==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 31-AUG-11 3TM7 . COMPND 2 MOLECULE: ASPARTATE 1-DECARBOXYLASE BETA CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR M.E.WEBB,C.M.C LOBLEY,F.SOLIMAN,M.L.KILKENNY,A.G.SMITH,C.ABE . 245 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12103.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 165 67.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 27 11.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 67 27.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 . 18 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 22 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 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 . 0 0 3 3 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 1 3 2 2 0 0 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 . 1 0 2 0 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 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 G 0 0 38 0, 0.0 2,-0.2 0, 0.0 219,-0.1 0.000 360.0 360.0 360.0-179.2 2.7 72.2 44.4 2 0 A S - 0 0 98 213,-0.1 2,-0.3 214,-0.1 218,-0.0 0.467 360.0-135.5 -66.3 146.4 4.6 72.7 46.4 3 1 A M - 0 0 36 -2,-0.2 95,-1.3 213,-0.1 2,-0.5 -0.631 17.6-145.4 -79.6 133.6 5.2 69.0 46.0 4 2 A I E -AB 97 215A 41 211,-2.5 211,-1.9 -2,-0.3 2,-0.2 -0.912 8.3-152.1-114.5 129.9 5.5 67.3 49.4 5 3 A R E -A 96 0A 7 91,-2.9 91,-1.9 -2,-0.5 2,-0.6 -0.648 12.2-135.2 -96.7 152.0 7.8 64.3 50.1 6 4 A T E +A 95 0A 43 207,-0.5 160,-2.7 -2,-0.2 2,-0.3 -0.951 36.7 179.8-106.5 117.4 7.5 61.5 52.7 7 5 A M E -AC 94 165A 0 87,-3.2 87,-2.4 -2,-0.6 2,-0.5 -0.889 37.7 -99.3-125.8 145.7 10.8 61.0 54.4 8 6 A L E -A 93 0A 1 156,-3.3 85,-0.3 -2,-0.3 3,-0.1 -0.505 34.7-175.0 -60.3 115.1 12.3 58.8 57.0 9 7 A Q E - 0 0 17 83,-2.3 98,-2.4 -2,-0.5 2,-0.3 0.877 59.1 -43.0 -77.6 -42.3 12.3 61.0 60.1 10 8 A G E -Ad 92 107A 0 82,-1.4 82,-2.4 96,-0.3 -1,-0.3 -0.974 53.6-152.3-179.1 163.7 14.1 58.6 62.3 11 9 A K E -Ad 91 108A 3 96,-2.1 98,-2.2 -2,-0.3 2,-0.6 -0.997 22.0-132.2-154.8 154.6 14.5 55.0 63.4 12 10 A L E -Ad 90 109A 0 78,-2.5 78,-2.0 -2,-0.3 2,-0.7 -0.960 37.5-148.5-101.1 112.4 15.4 52.5 66.1 13 11 A H E - d 0 110A 5 96,-3.0 98,-1.8 -2,-0.6 76,-0.2 -0.792 64.7 -15.6 -98.6 112.9 17.7 50.1 64.3 14 12 A R E S+ 0 0 54 -2,-0.7 -1,-0.2 74,-0.5 75,-0.2 0.858 79.6 167.0 65.5 44.5 17.7 46.5 65.5 15 13 A V E -A 88 0A 0 73,-1.6 73,-3.0 -3,-0.4 2,-0.4 -0.541 33.7-121.8 -75.7 154.0 16.1 46.9 68.8 16 14 A K E -A 87 0A 90 71,-0.2 2,-0.3 -2,-0.2 71,-0.2 -0.834 19.7-116.5-103.8 133.0 15.0 43.7 70.6 17 15 A V - 0 0 2 69,-2.7 68,-2.3 -2,-0.4 56,-0.2 -0.525 30.7-178.9 -65.5 127.7 11.3 43.1 71.6 18 16 A T + 0 0 62 54,-2.7 2,-0.3 1,-0.3 55,-0.2 0.669 64.2 22.9-103.4 -24.2 11.2 42.8 75.4 19 17 A H E +l 73 0B 20 53,-1.6 55,-2.5 64,-0.1 2,-0.3 -0.995 54.7 177.6-148.2 138.5 7.5 42.1 76.0 20 18 A A E +l 74 0B 40 -2,-0.3 2,-0.4 53,-0.2 55,-0.2 -0.904 9.9 167.4-147.6 117.5 4.6 40.8 73.8 21 19 A D E -l 75 0B 83 53,-2.1 55,-1.7 -2,-0.3 58,-0.2 -0.980 24.7-169.3-140.1 118.2 1.1 40.3 75.1 22 20 A L S S+ 0 0 96 -2,-0.4 -1,-0.1 53,-0.2 53,-0.1 0.782 96.9 45.5 -68.5 -30.5 -2.1 39.6 73.2 23 21 A H S S+ 0 0 81 53,-0.1 2,-0.6 2,-0.1 -1,-0.2 0.585 77.2 112.6-100.0 -8.3 -4.1 40.2 76.2 24 22 A Y - 0 0 41 1,-0.1 2,-1.8 52,-0.1 52,-0.4 -0.512 58.7-150.4 -65.1 113.7 -2.5 43.4 77.6 25 23 A E 0 0 113 -2,-0.6 -1,-0.1 50,-0.1 -2,-0.1 -0.591 360.0 360.0 -84.8 76.9 -5.3 45.9 77.2 26 24 A G 0 0 66 -2,-1.8 49,-0.1 2,-0.0 -2,-0.0 -0.833 360.0 360.0-177.1 360.0 -2.8 48.7 76.7 27 !* 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 28 25 B S 0 0 36 0, 0.0 47,-1.6 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 -88.2 1.0 49.4 72.5 29 26 B C E -M 74 0B 1 32,-0.2 34,-2.4 45,-0.2 2,-0.4 -0.709 360.0-171.7-118.3 101.7 4.3 49.6 71.0 30 27 B A E -Mn 73 63B 21 43,-1.8 43,-2.8 -2,-0.2 2,-0.4 -0.774 3.1-173.8 -86.4 136.1 5.6 51.1 74.2 31 28 B I E -Mn 72 64B 0 32,-2.3 34,-2.4 -2,-0.4 41,-0.2 -0.998 34.5 -96.5-137.3 126.8 9.2 52.3 73.8 32 29 B D E >> - n 0 65B 2 39,-2.1 4,-1.9 -2,-0.4 3,-1.2 -0.161 35.5-127.9 -39.6 125.6 11.6 53.6 76.4 33 30 B Q H 3> S+ 0 0 46 32,-2.0 4,-2.7 1,-0.3 5,-0.2 0.816 107.9 60.7 -53.5 -34.8 11.4 57.4 76.2 34 31 B D H 3> S+ 0 0 66 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.865 105.6 47.9 -59.2 -37.9 15.2 57.7 75.8 35 32 B F H <> S+ 0 0 6 -3,-1.2 4,-1.9 2,-0.2 6,-0.3 0.916 110.3 51.3 -70.1 -45.2 14.9 55.7 72.6 36 33 B L H X>S+ 0 0 0 -4,-1.9 5,-1.9 1,-0.2 4,-0.8 0.940 109.7 51.2 -55.5 -46.4 12.0 57.9 71.4 37 34 B D H ><5S+ 0 0 92 -4,-2.7 3,-0.8 1,-0.2 -1,-0.2 0.908 109.1 49.9 -57.8 -44.9 14.2 61.0 72.1 38 35 B A H 3<5S+ 0 0 39 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.857 116.9 39.7 -67.0 -33.6 17.1 59.6 70.1 39 36 B A H 3<5S- 0 0 0 -4,-1.9 68,-0.3 -3,-0.2 -1,-0.3 0.402 109.2-120.8 -91.7 -3.3 15.0 58.7 67.1 40 37 B G T <<5 + 0 0 28 -3,-0.8 2,-0.3 -4,-0.8 -3,-0.2 0.667 59.8 152.9 68.1 22.5 12.9 61.9 67.3 41 38 B I < - 0 0 4 -5,-1.9 2,-0.3 -6,-0.3 -1,-0.2 -0.641 32.8-144.2 -88.6 136.1 9.8 59.8 67.6 42 39 B L > - 0 0 117 -2,-0.3 3,-2.0 4,-0.1 20,-0.3 -0.665 25.6 -94.2 -97.7 149.0 6.8 61.4 69.5 43 40 B E T 3 S+ 0 0 107 -2,-0.3 20,-0.2 1,-0.2 3,-0.1 -0.441 114.6 16.7 -54.5 136.3 4.2 59.8 71.8 44 41 B N T 3 S+ 0 0 118 18,-3.3 -1,-0.2 1,-0.3 2,-0.2 0.449 94.1 139.5 72.3 6.6 1.2 58.9 69.7 45 42 B E < - 0 0 34 -3,-2.0 17,-2.2 17,-0.2 -1,-0.3 -0.575 61.5-105.1 -78.1 141.1 3.1 59.2 66.4 46 43 B A E -E 61 0A 73 -2,-0.2 47,-0.4 15,-0.2 2,-0.3 -0.419 45.3-174.5 -57.3 135.1 2.5 56.6 63.7 47 44 B I E -E 60 0A 2 13,-2.0 13,-2.7 45,-0.1 2,-0.4 -0.980 21.0-139.8-134.1 149.5 5.4 54.1 63.4 48 45 B D E -EF 59 91A 38 43,-2.6 43,-2.8 -2,-0.3 2,-0.5 -0.889 15.1-157.5-103.5 138.2 6.3 51.3 61.1 49 46 B I E -EF 58 90A 3 9,-3.2 9,-2.5 -2,-0.4 2,-0.6 -0.984 5.6-169.8-119.7 122.6 7.7 48.1 62.6 50 47 B W E -EF 57 89A 16 39,-2.5 39,-2.2 -2,-0.5 2,-0.8 -0.956 15.7-144.7-113.7 116.6 9.8 45.8 60.3 51 48 B N E > - F 0 88A 0 5,-3.1 4,-1.9 -2,-0.6 37,-0.2 -0.719 13.2-172.4 -91.5 107.9 10.6 42.5 62.0 52 49 B V T 4 S+ 0 0 10 35,-1.9 -1,-0.2 -2,-0.8 36,-0.2 0.831 83.8 55.4 -65.4 -36.1 14.0 41.3 60.9 53 50 B T T 4 S+ 0 0 72 34,-1.3 -1,-0.2 1,-0.2 35,-0.1 0.937 127.3 11.4 -65.6 -48.3 13.5 38.0 62.5 54 51 B N T 4 S- 0 0 59 33,-0.2 -2,-0.2 27,-0.2 -1,-0.2 0.421 95.1-119.7-114.8 -0.8 10.2 36.9 60.8 55 52 B G < + 0 0 13 -4,-1.9 -3,-0.1 1,-0.2 2,-0.1 0.401 60.5 146.5 76.3 -1.9 9.9 39.4 58.0 56 53 B K - 0 0 100 25,-0.2 -5,-3.1 -6,-0.1 2,-0.4 -0.385 29.8-162.9 -69.5 146.0 6.5 40.7 59.2 57 54 B R E +E 50 0A 57 -7,-0.2 2,-0.3 -2,-0.1 -7,-0.2 -0.997 18.4 155.0-134.1 125.9 5.8 44.4 58.5 58 55 B F E -E 49 0A 31 -9,-2.5 -9,-3.2 -2,-0.4 2,-0.4 -0.938 31.4-130.9-149.1 167.2 3.1 46.4 60.3 59 56 B S E +E 48 0A 88 -2,-0.3 -11,-0.2 -11,-0.2 2,-0.2 -0.982 37.0 135.5-126.4 138.3 2.2 49.9 61.3 60 57 B T E -E 47 