==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-FEB-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 12-JUL-10 3NX1 . COMPND 2 MOLECULE: FERULIC ACID DECARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTER SP. PX6-4; . AUTHOR W.GU,J.K.YANG,Z.Y.LOU,Z.H.MENG,K.-Q.ZHANG . 327 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12976.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 236 72.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 119 36.4 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 . 8 2.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 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 . 35 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 24 7.3 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 0 2 0 0 0 1 1 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 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 0 0 3 4 1 7 1 0 0 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 0 0 0 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 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 D > 0 0 132 0, 0.0 3,-1.6 0, 0.0 55,-0.0 0.000 360.0 360.0 360.0 111.5 -19.1 23.5 23.3 2 6 A K T 3 + 0 0 71 1,-0.3 54,-1.3 55,-0.1 56,-0.1 0.555 360.0 59.3 -64.7 -7.1 -17.5 21.1 20.6 3 7 A H T 3 S+ 0 0 132 52,-0.1 2,-0.8 1,-0.1 -1,-0.3 0.250 79.4 100.6-107.0 16.1 -17.7 23.7 17.9 4 8 A D < + 0 0 64 -3,-1.6 3,-0.4 1,-0.1 -1,-0.1 -0.864 36.7 170.6-112.0 104.3 -15.6 26.3 19.7 5 9 A L >> + 0 0 22 -2,-0.8 4,-3.0 1,-0.2 3,-1.8 0.202 43.9 119.5 -96.5 11.2 -12.0 26.3 18.3 6 10 A S T 34 S+ 0 0 91 1,-0.3 -1,-0.2 2,-0.2 -2,-0.0 0.736 72.4 43.8 -43.5 -43.9 -11.4 29.4 20.3 7 11 A G T 34 S+ 0 0 33 -3,-0.4 -1,-0.3 1,-0.1 -2,-0.1 0.329 121.0 40.7 -94.1 3.0 -8.6 28.0 22.5 8 12 A F T X4 S+ 0 0 0 -3,-1.8 3,-2.0 3,-0.1 19,-0.2 0.698 85.9 93.7-124.7 -33.0 -6.9 26.3 19.6 9 13 A V T 3< S+ 0 0 38 -4,-3.0 132,-0.2 1,-0.2 19,-0.2 -0.416 94.8 27.9 -58.1 126.1 -7.1 28.8 16.6 10 14 A G T 3 S+ 0 0 0 17,-3.0 130,-3.9 1,-0.3 -1,-0.2 0.243 88.2 146.3 101.3 -13.6 -3.8 30.8 16.7 11 15 A K E < -A 139 0A 22 -3,-2.0 16,-2.6 128,-0.3 2,-0.4 -0.344 30.4-168.2 -63.7 128.5 -1.8 28.0 18.4 12 16 A H E -AB 138 26A 3 126,-2.1 126,-1.3 14,-0.2 2,-0.4 -0.991 15.3-179.8-120.6 124.9 1.8 27.7 17.4 13 17 A L E -AB 137 25A 0 12,-2.4 12,-2.4 -2,-0.4 2,-0.4 -0.990 22.0-165.3-139.0 135.0 3.3 24.4 18.6 14 18 A V E +AB 136 24A 3 122,-2.3 121,-1.9 -2,-0.4 122,-1.3 -0.938 25.8 163.5-117.3 139.3 6.8 22.7 18.4 15 19 A Y E -AB 134 23A 5 8,-2.2 8,-2.7 -2,-0.4 2,-0.4 -0.980 29.9-140.2-161.9 