==== 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 18-JUN-03 1PQH . COMPND 2 MOLECULE: ASPARTATE 1-DECARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR F.SCHMITZBERGER,M.L.KILKENNY,C.M.C.LOBLEY,M.E.WEBB,M.VINKOVI . 234 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11039.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 164 70.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 10.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 65 27.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 . 20 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 21 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 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 RESIDUES PER ALPHA HELIX . 2 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 0 0 PARALLEL BRIDGES PER LADDER . 2 4 0 2 2 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 2 0 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 -2 A R 0 0 147 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 138.8 37.8 24.4 11.7 2 -1 A G + 0 0 28 1,-0.2 3,-0.1 215,-0.0 0, 0.0 0.652 360.0 167.9 76.6 15.8 41.1 25.3 10.0 3 0 A S - 0 0 59 1,-0.1 2,-0.4 210,-0.1 -1,-0.2 -0.254 43.7-105.4 -63.3 146.6 40.5 29.0 10.6 4 1 A M - 0 0 34 209,-0.1 94,-1.6 207,-0.1 2,-0.5 -0.635 38.0-143.4 -72.0 128.9 43.5 31.3 10.0 5 2 A I E -AB 97 212A 35 207,-2.7 207,-2.0 -2,-0.4 2,-0.3 -0.877 10.5-154.4-109.7 126.5 44.9 32.3 13.4 6 3 A R E -A 96 0A 8 90,-3.0 90,-1.9 -2,-0.5 2,-0.6 -0.672 13.9-134.2 -94.4 151.0 46.3 35.7 14.1 7 4 A T E +A 95 0A 44 203,-0.5 156,-2.8 -2,-0.3 2,-0.3 -0.940 37.2 179.3-102.8 116.0 48.9 36.8 16.7 8 5 A M E -AC 94 162A 0 86,-3.1 86,-2.6 -2,-0.6 2,-0.4 -0.894 37.2 -98.9-123.8 146.1 47.6 40.0 18.3 9 6 A L E -A 93 0A 0 152,-3.1 84,-0.3 -2,-0.3 3,-0.1 -0.503 33.8-173.9 -59.4 119.0 48.8 42.3 21.0 10 7 A Q E - 0 0 16 82,-2.7 97,-2.6 1,-0.4 2,-0.3 0.864 59.0 -42.3 -81.0 -44.4 47.0 41.2 24.2 11 8 A G E -Ad 92 107A 0 81,-1.4 81,-2.2 95,-0.3 -1,-0.4 -0.975 53.4-152.0-174.9 165.1 48.2 44.1 26.4 12 9 A K E -Ad 91 108A 5 95,-2.0 97,-2.6 -2,-0.3 2,-0.7 -0.994 20.6-133.5-155.5 154.5 51.1 46.2 27.3 13 10 A L E -Ad 90 109A 0 77,-2.8 77,-2.1 -2,-0.3 2,-0.7 -0.943 34.9-148.0-101.8 111.9 52.6 48.2 30.0 14 11 A H E -Ad 89 110A 20 95,-3.0 97,-2.0 -2,-0.7 75,-0.2 -0.775 65.6 -15.6 -96.6 112.3 53.7 51.4 28.3 15 12 A R E S+ 0 0 63 -2,-0.7 -1,-0.2 73,-0.6 74,-0.2 0.885 77.9 166.6 66.1 47.5 56.9 53.1 29.6 16 13 A V E -A 88 0A 0 72,-1.6 72,-2.9 -3,-0.5 2,-0.4 -0.564 33.8-122.6 -76.8 