 52.0 -67.6 -31.3 36.0 9.8 22.6 85 87 A E H 3<5S+ 0 0 163 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.1 0.987 112.7 43.7 -64.8 -50.3 38.5 10.2 25.5 86 88 A L H 3<5S- 0 0 73 -4,-2.5 -1,-0.3 -5,-0.1 -2,-0.2 0.600 113.4-120.4 -67.2 -9.0 36.0 8.9 28.0 87 89 A G T <<5 + 0 0 28 -3,-1.1 2,-0.5 -4,-0.5 -3,-0.2 0.861 64.0 141.0 76.6 26.4 35.0 6.0 25.7 88 90 A I < - 0 0 4 -5,-2.9 -48,-0.2 27,-0.2 -1,-0.2 -0.960 41.8-147.4-111.3 124.6 31.3 7.0 25.5 89 91 A G E -c 40 0A 0 -50,-2.6 -48,-2.3 -2,-0.5 2,-0.3 -0.384 24.4-170.2 -66.7 166.0 29.2 6.8 22.2 90 92 A F E -cE 41 113A 0 23,-1.8 23,-2.8 -50,-0.2 2,-0.5 -0.980 27.3-138.4-153.9 163.5 26.4 9.5 21.8 91 93 A N E -cE 42 112A 2 -50,-1.9 -48,-2.5 -2,-0.3 2,-0.4 -0.994 28.0-174.2-118.7 123.9 23.4 10.5 19.8 92 94 A L E - E 0 111A 0 19,-1.9 19,-2.0 -2,-0.5 2,-0.4 -0.987 12.2-152.2-122.4 137.3 23.3 14.2 19.1 93 95 A G E + E 0 110A 1 -49,-1.5 -46,-2.1 -2,-0.4 2,-0.3 -0.815 27.2 154.8-103.1 147.3 20.5 16.1 17.3 94 96 A Y E - E 0 109A 6 15,-2.8 15,-2.4 -2,-0.4 2,-0.4 -0.970 47.8 -98.6-161.4 159.5 21.2 19.3 15.4 95 97 A A E - E 0 108A 4 -29,-0.5 -27,-2.7 -2,-0.3 2,-0.5 -0.792 43.7-157.5 -85.8 130.1 19.9 21.5 12.6 96 98 A E E -dE 68 107A 14 11,-2.9 11,-2.6 -2,-0.4 2,-0.5 -0.954 13.7-168.0-118.5 134.4 21.8 20.7 9.4 97 99 A L E + E 0 106A 21 -29,-2.5 2,-0.4 -2,-0.5 9,-0.2 -0.959 15.0 169.9-121.8 122.4 22.3 22.8 6.3 98 100 A V E - 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