153.2 6.9 19.0 19.3 16 20 A T E -AB 133 22A 45 117,-1.5 117,-2.9 -2,-0.3 6,-0.2 -0.994 23.3-130.0-124.8 118.5 9.2 15.9 18.9 17 21 A Y E > -A 132 0A 5 4,-3.5 3,-2.3 -2,-0.4 115,-0.3 -0.317 28.5-109.0 -59.4 145.3 7.8 12.4 18.0 18 22 A D T 3 S+ 0 0 89 113,-3.5 114,-0.1 1,-0.2 -1,-0.1 0.754 121.5 61.9 -46.2 -29.1 8.8 9.4 20.1 19 23 A N T 3 S- 0 0 64 112,-0.2 -1,-0.2 2,-0.1 3,-0.1 0.477 123.1-103.7 -73.5 3.8 10.8 8.4 16.9 20 24 A G S < S+ 0 0 45 -3,-2.3 2,-0.2 1,-0.3 -2,-0.1 0.112 76.1 141.5 85.6 -16.0 13.1 11.6 17.1 21 25 A W - 0 0 37 -5,-0.1 -4,-3.5 1,-0.0 2,-0.4 -0.426 40.5-150.2 -64.6 127.7 11.2 13.4 14.3 22 26 A N E +B 16 0A 37 -6,-0.2 16,-2.1 -2,-0.2 17,-1.4 -0.808 22.7 167.8-108.3 134.7 10.7 17.2 15.1 23 27 A Y E -BC 15 37A 14 -8,-2.7 -8,-2.2 -2,-0.4 2,-0.3 -0.940 20.3-155.9-150.4 159.9 7.6 19.1 13.7 24 28 A E E -BC 14 36A 0 12,-1.2 12,-2.2 -2,-0.3 2,-0.4 -0.992 8.3-165.9-151.4 134.8 5.9 22.4 14.2 25 29 A I E -BC 13 35A 0 -12,-2.4 -12,-2.4 -2,-0.3 2,-0.4 -0.967 7.8-165.8-125.5 140.6 2.3 23.4 13.5 26 30 A Y E -BC 12 34A 0 8,-2.8 8,-2.3 -2,-0.4 2,-0.9 -0.919 16.8-145.5-124.7 113.7 0.5 26.8 13.3 27 31 A V E - C 0 33A 0 -16,-2.6 -17,-3.0 -2,-0.4 6,-0.2 -0.614 18.3-174.6 -79.3 105.7 -3.3 26.7 13.4 28 32 A K E - 0 0 0 4,-1.5 115,-2.6 -2,-0.9 2,-0.3 0.815 55.9 -38.9 -80.7 -29.4 -4.2 29.6 11.0 29 33 A N E > S- C 0 32A 26 3,-1.5 3,-0.8 113,-0.2 -19,-0.1 -0.869 86.3 -54.9-179.2-171.8 -8.0 29.7 11.4 30 34 A D T 3 S+ 0 0 94 -2,-0.3 24,-0.5 1,-0.2 -2,-0.0 0.746 135.3 19.9 -66.6 -24.5 -11.0 27.3 11.8 31 35 A N T 3 S+ 0 0 67 22,-0.1 21,-2.1 20,-0.0 2,-0.4 0.231 112.6 68.8-126.9 31.4 -9.9 25.4 8.6 32 36 A T E < -CD 29 51A 12 -3,-0.8 -3,-1.5 19,-0.3 -4,-1.5 -0.989 46.0-178.2-151.0 143.1 -6.3 26.1 7.8 33 37 A I E -CD 27 50A 0 17,-2.0 17,-2.0 -2,-0.4 2,-0.4 -0.961 15.6-150.4-134.6 160.3 -2.9 25.4 9.0 34 38 A D E -C 26 0A 0 -8,-2.3 -8,-2.8 -2,-0.3 2,-0.3 -0.920 24.6-177.8-113.1 145.7 0.7 26.1 8.3 35 39 A Y E -CD 25 47A 7 12,-3.0 12,-2.8 -2,-0.4 2,-0.3 -0.983 18.6-164.0-143.4 169.4 3.4 23.6 9.2 36 40 A R E -CD 24 46A 3 -12,-2.2 -12,-1.2 -2,-0.3 2,-0.5 -0.965 12.8-150.2-149.1 119.2 7.2 23.1 9.1 37 41 A I E -C 23 0A 5 8,-2.8 7,-2.2 -2,-0.3 115,-0.3 -0.822 11.6-174.8 -92.8 125.4 8.9 19.7 9.5 38 42 A H - 0 0 38 -16,-2.1 2,-0.3 -2,-0.5 -15,-0.2 0.769 61.4 -9.3 -94.2 -24.6 12.4 20.0 11.0 39 43 A S S S+ 0 0 48 -17,-1.4 2,-0.3 4,-0.1 3,-0.3 -0.934 88.1 70.9-158.0 167.1 13.8 16.5 10.9 40 44 A G S > S- 0 0 36 -2,-0.3 3,-1.2 1,-0.2 -3,-0.0 -0.711 101.3 -26.4 120.2-153.2 12.8 12.9 10.2 41 45 A