==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-NOV-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DECARBOXYLASE 12-OCT-97 1AW8 . COMPND 2 MOLECULE: L-ASPARTATE-ALPHA-DECARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR A.ALBERT,V.DHANARAJ,U.GENSCHEL,G.KHAN,M.K.RAMJEE,R.PULIDO, . 228 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10861.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 169 74.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 11.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 65 28.5 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 . 22 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 22 9.6 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 1 1 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 . 0 0 4 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 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 1 A M 0 0 67 0, 0.0 94,-1.6 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 161.2 45.4 32.2 10.0 2 2 A I E -AB 94 208A 52 206,-2.6 206,-1.8 92,-0.2 2,-0.3 -0.892 360.0-152.6-109.9 132.3 46.7 33.3 13.4 3 3 A R E -A 93 0A 8 90,-3.0 90,-1.8 -2,-0.4 2,-0.6 -0.714 12.5-135.0-101.1 152.2 48.0 36.8 14.1 4 4 A T E -A 92 0A 43 202,-0.4 155,-2.3 -2,-0.3 2,-0.3 -0.943 35.4-176.6-105.7 112.2 50.6 37.9 16.7 5 5 A M E -AC 91 158A 0 86,-3.3 86,-2.7 -2,-0.6 2,-0.4 -0.867 35.2-102.5-116.8 149.8 49.2 41.0 18.4 6 6 A L E -A 90 0A 2 151,-2.7 84,-0.3 -2,-0.3 3,-0.1 -0.524 32.4-170.0 -65.6 120.2 50.5 43.4 21.0 7 7 A Q E - 0 0 17 82,-2.8 97,-2.5 -2,-0.4 2,-0.3 0.906 57.0 -51.3 -80.8 -43.5 48.7 42.3 24.1 8 8 A G E -Ad 89 104A 0 81,-1.2 81,-1.9 95,-0.3 -1,-0.3 -0.975 52.2-146.8-179.6 171.4 49.8 45.3 26.2 9 9 A K E -Ad 88 105A 5 95,-2.1 97,-2.2 -2,-0.3 2,-0.7 -0.999 21.2-129.0-158.8 157.1 52.7 47.4 27.4 10 10 A L E -Ad 87 106A 0 77,-2.4 77,-1.9 -2,-0.3 2,-0.8 -0.954 37.7-146.8-106.0 108.9 54.3 49.5 30.1 11 11 A H E -Ad 86 107A 1 95,-3.1 97,-1.9 -2,-0.7 75,-0.2 -0.770 65.3 -17.8 -90.8 113.3 55.3 52.7 28.3 12 12 A R E S+ 0 0 58 -2,-0.8 2,-0.2 73,-0.6 -1,-0.2 0.924 77.6 168.2 63.2 52.4 58.5 54.4 29.5 13 13 A V E -A 85 0A 0 72,-1.7 72,-2.7 -3,-0.4 2,-0.4 -0.614 33.8-121.7 -86.4 155.5 59.0 