==== 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 OXIDOREDUCTASE 04-JUN-02 1LX6 . COMPND 2 MOLECULE: ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE [NADH]; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR W.W.SMITH,X.QIU,C.A.JANSON . 486 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19065.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 361 74.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 60 12.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 32 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 70 14.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 171 35.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.1 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 3 6 1 1 1 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 4 2 4 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 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 G > 0 0 61 0, 0.0 3,-1.4 0, 0.0 29,-0.1 0.000 360.0 360.0 360.0 169.9 32.0 24.1 139.6 2 3 A F T 3 + 0 0 69 1,-0.3 220,-0.5 219,-0.0 221,-0.2 0.572 360.0 50.6 -76.7 -2.2 30.0 27.0 140.9 3 4 A L T > S+ 0 0 0 27,-2.7 3,-2.5 24,-0.1 -1,-0.3 0.216 77.5 145.7-112.8 13.1 28.1 24.7 143.2 4 5 A S T < S+ 0 0 77 -3,-1.4 28,-0.2 26,-0.5 27,-0.1 -0.314 74.2 9.6 -56.9 118.7 31.3 23.1 144.6 5 6 A G T 3 S+ 0 0 64 26,-1.3 2,-0.3 1,-0.3 -1,-0.3 0.471 95.8 126.9 90.3 3.0 30.7 22.3 148.3 6 7 A K < - 0 0 15 -3,-2.5 27,-3.4 25,-0.3 2,-0.6 -0.732 48.3-151.6 -93.0 140.2 27.0 23.0 148.3 7 8 A R E -a 33 0A 71 -2,-0.3 78,-2.7 25,-0.2 2,-0.4 -0.976 23.0-179.7-112.2 115.1 24.7 20.3 149.6 8 9 A I E -a 34 0A 0 25,-2.9 27,-1.1 -2,-0.6 2,-0.4 -0.957 22.4-140.6-122.1 139.0 21.3 20.6 147.9 9 10 A L E -ab 35 87A 0 77,-2.2 79,-1.8 -2,-0.4 2,-0.5 -0.781 17.5-155.1 -95.1 136.5 18.2 18.6 148.3 10 11 A V E -ab 36 88A 0 25,-3.0 27,-1.4 -2,-0.4 3,-0.3 -0.946 10.3-174.0-122.9 119.7 16.3 17.8 145.2 11 12 A T + 0 0 4 77,-1.8 27,-0.1 -2,-0.5 24,-0.0 -0.527 59.0 36.7-100.2 159.2 12.6 17.0 145.2 12 13 A G + 0 0 26 1,-0.2 2,-1.1 -2,-0.2 8,-0.4 0.543 58.2 150.8 78.9 8.4 10.4 15.9 142.2 13 14 A V + 0 0 5 24,-0.5 -1,-0.2 -3,-0.3 3,-0.1 -0.661 8.9 148.0 -77.8 105.4 12.6 13.6 140.2 14 15 A A - 0 0 42 -2,-1.1 2,-0.3 1,-0.4 -1,-0.2 