==== 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 3NX2 . 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 . 326 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13403.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 238 73.0 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 . 120 36.8 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 2.5 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 . 37 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 25 7.7 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 0 2 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 2 4 3 6 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 0 131 0, 0.0 3,-1.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 108.5 -18.5 23.8 23.1 2 6 A K T 3 + 0 0 70 1,-0.3 54,-1.1 55,-0.1 56,-0.1 0.647 360.0 53.8 -68.0 -16.9 -17.1 21.2 20.6 3 7 A H T 3 S+ 0 0 121 52,-0.1 2,-0.7 2,-0.0 -1,-0.3 0.544 85.0 97.3 -91.8 -12.0 -17.5 23.7 17.8 4 8 A D < + 0 0 67 -3,-1.3 3,-0.3 1,-0.1 51,-0.0 -0.726 42.1 173.8 -82.8 111.6 -15.5 26.5 19.5 5 9 A L >> + 0 0 23 -2,-0.7 4,-2.9 1,-0.2 3,-1.9 0.199 43.7 115.5-106.5 13.0 -11.9 26.6 18.3 6 10 A S T 34 S+ 0 0 91 1,-0.3 -1,-0.2 2,-0.2 -2,-0.0 0.752 74.4 53.2 -40.5 -44.0 -10.9 29.8 20.1 7 11 A G T 34 S+ 0 0 33 -3,-0.3 -1,-0.3 1,-0.1 -2,-0.1 0.466 120.1 32.1 -79.8 -3.2 -8.5 28.0 22.3 8 12 A F T X4 S+ 0 0 0 -3,-1.9 3,-2.4 3,-0.1 19,-0.3 0.739 88.1 93.2-124.9 -50.3 -6.7 26.5 19.3 9 13 A V T 3< S+ 0 0 34 -4,-2.9 19,-0.2 1,-0.3 132,-0.2 -0.318 95.9 28.3 -49.9 130.1 -6.7 28.9 16.3 10 14 A G T 3 S+ 0 0 0 17,-3.3 130,-2.9 1,-0.3 131,-0.3 0.288 88.5 144.4 93.3 -7.6 -3.6 30.9 16.5 11 15 A K E < -A 139 0A 27 -3,-2.4 16,-2.6 128,-0.2 2,-0.5 -0.402 34.5-163.5 -70.2 135.0 -1.6 28.2 18.3 12 16 A H E -AB 138 26A 9 126,-2.3 126,-1.7 14,-0.2 2,-0.5 -0.974 18.3-171.2-119.9 113.0 2.1 27.8 17.5 13 17 A L E -AB 137 25A 2 12,-2.8 12,-1.7 -2,-0.5 2,-0.6 -0.903 20.4-165.1-113.9 126.1 3.3 24.4 18.7 14 18 A V E -AB 136 24A 1 122,-3.4 121,-2.4 -2,-0.5 122,-1.6 -0.948 19.4-177.0-100.5 125.7 6.7 22.9 19.0 15 19 A Y E -AB 134 23A 16 8,-2.6 8,-2.6 -2,-0.6 2,-0.4 -0.966 9.3-158.0-125.9 155.5 6.5 19.2 19.6 16 20 A T E -AB 133 22A 22 117,-2.6 117,-2.6 -2,-0.4 6,-0.2 -0.984 8.9-140.4-140.7 114.6 9.4 16.8 20.1 17 21 A Y > - 0 0 22 4,-1.8 3,-2.2 -2,-0.4 115,-0.2 -0.219 39.8 -96.7 -70.3 170.6 9.5 13.0 19.6 18 22 A D T 3 S+ 0 0 139 113,-0.4 -1,-0.1 1,-0.3 114,-0.1 0.761 125.5 