==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 20-OCT-05 2BDR . COMPND 2 MOLECULE: UREIDOGLYCOLATE HYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS PUTIDA; . AUTHOR F.FOROUHAR,M.ABASHIDZE,S.JAYARAMAN,C.K.HO,K.CONOVER,T.B.ACTO . 332 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14727.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 219 66.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 4.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 128 38.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 39 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 11 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 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 RESIDUES PER ALPHA HELIX . 0 2 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 0 PARALLEL BRIDGES PER LADDER . 4 4 6 4 4 0 2 0 0 2 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 2 0 0 0 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 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 0 132 0, 0.0 2,-0.3 0, 0.0 160,-0.2 0.000 360.0 360.0 360.0 149.9 34.2 52.7 0.6 2 2 A R E -a 161 0A 88 158,-1.1 160,-2.3 157,-0.1 2,-0.4 -0.994 360.0-113.2-156.6 150.4 32.5 54.8 -2.1 3 3 A T E -a 162 0A 92 -2,-0.3 160,-0.2 158,-0.2 2,-0.2 -0.700 35.3-123.3 -86.9 131.1 29.1 56.1 -3.0 4 4 A L - 0 0 10 158,-3.2 2,-0.5 -2,-0.4 160,-0.4 -0.457 15.2-129.2 -75.9 143.5 27.6 54.7 -6.2 5 5 A X - 0 0 146 -2,-0.2 2,-0.9 158,-0.1 104,-0.8 -0.812 21.2-133.0 -89.8 126.2 26.5 57.0 -9.0 6 6 A I E -c 109 0B 53 -2,-0.5 104,-0.2 158,-0.1 3,-0.0 -0.742 28.7-168.0 -86.4 107.1 22.9 56.2 -10.1 7 7 A E E -c 110 0B 42 102,-2.5 104,-2.3 -2,-0.9 2,-0.1 -0.717 27.6-107.3 -97.5 142.9 23.0 56.1 -13.9 8 8 A P E -c 111 0B 98 0, 0.0 2,-0.3 0, 0.0 104,-0.2 -0.445 45.7-107.9 -64.2 138.6 19.9 56.0 -16.1 9 9 A L + 0 0 5 102,-2.3 2,-0.3 -2,-0.1 104,-0.1 -0.534 51.3 162.5 -71.9 130.2 19.6 52.5 -17.5 10 10 A T > - 0 0 38 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.983 48.0-119.3-145.2 153.7 20.5 52.3 -21.2 11 11 A K H > S+ 0 0 66 -2,-0.3 4,-1.2 1,-0.2 7,-0.2 0.932 114.2 48.8 -57.8 -47.4 21.4 49.5 -23.6 12 12 A E H 4 S+ 0 0 152 1,-0.2 4,-0.2 2,-0.2 -1,-0.2 0.887 114.7 42.9 -62.6 -41.1 24.8 51.0 -24.4 13 13 A A H 4 S+ 0 0 30 1,-0.2 3,-0.3 2,-0.1 -1,-0.2 0.798 118.7 44.3 -76.5 -27.9 25.8 51.6 -20.7 14 14 A F H >X S+ 0 0 0 -4,-2.2 3,-2.6 1,-0.2 4,-1.7 0.540 81.8 105.0 -92.3 -9.3 24.5 48.2 -19.5 15 15 A A T 3< S+ 0 0 60 -4,-1.2 -1,-0.2 1,-0.3 -2,-0.1 0.767 75.3 55.1 -42.4 -41.8 26.0 46.2 -22.4 16 16 A Q T 34 S+ 0 0 131 -3,-0.3 82,-0.3 -4,-0.2 -1,-0.3 0.727 116.2 39.3 -68.6 -19.2 28.8 44.7 -20.4 17 17 A F T <4 S- 0 0 0 -3,-2.6 104,-2.4 1,-0.3 2,-0.3 0.698 122.7 -75.4-103.9 -24.8 26.3 43.3 -17.9 18 18 A G E < -I 120 0C 5 -4,-1.7 2,-0.3 102,-0.2 -1,-0.3 -0.986 61.5 -41.5 162.9-151.7 23.4 42.1 -20.0 19 19 A D E -I 119 0C 45 100,-1.8 100,-2.3 -2,-0.3 2,-0.6 -0.828 37.0-132.3-116.4 152.0 20.5 43.3 -22.1 20 20 A V E -I 118 0C 6 -2,-0.3 2,-1.0 98,-0.2 98,-0.2 -0.904 16.9-147.3-103.3 123.1 17.9 46.0 -21.5 21 21 A I E +I 117 0C 1 96,-2.2 96,-2.8 -2,-0.6 2,-0.3 -0.803 50.0 116.5 -93.7 101.1 14.3 44.8 -22.2 22 22 A E - 0 0 14 -2,-1.0 94,-0.1 94,-0.2 203,-0.1 -0.973 62.9-132.5-158.0 163.3 12.5 47.8 -23.6 23 23 A T S > S+ 0 0 10 92,-0.4 3,-2.2 -2,-0.3 -1,-0.1 0.816 76.8 99.8 -91.4 -35.5 10.7 49.0 -26.7 24 24 A D T 3 S- 0 0 79 1,-0.3 3,-0.1 91,-0.2 -2,-0.1 -0.296 102.9 -3.2 -56.1 124.3 12.3 52.4 -26.9 25 25 A G T 3 S+ 0 0 78 1,-0.2 -1,-0.3 -2,-0.1 2,-0.3 0.535 106.1 130.9 70.6 6.0 15.2 52.4 -29.4 26 26 A S < - 0 0 15 -3,-2.2 -1,-0.2 1,-0.1 2,-0.1 -0.661 58.6-116.0 -95.9 149.6 14.6 48.7 -30.0 27 27 A D + 0 0 146 -2,-0.3 2,-0.3 13,-0.1 13,-0.1 -0.395 41.4 161.1 -77.4 155.8 14.3 47.0 -33.4 28 28 A H - 0 0 78 11,-0.2 2,-0.3 -2,-0.1 11,-0.2 -0.982 25.2-150.6-164.9 169.0 11.1 45.2 -34.4 29 29 A F E -O 38 0D 101 9,-1.6 9,-3.1 -2,-0.3 2,-0.2 -0.925 33.4 -95.0-142.8 164.4 9.0 43.9 -37.3 30 30 A X E +O 37 0D 91 -2,-0.3 2,-0.3 7,-0.2 7,-0.2 -0.560 40.5 169.5 -87.3 149.2 5.3 43.4 -37.8 31 31 A I E >>> +O 36 0D 34 5,-2.3 5,-1.8 -2,-0.2 4,-0.7 -0.861 52.2 49.9-143.3 176.6 3.3 40.3 -37.1 32 32 A N G >45S- 0 0 37 -2,-0.3 3,-1.5 1,-0.2 -1,-0.2 0.936 133.2 -53.3 52.2 52.7 -0.4 39.3 -36.9 33 33 A N G 345S- 0 0 148 1,-0.3 -1,-0.2 -3,-0.1 -3,-0.0 0.758 106.9 -53.2 55.7 29.8 -1.2 40.9 -40.3 34 34 A G G <45S+ 0 0 39 -3,-0.7 -1,-0.3 2,-0.2 -2,-0.2 0.576 116.5 107.7 86.0 10.9 0.3 44.2 -39.2 35 35 A S T <<5S+ 0 0 30 -3,-1.5 194,-2.7 -4,-0.7 2,-0.4 0.608 75.4 49.4 -94.1 -13.3 -1.7 44.6 -36.0 36 36 A T E < -OP 31 228D 2 -5,-1.8 -5,-2.3 192,-0.2 2,-0.6 -0.978 68.2-143.9-132.0 140.3 1.2 43.8 -33.6 37 37 A X E -OP 30 227D 35 190,-2.8 190,-2.5 -2,-0.4 2,-0.8 -0.894 16.7-154.2-100.4 123.3 4.8 45.1 -33.4 38 38 A R E -OP 29 226D 25 -9,-3.1 2,-1.7 -2,-0.6 -9,-1.6 -0.869 7.3-162.1-103.3 107.8 7.2 42.5 -32.3 39 39 A F E - P 0 225D 8 186,-3.2 186,-1.7 -2,-0.8 3,-0.5 -0.717 36.5-145.6 -86.4 87.5 10.3 43.9 -30.5 40 40 A H E - 0 0 73 -2,-1.7 -13,-0.1 