L T 3 S+ 0 0 49 1,-0.3 -1,-0.2 -2,-0.3 -20,-0.0 0.885 146.5 27.1 -56.2 -42.3 11.9 11.3 6.8 42 46 A V T > S+ 0 0 2 -3,-0.3 3,-1.5 60,-0.1 -1,-0.3 -0.334 85.0 171.5-119.2 45.2 10.8 14.5 5.3 43 47 A G T < + 0 0 22 -3,-1.2 -5,-0.2 1,-0.2 -3,-0.1 -0.382 65.8 23.0 -65.5 136.6 12.9 17.0 7.2 44 48 A N T 3 S+ 0 0 43 -7,-2.2 -1,-0.2 1,-0.3 108,-0.2 0.186 84.8 130.5 87.7 -7.7 12.7 20.6 5.8 45 49 A R < + 0 0 4 -3,-1.5 -8,-2.8 58,-0.1 -1,-0.3 -0.460 34.0 177.6 -59.4 136.5 9.4 20.2 4.1 46 50 A W E -De 36 105A 28 58,-1.8 60,-2.0 -10,-0.2 2,-0.3 -0.995 13.5-162.8-149.1 164.3 7.0 23.0 4.9 47 51 A V E -D 35 0A 2 -12,-2.8 -12,-3.0 -2,-0.3 2,-0.4 -0.974 6.8-160.9-156.9 117.2 3.5 24.1 4.0 48 52 A K E S+ 0 0 26 -2,-0.3 -14,-0.2 -14,-0.2 -2,-0.0 -0.822 75.3 11.3 -92.1 136.9 1.3 27.2 4.1 49 53 A D E + 0 0 87 -2,-0.4 2,-0.5 1,-0.2 -15,-0.2 0.821 68.3 170.4 69.9 41.8 -2.5 27.1 3.8 50 54 A Q E -D 33 0A 23 -17,-2.0 -17,-2.0 -3,-0.3 -1,-0.2 -0.754 35.5-125.7 -78.7 116.9 -3.3 23.5 4.1 51 55 A E E +D 32 0A 122 -2,-0.5 2,-0.3 -19,-0.2 16,-0.3 -0.399 39.5 179.7 -57.4 134.2 -7.1 23.0 4.4 52 56 A A - 0 0 3 -21,-2.1 2,-0.7 14,-0.1 14,-0.2 -0.971 35.7-123.8-138.4 154.6 -7.8 21.0 7.5 53 57 A Y E -F 65 0A 95 12,-2.9 12,-1.7 -2,-0.3 2,-0.5 -0.906 38.1-173.7 -94.4 116.1 -10.8 19.5 9.4 54 58 A I E +F 64 0A 14 -2,-0.7 2,-0.3 -24,-0.5 10,-0.2 -0.940 9.0 164.5-119.8 128.1 -10.3 20.9 12.9 55 59 A V E -F 63 0A 17 8,-2.4 8,-2.7 -2,-0.5 2,-0.5 -0.939 37.3-118.6-140.4 160.2 -12.5 19.9 15.8 56 60 A R E +F 62 0A 38 -54,-1.3 6,-0.2 -2,-0.3 3,-0.1 -0.907 29.8 168.5 -95.5 126.0 -12.8 19.9 19.6 57 61 A V E + 0 0 0 4,-3.2 2,-0.3 -2,-0.5 5,-0.2 0.464 67.2 12.7-120.6 -8.1 -12.9 16.4 21.2 58 62 A G E > S-F 61 0A 6 3,-1.6 3,-1.2 -56,-0.1 2,-0.4 -0.962 99.2 -74.3-156.5 168.8 -12.5 17.4 24.7 59 63 A E T 3 S- 0 0 145 -2,-0.3 22,-0.3 1,-0.3 3,-0.1 -0.521 130.9 -5.1 -57.1 114.5 -12.5 20.3 27.0 60 64 A S T 3 S+ 0 0 29 -2,-0.4 20,-3.2 1,-0.1 21,-0.6 0.758 111.7 112.0 63.2 14.8 -9.0 21.5 25.6 61 65 A I E < -FG 58 79A 8 -3,-1.2 -4,-3.2 18,-0.2 -3,-1.6 -0.976 45.9-174.3-121.7 126.2 -8.3 18.4 23.3 62 66 A Y E -FG 56 78A 9 16,-3.0 16,-2.6 -2,-0.5 2,-0.4 -0.921 16.0-150.4-124.1 148.2 -8.4 19.1 19.6 63 67 A K E -FG 55 77A 0 -8,-2.7 -8,-2.4 -2,-0.4 2,-0.4 -0.920 9.7-173.1-111.9 133.4 -8.2 17.0 16.5 64 68 A I E +FG 54 76A 0 12,-2.2 12,-3.0 -2,-0.4 2,-0.3 -0.990 9.2 173.5-124.9 136.2 -6.8 18.2 13.1 65 69 A S E +FG 53 75A 0 -12,-1.7 -12,-2.9 -2,-0.4 2,-0.3 -0.951 5.6 152.1-137.1 145.8 -7.0 16.1 9.9 66 70 A W E - G 0 74A 9 8,-1.8 8,-2.2 -2,-0.3 2,-0.3 -0.988 34.1-121.8-166.1 163.1 -6.1 16.7 6.2 67 71 A T E - G 0 73A 38 -2,-0.3 6,-0.2 -16,-0.3 -16,-0.1 -0.894 26.1-139.4-112.7 140.7 -5.0 15.3 3.0 68 72 A E > - 0 0 14 4,-2.5 3,-1.4 -2,-0.3 -2,-0.0 -0.646 23.5-119.2 -96.9 158.2 -1.8 16.2 1.0 69 73 A P T 3 S+ 0 0 20 0, 0.0 48,-0.2 0, 0.0 -1,-0.1 0.731 115.7 63.0 -59.4 -26.3 -1.1 16.7 -2.7 70 74 A T T 3 S- 0 0 1 2,-0.1 25,-0.1 46,-0.1 40,-0.0 0.561 122.6-104.8 -70.3 -19.2 1.4 13.9 -2.3 71 75 A G S < S+ 0 0 7 -3,-1.4 2,-0.1 1,-0.3 43,-0.0 0.241 75.5 140.9 104.8 -11.9 -1.4 11.4 -1.3 72 76 A T - 0 0 1 19,-0.1 -4,-2.5 -5,-0.1 2,-0.4 -0.413 39.8-152.2 -65.5 138.9 -0.5 11.4 2.4 73 77 A D E -GH 67 90A 3 17,-2.2 17,-3.2 -6,-0.2 2,-0.3 -0.948 12.7-171.2-110.6 136.4 -3.2 11.4 5.1 74 78 A V E +GH 66 89A 6 -8,-2.2 -8,-1.8 -2,-0.4 2,-0.3 -0.953 11.4 177.2-126.1 139.1 -2.5 13.0 8.5 75 79 A S E -GH 65 88A 0 13,-2.2 13,-2.9 -2,-0.3 2,-0.3 -0.876 16.1-172.7-143.6 114.4 -4.7 12.9 11.8 76 80 A L E -GH 64 87A 2 -12,-3.0 -12,-2.2 -2,-0.3 2,-0.4 -0.855 16.7-153.4-114.5 146.2 -3.3 14.6 14.8 77 81 A I E -GH 63 86A 1 9,-3.2 9,-2.7 -2,-0.3 2,-0.5 -0.985 9.5-175.7-114.2 121.1 -4.3 14.9 18.5 78 82 A V E -GH 62 85A 0 -16,-2.6 -16,-3.0 -2,-0.4 2,-0.7 -0.980 4.0-170.1-117.1 114.1 -3.3 17.9 20.7 79 83 A N E > +GH 61 84A 1 5,-2.7 5,-1.2 -2,-0.5 -18,-0.2 -0.923 5.5 179.8 -99.5 106.4 -4.2 17.7 24.3 80 84 A L T > 5S+ 0 0 46 -20,-3.2 3,-0.9 -2,-0.7 -1,-0.2 0.952 77.2 52.4 -76.5 -41.2 -3.6 21.1 25.7 81 85 A G T 3 5S+ 0 0 56 -21,-0.6 -1,-0.1 -22,-0.3 -20,-0.1 0.895 122.9 27.8 -55.9 -50.8 -4.7 20.3 29.3 82 86 A D T 3 5S- 0 0 60 140,-0.2 -1,-0.3 -22,-0.2 -2,-0.2 0.178 103.1-126.3 -96.5 7.4 -2.5 17.2 29.7 83 87 A S T < 5 + 0 0 74 -3,-0.9 51,-0.6 1,-0.2 2,-0.5 0.878 58.9 144.9 52.0 45.2 0.2 18.3 27.3 84 88 A L E < -HI 79 133A 12 -5,-1.2 -5,-2.7 138,-0.2 2,-0.4 -0.927 31.3-164.5-122.5 135.3 0.0 15.1 25.3 85 89 A F E -HI 78 132A 1 47,-1.0 47,-2.3 -2,-0.5 2,-0.4 -0.979 6.0-177.2-122.1 133.1 0.5 15.0 21.6 86 90 A H E -HI 77 131A 0 -9,-2.7 -9,-3.2 -2,-0.4 2,-0.4 -0.981 3.9-172.5-128.3 129.7 -0.4 12.1 19.3 87 91 A G E -HI 76 130A 1 43,-3.9 43,-3.4 -2,-0.4 2,-0.4 -0.966 10.7-173.3-120.0 128.3 0.1 11.9 15.5 88 92 A T E -HI 75 129A 0 -13,-2.9 -13,-2.2 -2,-0.4 2,-0.5 -0.991 10.8-179.2-110.7 127.0 -1.0 9.3 12.8 89 93 A I E -HI 74 128A 9 39,-3.2 39,-3.9 -2,-0.4 2,-0.8 -0.990 14.2-160.7-122.7 118.5 0.5 9.8 9.3 90 94 A F E -HI 73 127A 2 -17,-3.2 -17,-2.2 -2,-0.5 37,-0.2 -0.892 19.0-170.7 -97.8 102.1 -0.5 7.4 6.5 91 95 A F E - 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