59.9 -67.4 -25.2 11.4 10.7 22.1 19 23 A N T 3 S- 0 0 88 2,-0.1 -1,-0.3 1,-0.0 -2,-0.1 0.298 120.9-108.9 -79.4 6.5 14.4 10.8 19.8 20 24 A G < + 0 0 42 -3,-2.2 2,-0.2 1,-0.2 -2,-0.1 0.422 66.6 147.0 80.0 1.8 14.6 14.7 20.2 21 25 A W - 0 0 99 1,-0.0 -4,-1.8 -5,-0.0 2,-0.3 -0.539 40.2-136.3 -74.7 138.1 13.4 15.8 16.8 22 26 A N E -B 16 0A 34 -2,-0.2 16,-1.3 -6,-0.2 17,-0.5 -0.694 21.9-178.0 -96.5 138.8 11.4 19.1 16.7 23 27 A Y E -BC 15 37A 34 -8,-2.6 -8,-2.6 -2,-0.3 2,-0.4 -0.954 10.9-148.0-130.0 153.0 8.3 19.6 14.7 24 28 A E E -BC 14 36A 1 12,-2.3 12,-1.9 -2,-0.3 2,-0.4 -0.984 13.2-179.4-127.5 136.7 6.1 22.7 14.3 25 29 A I E -BC 13 35A 2 -12,-1.7 -12,-2.8 -2,-0.4 2,-0.5 -0.994 6.4-168.6-121.6 131.6 2.3 23.3 13.6 26 30 A Y E -BC 12 34A 0 8,-2.9 8,-2.1 -2,-0.4 2,-1.2 -0.975 16.9-145.3-113.6 119.1 0.9 26.8 13.3 27 31 A V E - C 0 33A 0 -16,-2.6 -17,-3.3 -2,-0.5 6,-0.2 -0.699 22.2-179.4 -84.6 95.6 -3.0 26.7 13.4 28 32 A K E - 0 0 1 -2,-1.2 115,-2.3 4,-0.9 2,-0.2 0.889 57.6 -29.3 -69.8 -43.1 -3.6 29.6 11.0 29 33 A N E > S- C 0 32A 32 3,-1.6 3,-0.9 113,-0.2 -19,-0.1 -0.833 85.2 -63.9-157.5-165.2 -7.4 29.6 11.1 30 34 A D T 3 S+ 0 0 96 -2,-0.2 24,-0.6 1,-0.2 3,-0.0 0.669 132.5 18.9 -73.4 -11.2 -10.3 27.3 11.6 31 35 A N T 3 S+ 0 0 80 22,-0.1 21,-1.7 1,-0.1 2,-0.3 0.107 112.9 74.7-139.1 30.1 -9.5 25.2 8.5 32 36 A T E < -CD 29 51A 18 -3,-0.9 -3,-1.6 19,-0.2 -4,-0.9 -1.000 48.1-177.2-145.3 138.4 -5.8 26.0 7.6 33 37 A I E -CD 27 50A 0 17,-2.4 17,-3.0 -2,-0.3 2,-0.4 -0.973 14.9-153.8-132.3 156.2 -2.4 25.0 9.0 34 38 A D E -C 26 0A 0 -8,-2.1 -8,-2.9 -2,-0.3 2,-0.3 -0.924 23.1-176.0-110.6 147.4 1.2 25.7 8.3 35 39 A Y E -CD 25 47A 18 12,-2.7 12,-2.6 -2,-0.4 2,-0.4 -0.981 14.5-164.8-143.5 163.2 3.8 23.2 9.3 36 40 A R E -CD 24 46A 8 -12,-1.9 -12,-2.3 -2,-0.3 2,-0.4 -0.969 6.7-156.5-150.9 124.6 7.5 22.7 9.4 37 41 A I E -C 23 0A 15 8,-2.9 7,-1.7 -2,-0.4 115,-0.4 -0.875 8.2-177.3-104.6 132.2 9.7 19.6 9.8 38 42 A H + 0 0 36 -16,-1.3 2,-0.2 -2,-0.4 -1,-0.1 0.881 58.3 17.6 -91.9 -45.6 13.3 20.0 11.1 39 43 A S S S+ 0 0 44 -17,-0.5 3,-0.4 4,-0.2 2,-0.1 -0.660 83.2 42.5-133.8 168.2 14.9 16.5 11.1 40 44 A G S > S- 0 0 37 -2,-0.2 3,-1.6 1,-0.2 -3,-0.0 -0.372 102.2 -29.7 93.1-163.7 14.7 12.9 9.8 41 45 A L T 3 S+ 0 0 137 1,-0.3 -1,-0.2 -2,-0.1 62,-0.1 0.765 145.7 33.3 -69.5 -22.5 14.0 11.5 6.4 42 46 A V T > S+ 0 0 22 -3,-0.4 3,-1.9 60,-0.1 -1,-0.3 0.051 88.4 153.3-117.1 25.0 11.7 14.4 5.5 43 47 A G T < + 0 