52.9 32.9 14 14 A K E -A 84 0A 86 -2,-0.2 2,-0.2 70,-0.2 70,-0.2 -0.839 21.2-116.7-103.5 133.7 62.3 53.6 34.6 15 15 A V - 0 0 1 68,-2.8 67,-2.3 -2,-0.4 55,-0.2 -0.531 30.8-178.1 -65.9 132.1 64.5 50.7 35.6 16 16 A T + 0 0 54 53,-2.9 2,-0.3 1,-0.3 54,-0.2 0.532 60.4 19.8-110.4 -12.7 64.9 50.8 39.4 17 17 A H E -k 70 0B 95 52,-1.5 54,-2.5 63,-0.1 2,-0.4 -0.982 52.2-163.7-158.8 148.0 67.3 47.8 40.1 18 18 A A E -k 71 0B 39 -2,-0.3 2,-0.3 52,-0.2 54,-0.2 -0.997 8.4-179.9-136.1 127.0 69.9 45.6 38.3 19 19 A D E > +k 72 0B 50 52,-2.0 54,-3.0 -2,-0.4 3,-1.0 -0.752 10.2 177.4-134.4 92.5 71.1 42.3 39.7 20 20 A L T 3 S+ 0 0 74 -2,-0.3 -1,-0.1 1,-0.2 2,-0.1 0.823 76.8 66.5 -59.6 -30.3 73.6 40.5 37.6 21 21 A H T 3 S- 0 0 169 52,-0.1 -1,-0.2 1,-0.1 2,-0.2 0.003 110.8 -51.2 -91.3 27.9 73.8 37.8 40.3 22 22 A Y S < S+ 0 0 169 -3,-1.0 51,-0.6 -2,-0.1 -3,-0.1 -0.816 84.2 104.6 132.5 177.7 70.4 36.0 40.4 23 23 A E 0 0 107 -2,-0.2 49,-0.1 1,-0.2 -3,-0.1 0.022 360.0 360.0 99.8 -17.9 66.6 36.5 40.6 24 24 A G 0 0 39 -5,-0.2 -1,-0.2 47,-0.1 50,-0.2 0.140 360.0 360.0 0.1 360.0 67.2 35.7 37.2 25 !* 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 26 26 B C 0 0 4 0, 0.0 34,-2.3 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 104.7 62.5 41.4 35.2 27 27 B A E -lM 60 70B 12 43,-1.6 43,-2.3 32,-0.2 2,-0.4 -0.773 360.0-171.7 -80.7 131.6 60.5 41.8 38.4 28 28 B I E -lM 61 69B 0 32,-2.4 34,-2.3 -2,-0.4 41,-0.2 -0.997 34.6 -96.1-132.4 132.1 57.7 44.2 37.8 29 29 B D E >> -l 62 0B 1 39,-1.9 3,-1.7 -2,-0.4 4,-1.7 -0.215 35.6-128.6 -45.1 122.6 55.3 45.7 40.4 30 30 B Q H 3> S+ 0 0 51 32,-2.4 4,-2.3 1,-0.3 -1,-0.2 0.757 108.2 59.9 -47.4 -33.6 52.2 43.5 40.3 31 31 B D H 3> S+ 0 0 65 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.877 104.7 49.3 -64.5 -38.7 50.0 46.6 39.8 32 32 B F H <> S+ 0 0 8 -3,-1.7 4,-1.8 2,-0.2 6,-0.3 0.919 109.9 50.5 -67.2 -42.3 51.9 47.4 36.6 33 33 B L H X>S+ 0 0 0 -4,-1.7 5,-1.8 1,-0.2 4,-0.9 0.911 109.4 52.5 -61.2 -40.4 51.5 43.9 35.4 34 34 B D H <5S+ 0 0 87 -4,-2.3 3,-0.4 1,-0.2 -1,-0.2 0.901 108.4 49.6 -61.5 -44.7 47.7 44.2 36.1 35 35 B A H <5S+ 0 0 38 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.829 117.0 40.5 -64.7 -36.2 47.4 47.4 34.1 