0A 38 -13,-2.7 -13,-2.0 -2,-0.4 2,-0.3 -0.527 47.7 -85.8-148.8-150.3 1.0 51.1 64.7 61 58 B Y E -E 46 0A 112 -15,-0.3 2,-0.3 -2,-0.2 -32,-0.2 -0.965 33.6-114.0-138.9 156.0 1.7 54.1 67.0 62 59 B A - 0 0 0 -17,-2.2 -18,-3.3 -20,-0.3 2,-0.3 -0.666 24.6-176.8 -90.3 138.5 4.3 54.8 69.7 63 60 B I E -n 30 0B 8 -34,-2.4 -32,-2.3 -2,-0.3 2,-0.3 -0.977 31.5-110.5-126.3 147.3 3.6 55.2 73.4 64 61 B A E -n 31 0B 33 -2,-0.3 2,-0.3 -34,-0.2 -32,-0.2 -0.596 25.4-160.8 -78.6 134.7 6.4 56.1 75.9 65 62 B A E -n 32 0B 14 -34,-2.4 -32,-2.0 -2,-0.3 -31,-0.1 -0.690 47.2 -64.5 -98.4 163.8 7.6 53.6 78.4 66 63 B E > - 0 0 153 -2,-0.3 3,-2.2 -34,-0.2 5,-0.3 -0.146 62.0 -98.0 -50.8 134.7 9.5 54.7 81.5 67 64 B R T 3 S+ 0 0 137 1,-0.3 -1,-0.1 -35,-0.2 -35,-0.1 -0.362 109.1 14.6 -55.4 128.6 12.9 56.3 80.8 68 65 B G T 3 S+ 0 0 48 -3,-0.1 -1,-0.3 -2,-0.1 -2,-0.1 0.370 92.5 110.3 82.3 -0.5 15.7 53.8 81.2 69 66 B S < - 0 0 34 -3,-2.2 -2,-0.1 2,-0.1 3,-0.1 0.721 69.1-146.9 -71.5 -22.7 13.4 50.7 81.2 70 67 B R + 0 0 81 -4,-0.3 2,-0.2 1,-0.2 -3,-0.1 0.664 39.0 164.5 56.5 25.1 14.7 49.7 77.8 71 68 B I + 0 0 59 -5,-0.3 -39,-2.1 -53,-0.1 2,-0.3 -0.427 29.1 176.5 -75.4 137.2 11.3 48.4 77.0 72 69 B I E + M 0 31B 1 -41,-0.2 -54,-2.7 -2,-0.2 -53,-1.6 -0.895 24.1 178.0-130.4 101.4 10.1 47.5 73.4 73 70 B S E -lM 19 30B 33 -43,-2.8 -43,-1.8 -2,-0.3 2,-0.4 -0.941 19.6-163.4-118.3 128.3 6.6 46.1 74.1 74 71 B V E -lM 20 29B 2 -55,-2.5 -53,-2.1 -2,-0.5 2,-0.3 -0.849 17.0-173.0-107.1 135.9 4.0 44.9 71.6 75 72 B A E > -l 21 0B 10 -47,-1.6 3,-1.4 -2,-0.4 4,-0.5 -0.849 40.7 -16.0-126.0 161.6 0.4 44.5 72.7 76 73 B G G > S+ 0 0 22 -55,-1.7 3,-1.3 -52,-0.4 4,-0.3 -0.076 127.3 4.0 55.1-132.2 -2.9 43.2 71.3 77 74 B A G > S+ 0 0 82 1,-0.3 3,-1.8 2,-0.2 -1,-0.3 0.860 128.3 61.9 -56.1 -38.2 -3.1 42.6 67.6 78 75 B A G X> S+ 0 0 13 -3,-1.4 3,-2.1 1,-0.3 4,-0.7 0.746 87.3 72.7 -65.7 -22.6 0.5 43.5 67.2 79 76 B A G <4 S+ 0 0 19 -3,-1.3 -1,-0.3 -4,-0.5 -2,-0.2 0.660 86.7 65.3 -67.2 -12.9 1.6 40.6 69.4 80 77 B H G <4 S+ 0 0 124 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.546 105.9 44.7 -74.6 -12.0 0.6 38.4 66.4 81 78 B C T <4 S+ 0 0 32 -3,-2.1 2,-0.3 1,-0.2 -25,-0.2 0.529 117.6 30.1-113.3 -11.0 3.5 40.0 64.5 82 79 B A < - 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