1,-0.2 184,-0.1 -0.304 50.2 -14.0 -69.6 136.4 12.1 40.7 -31.2 41 41 A K E + 0 0 96 1,-0.1 183,-0.2 -2,-0.1 -1,-0.2 0.864 61.7 165.9 43.3 57.8 14.7 38.9 -29.0 42 42 A L E S+ 0 0 22 181,-1.9 2,-0.3 -3,-0.5 182,-0.2 0.749 74.8 8.4 -69.2 -23.3 15.5 41.7 -26.6 43 43 A A E - P 0 223D 2 180,-1.4 180,-2.8 -24,-0.1 2,-0.4 -0.986 68.4-143.8-154.9 152.3 17.2 39.1 -24.5 44 44 A T E - P 0 222D 40 -2,-0.3 2,-0.5 178,-0.2 178,-0.2 -0.975 21.1-127.9-122.6 132.4 18.1 35.4 -24.8 45 45 A V E - P 0 221D 1 176,-3.0 176,-0.6 -2,-0.4 2,-0.4 -0.692 28.3-159.7 -79.6 121.6 17.9 33.0 -21.8 46 46 A E - 0 0 62 -2,-0.5 34,-1.9 174,-0.1 2,-0.3 -0.879 10.9-177.8-108.3 138.5 21.3 31.3 -21.5 47 47 A T B -U 79 0E 27 -2,-0.4 32,-0.2 32,-0.2 7,-0.0 -0.926 33.5-125.5-129.8 155.0 21.8 28.0 -19.7 48 48 A A S S+ 0 0 21 30,-1.7 31,-0.1 -2,-0.3 -1,-0.1 0.880 96.2 21.2 -66.2 -41.5 24.9 25.9 -19.0 49 49 A E S > S- 0 0 99 29,-0.2 3,-1.5 1,-0.1 -1,-0.1 -0.949 74.8-123.9-130.1 150.0 23.4 22.7 -20.5 50 50 A P T 3 S+ 0 0 68 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.769 110.9 66.3 -62.6 -22.9 20.6 22.1 -23.1 51 51 A E T 3 S+ 0 0 131 2,-0.1 -3,-0.0 -4,-0.0 0, 0.0 0.763 83.2 98.8 -68.2 -24.9 19.0 19.8 -20.5 52 52 A D < - 0 0 17 -3,-1.5 2,-0.4 1,-0.1 93,-0.2 -0.240 69.7-137.4 -61.9 151.9 18.5 22.9 -18.3 53 53 A K E -J 144 0C 98 91,-2.7 91,-3.1 160,-0.0 2,-0.5 -0.877 4.9-132.2-116.2 146.0 15.0 24.6 -18.4 54 54 A A E -JK 143 212C 8 158,-0.5 158,-2.9 -2,-0.4 2,-0.3 -0.848 32.9-166.3 -93.3 128.0 14.1 28.3 -18.6 55 55 A I E -JK 142 211C 3 87,-3.0 87,-1.9 -2,-0.5 2,-0.5 -0.870 16.0-139.1-120.4 153.9 11.5 29.0 -16.0 56 56 A I E +JK 141 210C 0 154,-2.9 153,-2.2 -2,-0.3 154,-1.4 -0.936 30.4 159.8-112.2 127.9 9.1 31.9 -15.4 57 57 A S E -J 140 0C 0 83,-2.9 83,-3.1 -2,-0.5 2,-0.4 -0.814 32.5-127.6-135.2 173.4 8.4 33.2 -11.8 58 58 A I E -JK 139 206C 6 148,-1.6 148,-3.0 -2,-0.3 2,-0.5 -0.998 16.2-155.2-127.9 133.2 7.2 36.4 -10.2 59 59 A F E -JK 138 205C 5 79,-2.7 79,-2.5 -2,-0.4 2,-0.7 -0.934 4.3-166.1-108.6 128.7 9.1 38.1 -7.4 60 60 A R E -JK 137 204C 54 144,-2.4 144,-2.7 -2,-0.5 2,-0.3 -0.916 24.3-176.3-113.3 100.1 7.1 40.3 -5.0 61 61 A A E -JK 136 203C 0 75,-2.1 75,-2.2 -2,-0.7 2,-0.3 -0.778 20.9-140.9-106.9 145.5 9.9 42.3 -3.3 62 62 A D E -J 135 0C 44 140,-2.6 69,-0.3 -2,-0.3 73,-0.2 -0.696 35.0 -98.0 -97.6 152.1 9.8 44.8 -0.4 63 63 A A - 0 0 38 71,-2.3 2,-0.3 -2,-0.3 69,-0.1 -0.286 32.7-129.8 -67.1 152.6 12.1 47.8 -0.4 64 64 A Q - 0 0 56 67,-0.4 2,-0.1 1,-0.1 4,-0.1 -0.748 35.3 -90.9-101.2 151.6 15.3 47.8 1.5 65 65 A D - 0 0 149 -2,-0.3 -1,-0.1 2,-0.1 0, 0.0 -0.399 59.3-106.1 -63.0 134.9 16.2 50.6 3.9 66 66 A X S S+ 0 0 69 2,-0.1 2,-0.2 -2,-0.1 98,-0.1 -0.831 98.2 49.4-110.7 152.9 18.1 53.4 2.2 67 67 A P S S- 0 0 78 0, 0.0 2,-0.4 0, 0.0 97,-0.2 0.620 87.6-154.8 -71.1 151.1 20.8 54.4 2.0 68 68 A L E -B 163 0A 26 95,-2.5 95,-3.1 -2,-0.2 2,-0.8 -0.801 11.7-142.4-100.3 136.8 21.8 50.9 1.4 69 69 A T E -B 162 0A 47 -2,-0.4 2,-0.9 93,-0.2 93,-0.2 -0.881 19.4-139.6 -97.2 108.8 25.3 49.6 2.2 70 70 A V E +B 161 0A 0 91,-2.8 91,-1.6 -2,-0.8 3,-0.1 -0.612 35.2 163.3 -71.7 106.5 26.1 47.1 -0.6 71 71 A R + 0 0 136 -2,-0.9 84,-1.9 89,-0.2 2,-0.3 0.569 59.2 7.7-101.1 -14.9 27.9 44.4 1.4 72 72 A X E -D 154 0B 22 82,-0.3 2,-0.3 -3,-0.1 82,-0.2 -0.972 52.5-154.0-158.7 170.6 27.6 41.6 -1.2 73 73 A L E -D 153 0B 0 80,-1.8 80,-2.7 -2,-0.3 2,-0.3 -0.960 14.1-150.9-146.3 157.1 26.8 40.6 -4.7 74 74 A E E -DE 152 126B 28 52,-3.0 52,-2.9 -2,-0.3 2,-0.3 -0.872 6.5-164.2-129.5 163.6 25.7 37.3 -6.2 75 75 A R E -D 151 0B 50 76,-1.9 76,-2.3 -2,-0.3 50,-0.1 -0.970 19.7-137.5-145.2 158.1 26.1 35.6 -9.6 76 76 A H > - 0 0 15 48,-0.4 47,-1.7 -2,-0.3 3,-1.1 -0.887 17.4-174.9-117.9 94.6 24.5 32.7 -11.4 77 77 A P T 3 S+ 0 0 28 0, 0.0 72,-0.1 0, 0.0 -1,-0.1 0.699 82.0 46.8 -64.8 -17.1 27.4 30.9 -13.1 78 78 A L T 3 S+ 0 0 34 1,-0.1 -30,-1.7 -3,-0.1 2,-0.3 0.388 117.7 9.8-107.4 3.5 25.1 28.5 -14.9 79 79 A G B < -U 47 0E 1 -3,-1.1 44,-0.5 -32,-0.2 -32,-0.2 -0.990 66.6-103.6-172.5 163.1 22.4 30.8 -16.3 80 80 A S - 0 0 1 -34,-1.9 63,-0.7 -2,-0.3 2,-0.3 -0.397 29.7-152.3 -85.4 169.3 21.1 34.3 -17.1 81 81 A Q E -LM 120 142C 12 39,-1.5 39,-3.0 61,-0.2 2,-0.4 -0.938 5.8-160.6-149.0 124.1 18.4 35.9 -15.0 82 82 A A E -LM 119 141C 0 59,-2.7 59,-1.7 -2,-0.3 2,-0.4 -0.859 4.9-166.1-111.6 142.2 15.9 38.5 -16.2 83 83 A F E -LM 118 140C 11 35,-2.8 35,-2.6 -2,-0.4 57,-0.2 -0.994 9.2-180.0-124.1 121.9 13.8 41.0 -14.2 84 84 A I E - M 0 139C 5 55,-2.5 55,-3.0 -2,-0.4 33,-0.2 -0.982 29.3-120.7-126.7 122.2 10.9 42.8 -15.9 85 85 A P E - M 0 138C 6 0, 0.0 53,-0.2 0, 0.0 32,-0.0 -0.307 22.9-173.7 -59.7 141.7 8.7 45.3 -14.0 86 86 A L S S+ 0 0 20 51,-2.1 169,-0.2 168,-0.1 52,-0.1 0.614 81.2 46.5-108.7 -20.2 5.1 44.3 -13.9 87 87 A L S S- 0 0 92 50,-0.7 51,-0.1 2,-0.1 167,-0.1 0.273 109.7-111.1-107.5 10.5 3.6 47.4 -12.3 88 88 A G + 0 0 40 1,-0.2 27,-0.1 26,-0.2 166,-0.0 0.586 68.5 145.9 72.6 11.7 5.5 50.0 -14.3 89 89 A N - 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