0.709 64.8 -8.9-107.5 -30.3 10.1 11.2 138.6 15 16 A S S > S- 0 0 40 -3,-0.2 3,-1.3 32,-0.0 -1,-0.4 -0.952 76.2 -89.4-156.5 176.7 11.8 10.4 135.3 16 17 A K T 3 S+ 0 0 93 -2,-0.3 6,-0.1 1,-0.3 -1,-0.0 0.772 125.8 54.6 -65.8 -26.5 14.7 11.3 133.1 17 18 A L T 3 S+ 0 0 143 4,-0.1 -1,-0.3 5,-0.0 192,-0.1 0.589 82.9 116.4 -83.1 -11.4 12.4 13.9 131.4 18 19 A S S X> S- 0 0 24 -3,-1.3 4,-1.9 1,-0.1 3,-1.0 -0.320 72.6-130.6 -59.8 138.6 11.6 15.5 134.8 19 20 A I H 3> S+ 0 0 43 1,-0.3 4,-1.6 2,-0.2 -1,-0.1 0.793 111.6 59.5 -59.8 -26.6 12.7 19.2 135.1 20 21 A A H 3> S+ 0 0 0 -8,-0.4 4,-2.8 2,-0.2 -1,-0.3 0.841 101.4 52.8 -71.8 -31.5 14.2 18.0 138.5 21 22 A Y H <> S+ 0 0 19 -3,-1.0 4,-2.8 -6,-0.3 -2,-0.2 0.965 110.4 46.8 -67.2 -49.3 16.4 15.5 136.6 22 23 A G H X S+ 0 0 2 -4,-1.9 4,-1.3 1,-0.2 -2,-0.2 0.821 114.5 49.2 -61.5 -29.6 17.7 18.2 134.3 23 24 A I H X S+ 0 0 0 -4,-1.6 4,-1.7 -5,-0.2 -2,-0.2 0.918 111.6 45.4 -76.5 -45.4 18.3 20.4 137.4 24 25 A A H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 5,-0.2 0.937 108.0 60.6 -62.9 -41.5 20.1 17.8 139.5 25 26 A Q H X S+ 0 0 66 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.898 110.2 40.6 -47.3 -50.8 22.2 16.9 136.4 26 27 A A H X S+ 0 0 3 -4,-1.3 4,-1.5 2,-0.2 -1,-0.2 0.743 112.2 51.9 -73.9 -32.8 23.5 20.5 136.3 27 28 A M H <>S+ 0 0 0 -4,-1.7 5,-3.2 -3,-0.2 -1,-0.2 0.841 111.9 50.6 -72.2 -32.6 24.0 21.0 140.0 28 29 A H H ><5S+ 0 0 76 -4,-2.8 3,-2.4 3,-0.2 -2,-0.2 0.944 107.7 50.6 -66.5 -51.8 26.0 17.8 139.9 29 30 A R H 3<5S+ 0 0 135 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.877 109.6 53.4 -54.3 -37.7 28.1 19.0 136.9 30 31 A E T 3<5S- 0 0 32 -4,-1.5 -27,-2.7 -29,-0.1 -26,-0.5 0.276 126.3-100.5 -86.2 14.4 28.8 22.1 138.9 31 32 A G T < 5 + 0 0 34 -3,-2.4 -26,-1.3 1,-0.2 -25,-0.3 0.666 69.2 148.2 81.0 19.1 30.0 20.2 141.9 32 33 A A < - 0 0 9 -5,-3.2 2,-0.6 -28,-0.2 -1,-0.2 -0.544 46.9-127.3 -82.7 153.5 27.0 20.2 144.2 33 34 A E E -a 7 0A 97 -27,-3.4 -25,-2.9 -30,-0.2 2,-0.2 -0.916 34.8-155.3 -99.6 123.4 26.3 17.3 146.5 34 35 A L E -a 8 0A 4 -2,-0.6 24,-0.4 20,-0.4 2,-0.3 -0.613 22.6-176.7-106.0 161.3 22.8 16.1 146.0 35 36 A A E -a 9 0A 0 -27,-1.1 -25,-3.0 -2,-0.2 2,-0.3 -0.957 16.9-153.1-145.2 147.2 20.1 14.2 148.0 