157.2 57.3 51.5 33.0 17 14 A K E -A 87 0A 87 70,-0.2 2,-0.3 -2,-0.2 70,-0.2 -0.860 19.8-115.6-107.0 134.2 60.7 52.0 34.6 18 15 A V - 0 0 1 68,-2.7 67,-2.5 -2,-0.4 55,-0.2 -0.515 31.3-179.4 -67.6 127.0 63.0 49.1 35.6 19 16 A T + 0 0 52 53,-2.7 2,-0.3 1,-0.3 54,-0.2 0.613 64.2 18.6-104.6 -17.3 63.3 49.1 39.4 20 17 A H B +k 73 0B 72 52,-1.5 54,-2.6 63,-0.1 -1,-0.3 -0.985 53.2 177.5-154.9 143.0 65.7 46.2 39.9 21 18 A A + 0 0 34 -2,-0.3 2,-0.5 52,-0.2 54,-0.2 -0.794 8.1 172.0-154.6 110.1 68.1 44.2 37.7 22 19 A D - 0 0 34 -2,-0.3 54,-2.1 1,-0.2 4,-0.3 -0.969 9.9-179.4-129.6 113.1 70.2 41.4 39.2 23 20 A L S S+ 0 0 61 -2,-0.5 -1,-0.2 52,-0.2 56,-0.1 0.952 79.3 29.7 -72.5 -51.7 72.2 39.1 36.9 24 21 A H S S+ 0 0 172 1,-0.1 -1,-0.1 51,-0.1 53,-0.1 0.854 121.9 35.5 -86.3 -48.4 73.8 36.8 39.4 25 22 A Y S S+ 0 0 85 51,-0.1 2,-0.3 2,-0.0 -1,-0.1 0.506 117.2 40.7 -98.4 -8.6 71.6 36.2 42.5 26 23 A E + 0 0 83 -4,-0.3 50,-1.1 1,-0.1 3,-0.1 -0.929 50.9 178.3-133.3 161.5 68.2 36.3 40.9 27 24 A G + 0 0 45 -2,-0.3 51,-0.3 48,-0.2 2,-0.3 0.663 52.5 79.1-124.4 -43.7 66.7 34.9 37.6 28 25 A T - 0 0 49 46,-0.1 2,-0.2 48,-0.1 48,-0.1 -0.530 69.6-126.8 -92.2 135.0 63.1 35.6 37.1 29 26 A C E -l 62 0B 4 32,-0.6 34,-2.2 -2,-0.3 2,-0.3 -0.523 30.2-163.3 -71.8 142.6 61.6 38.8 35.9 30 27 A A E -lM 63 73B 15 43,-1.6 43,-2.9 32,-0.2 2,-0.4 -0.989 10.8-172.0-135.7 141.8 58.8 40.1 38.3 31 28 A I E -lM 64 72B 4 32,-2.2 34,-2.3 -2,-0.3 41,-0.2 -0.999 39.6 -94.5-137.3 132.0 56.1 42.7 37.8 32 29 A D E >> -l 65 0B 1 39,-2.2 4,-1.9 -2,-0.4 3,-1.1 -0.180 35.2-129.5 -42.0 125.3 53.7 44.2 40.3 33 30 A Q H 3> S+ 0 0 40 32,-2.0 4,-2.7 1,-0.3 5,-0.2 0.798 107.3 61.1 -54.6 -33.3 50.5 42.1 40.1 34 31 A D H 3> S+ 0 0 66 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.884 105.7 47.4 -60.9 -37.6 48.4 45.3 39.8 35 32 A F H <> S+ 0 0 8 -3,-1.1 4,-2.0 2,-0.2 6,-0.3 0.914 109.7 52.1 -69.4 -44.2 50.3 46.0 36.6 36 33 A L H X>S+ 0 0 0 -4,-1.9 5,-1.9 1,-0.2 4,-0.7 0.951 110.7 49.6 -54.9 -47.4 49.8 42.5 35.3 37 34 A D H ><5S+ 0 0 82 -4,-2.7 3,-1.0 1,-0.2 -1,-0.2 0.915 108.4 52.0 -58.2 -45.1 46.1 42.8 35.9 38 35 A A H 3<5S+ 0 0 34 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.858 116.9 38.8 -63.8 -35.4 45.9 46.2 34.1 39 36 A A H 3<5S- 0 0 0 -4,-2.0 68,-0.3 -3,-0.2 -1,-0.3 0.409 109.2-120.4 -93.1 0.2 47.6 44.8 31.0 40 37 A G T <<5 + 0 0 27 -3,-1.0 2,-0.3 -4,-0.7 -3,-0.2 0.672 62.1 150.2 67.6 16.2 45.8 41.4 31.2 41 38 A I < - 0 0 3 -5,-1.9 2,-0.3 -6,-0.3 -1,-0.2 -0.651 35.2-142.4 -85.2 140.0 