0 17 -3,-1.6 -5,-0.2 1,-0.2 -4,-0.2 -0.227 63.1 23.8 -56.7 139.1 13.7 17.0 7.4 44 48 A N T 3 S+ 0 0 47 -7,-1.7 -1,-0.2 1,-0.4 108,-0.2 0.219 86.1 133.5 82.4 -9.4 13.4 20.5 6.1 45 49 A R < + 0 0 7 -3,-1.9 -8,-2.9 58,-0.1 -1,-0.4 -0.449 31.4 173.6 -60.5 134.5 10.1 19.9 4.4 46 50 A W E -De 36 105A 26 58,-2.1 60,-2.0 -10,-0.2 2,-0.3 -0.990 15.3-164.4-145.8 164.5 7.7 22.7 5.2 47 51 A V E -D 35 0A 2 -12,-2.6 -12,-2.7 -2,-0.3 2,-0.3 -0.999 3.3-162.6-151.6 135.5 4.2 23.7 4.1 48 52 A K E S+ 0 0 26 -2,-0.3 -14,-0.2 -14,-0.2 97,-0.0 -0.893 71.6 15.6-117.6 149.8 1.9 26.8 4.2 49 53 A D E S+ 0 0 86 -2,-0.3 2,-0.6 1,-0.2 -15,-0.2 0.861 70.4 173.9 63.4 41.8 -1.9 27.1 3.8 50 54 A Q E -D 33 0A 25 -17,-3.0 -17,-2.4 -3,-0.2 2,-0.2 -0.767 30.6-132.5 -83.6 116.5 -2.8 23.4 4.1 51 55 A E E +D 32 0A 143 -2,-0.6 16,-0.3 -19,-0.2 2,-0.3 -0.533 40.6 169.4 -64.5 132.7 -6.6 23.0 4.2 52 56 A A - 0 0 4 -21,-1.7 2,-0.6 -2,-0.2 14,-0.2 -0.906 42.7-113.3-146.2 162.5 -7.4 20.8 7.1 53 57 A Y E -F 65 0A 93 12,-3.4 12,-2.0 -2,-0.3 2,-0.5 -0.963 38.2-173.6-104.8 113.6 -10.3 19.5 9.2 54 58 A I E +F 64 0A 12 -2,-0.6 2,-0.3 -24,-0.6 10,-0.2 -0.960 9.9 165.7-116.4 115.4 -9.8 21.0 12.6 55 59 A V E -F 63 0A 18 8,-2.2 8,-2.5 -2,-0.5 2,-0.5 -0.860 35.5-121.4-124.1 162.1 -12.2 19.9 15.4 56 60 A R E +F 62 0A 32 -54,-1.1 6,-0.2 -2,-0.3 3,-0.1 -0.922 29.1 169.9-102.2 124.9 -12.3 20.0 19.2 57 61 A V E + 0 0 0 4,-2.5 2,-0.3 -2,-0.5 5,-0.2 0.470 63.6 7.3-117.0 -0.3 -12.5 16.7 20.9 58 62 A G E > S-F 61 0A 8 3,-1.5 3,-0.8 1,-0.1 -1,-0.1 -0.930 96.5 -71.6-163.3 179.7 -12.0 17.5 24.6 59 63 A E T 3 S- 0 0 144 1,-0.3 -1,-0.1 -2,-0.3 20,-0.0 0.915 130.5 -1.5 -51.1 -51.0 -11.7 20.5 26.9 60 64 A S T 3 S+ 0 0 39 -3,-0.1 20,-3.1 2,-0.0 21,-0.7 -0.187 111.3 108.4-133.6 41.9 -8.2 21.4 25.6 61 65 A I E < -FG 58 79A 11 -3,-0.8 -4,-2.5 18,-0.3 -3,-1.5 -0.987 44.0-177.5-124.0 125.4 -7.7 18.5 23.1 62 66 A Y E -FG 56 78A 5 16,-3.0 16,-3.2 -2,-0.5 2,-0.4 -0.858 14.5-150.1-122.5 156.3 -7.9 19.2 19.4 63 67 A K E -FG 55 77A 1 -8,-2.5 -8,-2.2 -2,-0.3 2,-0.4 -0.969 8.4-173.1-128.8 139.1 -7.7 17.1 16.1 64 68 A I E +FG 54 76A 0 12,-1.7 12,-2.4 -2,-0.4 2,-0.4 -0.996 9.4 174.3-134.2 125.7 -6.4 18.1 12.7 65 69 A S E +FG 53 75A 0 -12,-2.0 -12,-3.4 -2,-0.4 2,-0.3 -0.988 7.6 149.9-131.9 145.2 -6.7 15.9 9.7 66 70 A W E - G 0 74A 7 8,-1.8 8,-2.6 -2,-0.4 2,-0.4 -0.977 37.0-118.2-162.1 171.1 -5.8 16.5 6.0 67 71 A T E - G 0 73A 41 -16,-0.3 6,-0.2 -2,-0.3 -16,-0.1 -0.954 28.5-142.8-119.9 141.0 -4.7 15.0 2.7 68 72 A E > - 0 0 12 4,-2.8 3,-2.2 -2,-0.4 -18,-0.0 -0.632 23.9-115.1-106.4 155.8 -1.5 16.1 1.0 69 73 A P T 3 S+ 0 0 19 0, 0.0 48,-0.2 0, 0.0 -1,-0.1 0.707 114.6 63.7 -64.6 -15.5 -0.7 16.6 -2.7 70 74 A T T 3 S- 0 0 1 2,-0.1 25,-0.1 47,-0.1 3,-0.1 0.565 123.0-102.8 -76.6 -13.1 1.8 13.6 -2.4 71 75 A G S < S+ 0 0 7 -3,-2.2 2,-0.1 1,-0.3 43,-0.0 0.163 78.5 138.6 102.2 -16.2 -1.1 11.2 -1.6 72 76 A T - 0 0 2 19,-0.1 -4,-2.8 -5,-0.1 2,-0.4 -0.339 40.5-152.0 -59.1 137.4 -0.2 11.2 2.1 73 77 A D E -GH 67 90A 5 17,-1.8 17,-3.2 -6,-0.2 2,-0.4 -0.924 11.8-166.7-112.2 140.1 -3.0 11.3 4.8 74 78 A V E +GH 66 89A 7 -8,-2.6 -8,-1.8 -2,-0.4 2,-0.3 -0.975 15.2 173.2-128.5 139.3 -2.5 12.8 8.2 75 79 A S E +GH 65 88A 0 13,-2.6 13,-2.8 -2,-0.4 2,-0.3 -0.897 16.7 175.7-146.6 121.1 -4.5 12.8 11.5 76 80 A L E -GH 64 87A 5 -12,-2.4 -12,-1.7 -2,-0.3 2,-0.4 -0.877 22.6-144.3-126.0 154.5 -3.1 14.3 14.7 77 81 A I E -GH 63 86A 1 9,-3.0 9,-2.3 -2,-0.3 2,-0.6 -0.978 6.9-167.2-118.9 126.3 -4.1 15.0 18.2 78 82 A V E -GH 62 85A 1 -16,-3.2 -16,-3.0 -2,-0.4 2,-0.8 -0.944 5.6-176.6-111.7 105.8 -3.0 18.0 20.1 79 83 A N E > +GH 61 84A 1 5,-2.8 5,-2.1 -2,-0.6 -18,-0.3 -0.886 2.6 179.6-101.9 101.9 -3.8 17.6 23.9 80 84 A L T > 5S+ 0 0 35 -20,-3.1 3,-1.1 -2,-0.8 -1,-0.2 0.905 74.8 55.0 -78.9 -39.3 -2.7 20.9 25.3 81 85 A G T 3 5S+ 0 0 53 -21,-0.7 -1,-0.2 1,-0.3 -20,-0.1 0.822 117.2 35.4 -60.5 -35.7 -3.6 20.2 29.0 82 86 A D T 3 5S- 0 0 66 -22,-0.2 -1,-0.3 2,-0.2 -2,-0.2 0.272 104.5-124.8-101.2 8.6 -1.5 17.1 29.1 83 87 A S T < 5 + 0 0 62 -3,-1.1 51,-2.3 -4,-0.2 2,-0.4 0.816 64.1 143.9 48.6 40.5 1.3 18.4 26.8 84 88 A L E < -HI 79 133A 15 -5,-2.1 -5,-2.8 49,-0.2 2,-0.4 -0.918 33.4-171.1-120.8 127.8 0.7 15.3 24.6 85 89 A F E -HI 78 132A 2 47,-3.0 47,-2.3 -2,-0.4 2,-0.4 -0.900 3.6-176.6-111.0 144.4 0.9 15.0 20.8 86 90 A H E -HI 77 131A 0 -9,-2.3 -9,-3.0 -2,-0.4 2,-0.4 -0.958 5.6-172.2-142.0 131.1 -0.1 12.0 18.8 87 91 A G E -HI 76 130A 3 43,-2.6 43,-2.7 -2,-0.4 2,-0.5 -0.960 14.2-168.8-128.0 135.9 0.2 11.6 15.1 88 92 A T E -HI 75 129A 0 -13,-2.8 -13,-2.6 -2,-0.4 2,-0.5 -0.978 11.4-174.9-117.3 125.8 -0.9 9.2 12.5 89 93 A I E -HI 74 128A 40 39,-2.6 39,-3.2 -2,-0.5 2,-0.7 -0.986 14.6-158.8-120.8 128.5 0.5 9.4 9.0 90 94 A F E -HI 73 127A 2 -17,-3.2 -17,-1.8 -2,-0.5 37,-0.2 -0.844 22.6-167.9-103.8 91.9 -0.6 7.2 6.1 91 95 A F E - 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