36 36 B A H <5S- 0 0 0 -4,-1.8 68,-0.4 -5,-0.1 -1,-0.2 0.496 108.9-121.2 -91.2 -5.2 49.2 46.0 31.1 37 37 B G T <5 + 0 0 29 -4,-0.9 2,-0.3 -3,-0.4 -3,-0.2 0.644 60.1 152.5 74.4 16.4 47.5 42.6 31.4 38 38 B I < - 0 0 4 -5,-1.8 -1,-0.2 -6,-0.3 2,-0.2 -0.607 33.0-145.0 -85.5 136.1 50.8 40.9 31.7 39 39 B L > - 0 0 120 -2,-0.3 3,-1.6 -3,-0.1 20,-0.3 -0.633 25.0 -97.1 -98.8 157.9 51.1 37.6 33.6 40 40 B E T 3 S+ 0 0 97 1,-0.3 20,-0.2 -2,-0.2 3,-0.1 -0.506 112.9 19.8 -72.6 139.1 53.9 36.3 35.8 41 41 B N T 3 S+ 0 0 114 18,-3.3 -1,-0.3 1,-0.3 2,-0.2 0.383 94.2 136.0 79.6 1.0 56.1 33.9 33.8 42 42 B E < - 0 0 36 -3,-1.6 17,-2.5 17,-0.1 -1,-0.3 -0.547 63.4-106.6 -80.7 141.7 54.9 35.4 30.5 43 43 B A E -E 58 0A 71 15,-0.2 47,-0.4 -2,-0.2 2,-0.3 -0.484 43.5-174.3 -66.5 135.5 57.4 36.2 27.9 44 44 B I E -E 57 0A 1 13,-2.0 13,-2.4 -2,-0.2 2,-0.4 -0.951 21.5-138.5-134.7 151.2 58.1 39.9 27.5 45 45 B D E -EF 56 88A 40 43,-3.0 43,-2.9 -2,-0.3 2,-0.5 -0.925 16.8-158.1-107.3 135.2 60.1 42.1 25.1 46 46 B I E -EF 55 87A 1 9,-3.2 9,-2.2 -2,-0.4 2,-0.6 -0.973 5.1-168.5-118.9 120.8 62.1 45.0 26.7 47 47 B W E -EF 54 86A 16 39,-2.9 39,-2.2 -2,-0.5 2,-0.8 -0.951 15.3-143.4-112.4 113.2 63.1 47.9 24.4 48 48 B N E > - F 0 85A 0 5,-3.2 4,-1.8 -2,-0.6 37,-0.3 -0.704 13.6-172.3 -80.9 109.9 65.6 50.3 26.0 49 49 B V T 4 S+ 0 0 10 35,-2.0 36,-0.2 -2,-0.8 -1,-0.2 0.858 84.6 52.8 -68.7 -33.3 64.8 53.9 25.0 50 50 B T T 4 S+ 0 0 74 34,-1.4 -1,-0.1 1,-0.1 35,-0.1 0.970 127.7 12.4 -68.6 -56.7 68.0 55.0 26.6 51 51 B N T 4 S- 0 0 61 33,-0.2 -2,-0.2 27,-0.2 -1,-0.1 0.510 95.8-120.7-103.6 -5.6 70.6 52.8 25.0 52 52 B G < + 0 0 13 -4,-1.8 2,-0.1 1,-0.3 -3,-0.1 0.493 59.1 146.6 82.4 1.5 68.6 51.2 22.2 53 53 B K - 0 0 93 25,-0.2 -5,-3.2 -6,-0.1 2,-0.4 -0.453 29.8-162.6 -74.2 144.9 69.1 47.6 23.3 54 54 B R E +E 47 0A 59 -7,-0.2 2,-0.3 -2,-0.1 -7,-0.2 -0.991 19.5 156.0-132.2 122.1 66.2 45.1 22.6 55 55 B F E -E 46 0A 28 -9,-2.2 -9,-3.2 -2,-0.4 2,-0.4 -0.922 30.6-133.0-143.6 166.3 65.9 41.8 24.4 56 56 B S E +E 45 0A 87 -2,-0.3 -11,-0.2 -11,-0.2 2,-0.2 -0.965 37.4 131.9-124.5 142.2 63.4 39.2 25.4 57 57 B T E -E 44 0A 36 -13,-2.4 -13,-2.0 -2,-0.4 2,-0.3 -0.604 49.4 -86.3-156.7-147.4 62.9 37.5 28.8 58 58 