49.2 39.7 31.5 42 39 A L > - 0 0 116 -2,-0.3 3,-2.0 4,-0.1 20,-0.4 -0.703 25.1 -95.2-100.0 151.3 49.4 36.4 33.4 43 40 A E T 3 S+ 0 0 97 -2,-0.3 20,-0.2 1,-0.3 3,-0.1 -0.415 115.3 17.6 -53.2 133.5 52.1 35.0 35.7 44 41 A N T 3 S+ 0 0 109 18,-3.3 2,-0.3 1,-0.3 -1,-0.3 0.461 94.0 137.9 74.8 7.5 54.3 32.8 33.6 45 42 A E < - 0 0 33 -3,-2.0 17,-1.0 17,-0.4 -1,-0.3 -0.579 62.5-104.2 -79.8 141.4 53.1 34.3 30.3 46 43 A A E -E 61 0A 71 -2,-0.3 47,-0.3 15,-0.2 2,-0.3 -0.411 45.5-174.6 -57.2 134.3 55.6 35.0 27.6 47 44 A I E -E 60 0A 1 13,-2.5 13,-2.7 45,-0.1 2,-0.4 -0.974 21.7-139.3-133.3 151.1 56.3 38.7 27.3 48 45 A D E -EF 59 91A 38 43,-2.7 43,-2.7 -2,-0.3 2,-0.5 -0.906 15.3-158.3-103.7 135.9 58.3 40.9 25.0 49 46 A I E -EF 58 90A 2 9,-3.1 9,-2.3 -2,-0.4 2,-0.5 -0.982 5.2-169.5-118.0 123.3 60.4 43.7 26.6 50 47 A W E -EF 57 89A 17 39,-2.6 39,-2.3 -2,-0.5 2,-0.8 -0.963 16.3-143.8-115.9 113.7 61.3 46.6 24.3 51 48 A N E > - F 0 88A 0 5,-3.1 4,-2.1 -2,-0.5 37,-0.3 -0.722 13.6-171.6 -88.8 109.0 63.8 48.9 26.0 52 49 A V T 4 S+ 0 0 8 35,-1.9 -1,-0.2 -2,-0.8 36,-0.2 0.848 84.1 53.3 -66.1 -34.6 63.1 52.6 25.0 53 50 A T T 4 S+ 0 0 72 34,-1.3 -1,-0.2 1,-0.2 35,-0.1 0.936 128.1 12.5 -70.7 -46.1 66.4 53.7 26.7 54 51 A N T 4 S- 0 0 54 33,-0.2 -2,-0.2 27,-0.2 -1,-0.2 0.472 94.6-120.9-115.2 -2.3 68.8 51.4 24.9 55 52 A G < + 0 0 10 -4,-2.1 -3,-0.1 1,-0.3 142,-0.0 0.329 59.4 145.7 82.1 -6.0 66.9 49.9 22.1 56 53 A K - 0 0 93 25,-0.2 -5,-3.1 -6,-0.1 2,-0.4 -0.355 29.8-163.6 -68.8 146.0 67.3 46.2 23.2 57 54 A R E +E 50 0A 49 -7,-0.2 2,-0.3 -2,-0.0 -7,-0.2 -0.999 18.4 155.1-133.3 129.1 64.4 43.9 22.5 58 55 A F E -E 49 0A 29 -9,-2.3 -9,-3.1 -2,-0.4 2,-0.4 -0.963 32.8-127.6-153.1 165.7 64.0 40.5 24.1 59 56 A S E +E 48 0A 90 -2,-0.3 -11,-0.2 -11,-0.2 2,-0.2 -0.941 40.3 130.5-122.3 140.6 61.5 37.9 25.2 60 57 A T E -E 47 0A 38 -13,-2.7 -13,-2.5 -2,-0.4 2,-0.3 -0.676 46.1-104.8-155.9-154.7 61.1 36.4 28.6 61 58 A Y E -E 46 0A 96 -15,-0.3 -32,-0.6 -2,-0.2 2,-0.3 -0.956 26.3-139.2-142.7 162.4 58.3 35.6 31.1 62 59 A A E -l 29 0B 0 -17,-1.0 -18,-3.3 -20,-0.4 -17,-0.4 -0.919 4.7-154.8-126.2 152.3 57.3 37.3 34.3 63 60 A I E -l 30 0B 54 -34,-2.2 -32,-2.2 -2,-0.3 2,-0.3 -0.751 39.9 -89.8-107.4 168.0 56.1 36.3 37.7 64 61 A A E -l 31 0B 28 -2,-0.3 2,-0.3 -34,-0.2 -32,-0.2 -0.591 32.3-156.5 -80.9 133.6 54.0 38.5 40.0 65 62 A A E -l 32 0B 14 -34,-2.3 -32,-2.0 -2,-0.3 -31,-0.1 -0.693 49.4 -64.8 -93.7 162.0 55.6 40.8 42.4 66 63 A E > - 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