36 37 A F E -ac 10 59A 0 22,-3.5 24,-2.7 -2,-0.3 2,-0.3 -0.937 6.5-155.4-128.9 153.6 16.7 13.2 146.6 37 38 A T E - c 0 60A 5 -27,-1.4 -24,-0.5 -2,-0.3 2,-0.4 -0.860 10.4-154.3-119.1 157.7 13.3 12.6 148.0 38 39 A Y E - c 0 61A 22 22,-1.9 24,-2.7 -2,-0.3 6,-0.1 -0.997 16.1-135.7-134.4 141.6 10.6 10.4 146.4 39 40 A Q S S- 0 0 108 -2,-0.4 2,-0.3 22,-0.2 -1,-0.1 0.908 77.5 -17.0 -61.3 -50.5 6.8 10.6 146.8 40 41 A N S > S- 0 0 67 21,-0.1 3,-1.0 22,-0.0 4,-0.4 -0.917 75.1 -83.9-147.4-179.4 6.1 6.9 147.3 41 42 A D G >> S+ 0 0 114 -2,-0.3 3,-0.8 1,-0.3 4,-0.5 0.740 112.3 74.8 -63.6 -27.3 7.4 3.3 146.8 42 43 A K G 34 S+ 0 0 182 1,-0.3 4,-0.3 2,-0.1 -1,-0.3 0.950 109.5 33.4 -48.2 -47.4 6.3 3.2 143.2 43 44 A L G <> S+ 0 0 28 -3,-1.0 4,-2.6 1,-0.1 5,-0.3 0.428 90.7 97.0 -93.5 -0.7 9.3 5.4 142.6 44 45 A K H <> S+ 0 0 80 -3,-0.8 4,-2.6 -4,-0.4 5,-0.2 0.964 86.1 43.9 -54.0 -67.2 11.8 4.3 145.2 45 46 A G H X S+ 0 0 33 -4,-0.5 4,-1.3 1,-0.2 -1,-0.2 0.806 116.9 49.1 -46.3 -37.9 14.0 2.0 143.1 46 47 A R H > S+ 0 0 102 -4,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.936 111.2 46.2 -68.9 -53.1 14.0 4.5 140.2 47 48 A V H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.862 109.3 57.2 -61.3 -33.7 15.0 7.5 142.2 48 49 A E H X S+ 0 0 84 -4,-2.6 4,-2.3 -5,-0.3 -1,-0.2 0.906 106.6 49.3 -65.0 -35.5 17.7 5.4 143.9 49 50 A E H X S+ 0 0 120 -4,-1.3 4,-1.9 -5,-0.2 -2,-0.2 0.922 111.3 48.5 -68.5 -42.6 19.1 4.7 140.4 50 51 A F H X S+ 0 0 14 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.942 112.7 48.8 -62.2 -46.9 19.1 8.4 139.4 51 52 A A H <>S+ 0 0 0 -4,-2.7 5,-2.4 1,-0.2 -2,-0.2 0.910 106.9 54.2 -60.4 -46.1 20.7 9.4 142.7 52 53 A A H ><5S+ 0 0 70 -4,-2.3 3,-1.4 1,-0.2 -1,-0.2 0.897 108.5 51.3 -53.0 -46.9 23.5 6.7 142.4 53 54 A Q H 3<5S+ 0 0 112 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.885 109.6 48.7 -57.2 -45.8 24.3 8.2 138.9 54 55 A L T 3<5S- 0 0 15 -4,-1.9 -20,-0.4 -5,-0.1 -1,-0.3 0.211 123.3-107.1 -83.9 17.5 24.5 11.7 140.3 55 56 A G T < 5S+ 0 0 65 -3,-1.4 2,-0.3 1,-0.2 -3,-0.2 0.483 77.5 122.4 73.9 6.9 26.8 10.4 143.1 56 57 A S < - 0 0 12 -5,-2.4 -1,-0.2 -6,-0.2 -21,-0.1 -0.709 43.3-169.4-102.3 163.1 24.4 10.6 146.1 57 58 A D + 0 0 157 -2,-0.3 2,-1.0 -23,-0.2 -1,-0.1 0.455 61.1 105.7-117.7 -13.5 23.2 7.9 148.5 58 59 A I + 0 0 19 -24,-0.4 -22,-3.5 -7,-0.1 2,-0.5 -0.619 33.7 154.4 -79.7 98.3 20.5 10.1 150.0 59 60 A V E +c 36 0A 23 -2,-1.0 2,-0.3 -24,-0.2 -22,-0.2 -0.892 17.7 177.2-128.7 98.6 17.1 8.9 148.8 60 61 A L E -c 37 0A 29 -24,-2.7 -22,-1.9 -2,-0.5 2,-0.3 -0.800 27.9-121.8-106.0 140.2 14.5 9.9 151.3 61 62 A Q E +c 38 0A 75 -2,-0.3 2,-0.3 -24,-0.3 -22,-0.2 -0.613 35.9 170.0 -80.7 143.2 10.7 9.3 151.1 62 63 A C - 0 0 7 -24,-2.7 2,-0.6 -2,-0.3 8,-0.1 -0.850 22.8-172.6-161.6 117.0 8.5 12.4 151.3 63 64 A D > - 0 0 51 -2,-0.3 3,-1.5 3,-0.2 7,-0.4 -0.962 16.3-155.2-108.4 114.1 4.9 13.0 150.7 64 65 A V T 3 S+ 0 0 7 -2,-0.6 -1,-0.1 1,-0.3 61,-0.1 0.427 86.4 71.9 -71.4 -2.9 4.3 16.8 151.0 65 66 A A T 3 S+ 0 0 34 1,-0.2 2,-0.6 56,-0.0 -1,-0.3 0.648 92.0 67.0 -82.9 -18.9 0.6 16.4 151.9 66 67 A E X> - 0 0 111 -3,-1.5 4,-2.2 1,-0.2 3,-0.9 -0.892 64.6-161.5-109.8 110.7 1.7 15.1 155.4 67 68 A D H 3> S+ 0 0 74 -2,-0.6 4,-2.4 1,-0.3 -1,-0.2 0.917 97.4 52.4 -49.8 -48.8 3.4 17.5 157.7 68 69 A A H 3> S+ 0 0 61 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.769 105.4 54.0 -58.2 -34.9 4.7 14.4 159.7 69 70 A S H <> S+ 0 0 20 -3,-0.9 4,-2.3 -6,-0.3 -1,-0.2 0.959 109.0 48.2 -65.8 -50.3 6.1 12.9 156.5 70 71 A I H X S+ 0 0 1 -4,-2.2 4,-1.8 -7,-0.4 -2,-0.2 0.907 112.2 50.3 -57.6 -41.6 8.1 16.1 155.8 71 72 A D H X S+ 0 0 102 -4,-2.4 4,-0.9 -5,-0.2 -1,-0.2 0.950 109.2 50.8 -61.2 -48.4 9.3 16.1 159.4 72 73 A T H >X S+ 0 0 81 -4,-2.4 4,-2.1 1,-0.2 3,-1.1 0.905 107.7 51.7 -56.9 -47.2 10.4 12.5 159.2 73 74 A M H 3X S+ 0 0 4 -4,-2.3 4,-2.8 1,-0.3 -1,-0.2 0.875 107.6 53.1 -62.0 -35.4 12.4 13.0 156.0 74 75 A F H 3X S+ 0 0 10 -4,-1.8 4,-1.1 -5,-0.2 -1,-0.3 0.688 106.4 53.9 -77.9 -10.0 14.2 16.0 157.5 75 76 A A H X S+ 0 0 86 -4,-2.1 3,-1.5 2,-0.2 4,-0.7 0.960 115.2 50.4 -63.1 -47.7 16.7 11.1 158.3 77 78 A L H >X S+ 0 0 0 -4,-2.8 4,-3.5 1,-0.3 3,-1.7 0.914 104.4 60.5 -55.9 -42.5 18.4 13.7 156.1 78 79 A G H 3< S+ 0 0 20 -4,-1.1 -1,-0.3 1,-0.3 -2,-0.2 0.753 91.3 67.1 -57.0 -29.7 19.7 15.3 159.2 79 80 A K H << S+ 0 0 150 -3,-1.5 -1,-0.3 -4,-0.9 -2,-0.2 0.782 119.6 20.9 -62.7 -28.8 21.6 12.1 160.1 80 81 A V H << S+ 0 0 70 -3,-1.7 -2,-0.2 -4,-0.7 -1,-0.2 