B Y E -E 43 0A 94 -15,-0.3 -15,-0.2 -2,-0.2 2,-0.2 -0.977 35.5-104.6-143.5 153.3 60.0 36.7 31.1 59 59 B A - 0 0 0 -17,-2.5 -18,-3.3 -20,-0.3 2,-0.3 -0.552 24.5-172.2 -83.8 145.4 58.1 38.6 33.8 60 60 B I E -l 27 0B 32 -34,-2.3 -32,-2.4 -2,-0.2 2,-0.4 -0.915 29.3-114.8-128.1 147.6 58.3 38.0 37.6 61 61 B A E -l 28 0B 24 -2,-0.3 2,-0.3 -34,-0.2 -32,-0.2 -0.751 23.5-162.1 -93.1 135.6 56.0 39.8 40.0 62 62 B A E -l 29 0B 15 -34,-2.3 -32,-2.4 -2,-0.4 -31,-0.1 -0.778 43.9 -76.7-106.4 156.2 57.3 42.3 42.5 63 63 B E > - 0 0 158 -2,-0.3 3,-1.7 -34,-0.2 5,-0.3 -0.236 60.5 -93.2 -56.7 140.5 55.1 43.3 45.5 64 64 B R T 3 S+ 0 0 136 1,-0.3 -1,-0.1 -35,-0.2 -35,-0.0 -0.197 107.7 17.0 -55.2 143.3 52.3 45.7 44.7 65 65 B G T 3 S+ 0 0 48 -3,-0.1 -1,-0.3 1,-0.1 -2,-0.1 0.395 91.9 108.5 75.1 -2.3 53.0 49.4 45.2 66 66 B S < - 0 0 36 -3,-1.7 -2,-0.1 2,-0.1 -1,-0.1 0.781 69.1-148.5 -75.0 -26.6 56.8 48.8 45.2 67 67 B R + 0 0 79 -4,-0.3 2,-0.2 1,-0.2 -3,-0.1 0.661 37.8 163.7 63.9 23.0 57.1 50.4 41.7 68 68 B I + 0 0 58 -5,-0.3 -39,-1.9 -53,-0.1 2,-0.4 -0.439 27.9 177.1 -76.8 140.9 60.0 48.1 41.1 69 69 B I E + M 0 28B 0 -41,-0.2 -53,-2.9 -2,-0.2 -52,-1.5 -0.887 19.6 177.5-139.8 95.8 61.4 47.4 37.6 70 70 B S E -kM 17 27B 7 -43,-2.3 -43,-1.6 -2,-0.4 2,-0.8 -0.940 21.6-156.9-114.7 120.8 64.4 45.1 38.2 71 71 B V E +k 18 0B 2 -54,-2.5 -52,-2.0 -2,-0.5 2,-0.3 -0.858 27.5 179.1 -96.2 111.3 66.5 43.6 35.4 72 72 B N E > +k 19 0B 6 -2,-0.8 3,-1.1 -54,-0.2 -52,-0.2 -0.781 37.0 3.9-112.1 164.4 68.2 40.5 36.8 73 73 B G G > S- 0 0 11 -54,-3.0 3,-2.1 -51,-0.6 4,-0.1 -0.424 128.4 -11.2 65.8-146.4 70.5 37.8 35.6 74 74 B A G > S+ 0 0 81 1,-0.3 3,-1.9 -50,-0.2 -1,-0.2 0.754 128.6 72.1 -56.7 -27.0 71.9 38.1 32.1 75 75 B A G X> S+ 0 0 11 -3,-1.1 3,-2.5 1,-0.3 4,-0.7 0.782 78.5 76.2 -60.7 -27.2 69.4 40.9 31.4 76 76 B A G <4 S+ 0 0 12 -3,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.598 85.1 64.7 -61.4 -10.3 71.5 43.2 33.7 77 77 B H G <4 S+ 0 0 127 -3,-1.9 -1,-0.3 1,-0.1 -2,-0.2 0.556 104.9 45.1 -86.8 -10.3 73.9 43.5 30.8 78 78 B C T <4 S+ 0 0 32 -3,-2.5 2,-0.3 1,-0.2 -25,-0.2 0.550 115.3 35.4-110.4 -11.9 71.2 45.3 28.8 79 79 B A < - 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