==== 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 LYASE 13-FEB-08 3C8W . COMPND 2 MOLECULE: ACETOACETATE DECARBOXYLASE ADC; . SOURCE 2 ORGANISM_SCIENTIFIC: LEGIONELLA PNEUMOPHILA SUBSP. PNEUMOPH . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 998 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 39205.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 725 72.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 2.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 433 43.4 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 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 1.2 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 . 113 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 60 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 76 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 0.8 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 0 0 0 4 4 4 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 4 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 0 0 0 PARALLEL BRIDGES PER LADDER . 0 9 6 4 4 4 4 16 0 4 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 1 3 0 0 0 0 0 0 0 4 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 5 A L 0 0 87 0, 0.0 961,-2.9 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0-169.2 30.3 77.8 84.2 2 6 A S E -A 961 0A 42 959,-0.2 2,-0.3 973,-0.2 959,-0.2 -0.861 360.0-158.9-167.8-174.2 31.8 74.4 83.9 3 7 A A E -A 960 0A 16 957,-1.8 957,-2.0 -2,-0.2 2,-0.4 -0.952 16.6-130.9 179.1 159.9 34.2 71.9 82.4 4 8 A N E -A 959 0A 14 -2,-0.3 974,-0.3 2,-0.2 955,-0.3 -0.978 20.6-136.5-125.9 140.0 35.1 68.3 81.6 5 9 A S S S+ 0 0 49 953,-3.5 954,-0.1 -2,-0.4 -1,-0.1 0.784 79.8 101.9 -63.6 -21.4 38.5 66.8 82.5 6 10 A L + 0 0 20 952,-0.5 -2,-0.2 2,-0.0 972,-0.1 -0.098 32.4 147.2 -69.5 158.0 38.3 65.3 78.9 7 11 A E - 0 0 125 14,-0.1 2,-0.0 541,-0.0 14,-0.0 0.425 51.4-108.6 130.0 92.0 39.9 66.3 75.7 8 12 A G + 0 0 13 13,-0.1 13,-0.1 3,-0.1 14,-0.1 -0.103 66.8 20.8 154.6 104.1 40.4 64.1 74.3 9 13 A V S S+ 0 0 31 12,-0.2 3,-0.2 11,-0.1 12,-0.1 0.167 93.0 98.0 95.7 0.5 41.4 61.0 72.3 10 14 A I S S+ 0 0 89 1,-0.2 2,-1.3 11,-0.1 11,-0.0 0.731 72.6 67.3 -79.8 -27.3 44.4 61.6 74.6 11 15 A D + 0 0 57 10,-0.1 2,-0.7 3,-0.0 -1,-0.2 -0.719 64.2 157.2 -95.4 86.5 42.4 58.9 76.5 12 16 A N > + 0 0 51 -2,-1.3 3,-1.0 -3,-0.2 9,-0.0 -0.846 12.9 177.1-113.0 88.3 42.9 56.1 74.1 13 17 A E T 3 S+ 0 0 41 -2,-0.7 -1,-0.1 1,-0.3 -2,-0.0 0.687 77.5 40.3 -77.4 -21.1 42.4 53.1 76.4 14 18 A F T 3 S- 0 0 17 -3,-0.1 -1,-0.3 13,-0.1 665,-0.1 0.130 111.5-114.0-114.9 15.1 42.7 50.3 73.9 15 19 A S < - 0 0 89 -3,-1.0 -2,-0.1 1,-0.2 3,-0.0 0.853 44.7-177.1 57.0 46.6 45.6 51.9 72.0 16 20 A X - 0 0 13 1,-0.1 -1,-0.2 667,-0.1 671,-0.0 -0.551 29.5-140.0 -72.4 128.5 43.8 52.6 68.7 17 21 A