0.748 134.3 38.8-107.3 -35.7 23.9 12.7 157.1 81 82 A W < + 0 0 2 -4,-3.5 -1,-0.2 -5,-0.2 -2,-0.1 -0.794 56.4 170.6-119.8 84.8 23.4 16.4 156.5 82 83 A P S S+ 0 0 89 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.816 84.2 16.5 -60.1 -31.1 23.2 18.2 159.9 83 84 A K S S+ 0 0 96 -3,-0.1 2,-0.3 -5,-0.0 51,-0.2 -0.963 76.0 167.9-139.5 146.8 23.3 21.4 157.8 84 85 A F B -g 134 0B 0 49,-1.2 51,-2.5 -2,-0.3 -76,-0.2 -0.851 37.1-114.2-148.0-176.3 22.8 21.9 154.1 85 86 A D - 0 0 16 -78,-2.7 54,-2.3 1,-0.4 2,-0.2 0.210 68.2 -59.4-119.8 21.5 22.3 24.8 151.7 86 87 A G - 0 0 0 52,-0.3 -77,-2.2 -79,-0.2 -1,-0.4 -0.726 45.5-112.8 131.5 177.3 18.8 24.6 150.3 87 88 A F E -b 9 0A 0 52,-0.4 54,-1.6 -79,-0.2 2,-0.5 -0.896 18.5-119.3-142.6 169.6 16.4 22.5 148.3 88 89 A V E -bd 10 141A 0 -79,-1.8 -77,-1.8 -2,-0.3 2,-0.9 -0.964 19.4-152.5-118.4 112.5 14.7 22.4 144.9 89 90 A H E + d 0 142A 0 52,-3.8 54,-0.7 -2,-0.5 -77,-0.1 -0.783 31.0 155.2 -86.0 110.2 10.9 22.4 145.1 90 91 A S + 0 0 27 -2,-0.9 2,-0.4 52,-0.2 -70,-0.2 -0.323 31.6 118.5-132.9 52.4 9.8 20.7 141.9 91 92 A I + 0 0 31 28,-0.1 2,-0.3 27,-0.1 52,-0.2 -0.923 27.8 156.6-118.5 139.7 6.3 19.4 143.0 92 93 A G + 0 0 45 -2,-0.4 2,-0.3 2,-0.0 24,-0.1 -0.966 8.7 162.4-160.3 150.5 3.0 20.4 141.5 93 94 A F + 0 0 107 22,-0.3 26,-0.4 -2,-0.3 25,-0.1 -0.936 15.6 164.9-174.5 152.4 -0.5 18.8 141.3 94 95 A A - 0 0 11 -2,-0.3 2,-0.2 24,-0.1 18,-0.1 -0.936 50.9 -89.8-165.1 144.0 -4.2 19.1 140.8 95 96 A P >> - 0 0 27 0, 0.0 3,-1.8 0, 0.0 4,-0.5 -0.534 43.6-120.3 -62.2 134.2 -6.9 16.4 140.2 96 97 A G G >4 S+ 0 0 56 1,-0.3 3,-1.0 -2,-0.2 4,-0.0 0.725 108.1 62.0 -44.9 -43.9 -7.1 15.8 136.4 97 98 A D G >4 S+ 0 0 111 1,-0.2 3,-1.1 2,-0.2 -1,-0.3 0.828 97.8 64.2 -54.7 -30.8 -10.8 16.8 135.9 98 99 A Q G <4 S+ 0 0 1 -3,-1.8 59,-0.4 1,-0.2 -1,-0.2 0.848 96.0 57.9 -61.6 -38.0 -9.7 20.2 137.1 99 100 A L G << S+ 0 0 48 -3,-1.0 2,-0.4 -4,-0.5 -1,-0.2 0.108 91.8 71.1 -89.5 22.0 -7.4 20.7 134.1 100 101 A D S < S- 0 0 121 -3,-1.1 2,-0.1 2,-0.1 55,-0.0 -0.995 88.3 -7.0-141.7 132.3 -9.6 20.4 131.1 101 102 A G S S+ 0 0 39 -2,-0.4 53,-0.4 4,-0.0 55,-0.2 -0.279 105.9 4.4 88.4-173.7 -12.3 22.7 129.8 102 103 A D > - 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