P S S+ 0 0 82 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.934 104.4 26.2 -53.7 -43.3 46.1 54.1 66.0 18 22 A A S S- 0 0 5 536,-0.1 730,-0.1 -3,-0.0 670,-0.1 -0.862 96.3-157.3-119.7 91.8 43.1 56.3 65.1 19 23 A P - 0 0 27 0, 0.0 2,-0.5 0, 0.0 -7,-0.1 -0.202 16.0-118.1 -73.3 162.2 40.9 56.7 68.2 20 24 A R - 0 0 31 1,-0.1 -11,-0.1 2,-0.0 -4,-0.1 -0.850 16.9-142.6 -96.1 130.5 37.3 57.5 68.6 21 25 A W S S+ 0 0 10 -2,-0.5 2,-0.8 531,-0.2 -12,-0.2 0.872 86.7 64.8 -61.4 -41.9 36.7 60.8 70.6 22 26 A L S S- 0 0 1 578,-0.4 2,-0.2 -14,-0.1 -1,-0.1 -0.759 76.3-157.2 -92.3 107.5 33.6 59.5 72.4 23 27 A N - 0 0 50 -2,-0.8 -2,-0.0 1,-0.1 -11,-0.0 -0.529 17.3-176.9 -85.6 149.0 34.4 56.6 74.8 24 28 A T S S+ 0 0 16 1,-0.4 88,-0.1 -2,-0.2 -1,-0.1 0.728 70.0 10.4-112.3 -34.2 32.0 54.0 75.9 25 29 A Y S S- 0 0 18 86,-0.1 -1,-0.4 87,-0.1 -12,-0.1 -0.992 71.1-126.2-149.0 143.5 33.9 51.8 78.3 26 30 A P - 0 0 3 0, 0.0 2,-0.1 0, 0.0 881,-0.0 -0.346 38.2 -87.1 -82.5 173.7 37.3 52.0 80.0 27 31 A A - 0 0 23 1,-0.1 -13,-0.1 -2,-0.1 85,-0.0 -0.422 58.8-170.4 -76.7 154.2 40.1 49.5 79.9 28 32 A G S S+ 0 0 22 -2,-0.1 2,-0.2 2,-0.1 -1,-0.1 -0.096 71.3 174.9 -97.2-159.8 40.2 46.7 82.5 29 33 A P - 0 0 81 0, 0.0 2,-0.5 0, 0.0 -2,-0.0 0.551 61.5-147.3 -62.8 166.7 40.9 44.4 84.2 30 34 A Y E -E 239 0B 1 209,-2.4 209,-3.0 -2,-0.2 2,-0.5 -0.925 4.1-146.4-119.0 130.9 37.7 45.1 86.1 31 35 A R E -E 238 0B 73 -2,-0.5 44,-2.7 207,-0.2 2,-0.5 -0.811 9.5-161.5-103.8 130.2 37.2 44.5 89.8 32 36 A F E -EF 237 74B 0 205,-3.4 205,-2.0 -2,-0.5 2,-0.4 -0.942 4.1-169.2-114.3 123.7 34.0 43.3 91.3 33 37 A I E S+EF 236 73B 49 40,-2.7 40,-0.7 -2,-0.5 203,-0.2 -0.919 77.2 2.9-110.0 134.1 33.1 43.6 95.0 34 38 A N E S+ 0 0 67 201,-0.5 2,-0.7 -2,-0.4 202,-0.2 0.821 76.2 175.7 56.2 38.0 30.0 41.7 96.3 35 39 A R E -E 235 0B 22 200,-1.6 200,-2.0 -3,-0.3 2,-0.5 -0.654 18.0-156.7 -67.2 113.1 29.2 40.2 93.0 36 40 A E E -EG 234 70B 47 34,-2.7 34,-2.5 -2,-0.7 2,-0.4 -0.906 9.3-159.9-114.2 123.4 26.3 38.0 94.0 37 41 A F E -EG 233 69B 14 196,-3.1 196,-2.1 -2,-0.5 2,-0.4 -0.826 13.2-179.7-107.4 132.2 25.2 34.9 92.1 38 42 A F E -EG 232 68B 1 30,-2.4 30,-1.9 -2,-0.4 2,-0.4 -0.963 20.2-179.6-126.7 112.6 21.7 33.2 92.2 39 43 A I E -EG 231 67B 23 192,-2.6 192,-3.1 -2,-0.4 2,-0.5 -0.974 20.6-172.9-125.7 129.7 21.7 30.1 89.9 40 44 A I E -EG 230 66B 2 26,-2.6 26,-3.0 -2,-0.4 2,-0.4 -0.982 15.2-159.6-119.5 111.2 19.1 27.6 89.1 41 45 A A E +EG 229 65B 3 188,-2.1 187,-2.9 -2,-0.5 188,-1.7 -0.768 16.7 176.1 -93.1 132.4 20.4 24.7 87.0 42 46 A Y E -EG 227 64B 0 22,-2.3 22,-2.5 -2,-0.4 2,-0.3 -0.992 30.6-112.9-140.1 152.6 17.8 22.8 85.1 43 47 A E E +EG 226 63B 55 183,-2.6 182,-3.5 -2,-0.3 183,-0.9 -0.614 41.3 161.9 -84.7 137.0 17.7 19.9 82.6 44 48 A T - 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