==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 22-FEB-10 3LVK . COMPND 2 MOLECULE: CYSTEINE DESULFURASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR R.SHI,A.PROTEAU,A.MATTE,M.CYGLER,MONTREAL-KINGSTON BACTERIAL . 464 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20110.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 324 69.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 31 6.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 43 9.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 1 0.2 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 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 150 32.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.2 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 3 2 0 1 0 2 0 1 0 1 0 0 0 0 2 0 0 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 1 1 2 1 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 PARALLEL BRIDGES PER LADDER . 4 0 0 3 2 1 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 . 1 0 1 1 0 1 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 1 A M 0 0 107 0, 0.0 2,-0.1 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0 115.6 19.5 3.7 42.4 2 2 A K - 0 0 78 2,-0.1 0, 0.0 1,-0.0 0, 0.0 -0.265 360.0 -94.0 -87.2 165.3 16.6 1.8 43.8 3 3 A L S S+ 0 0 79 2,-0.1 2,-0.2 -2,-0.1 317,-0.1 -0.992 93.6 44.6-136.1 140.7 16.3 -1.3 46.1 4 4 A P S S- 0 0 87 0, 0.0 2,-0.6 0, 0.0 316,-0.2 0.461 81.5-140.6 -60.7 165.5 15.9 -4.2 45.9 5 5 A I E -a 320 0A 1 314,-1.7 316,-2.9 -2,-0.2 2,-0.5 -0.940 18.5-126.4-100.7 117.8 18.5 -4.6 43.1 6 6 A Y E +a 321 0A 81 -2,-0.6 316,-0.1 314,-0.2 3,-0.1 -0.509 45.4 154.2 -71.3 115.2 17.2 -7.1 40.6 7 7 A L + 0 0 0 314,-2.7 346,-2.3 -2,-0.5 316,-0.2 -0.260 50.8 89.5-129.5 43.4 19.8 -9.9 40.0 8 8 A D B >> +b 353 0B 24 344,-0.2 3,-2.5 314,-0.1 4,-1.5 -0.068 34.1 138.7-135.2 29.2 17.4 -12.6 39.0 9 9 A Y T 34 S+ 0 0 13 344,-1.3 345,-0.1 1,-0.3 -1,-0.1 0.655 72.6 62.9 -49.5 -17.3 17.2 -12.1 35.2 10 10 A S T 34 S+ 0 0 2 1,-0.1 -1,-0.3 289,-0.1 3,-0.1 0.708 98.7 51.9 -87.5 -21.8 17.3 -15.9 35.0 11 11 A A T <4 S- 0 0 43 -3,-2.5 2,-0.3 1,-0.4 -2,-0.2 0.930 137.2 -43.3 -68.6 -51.7 14.0 -16.3 36.9 12 12 A T < - 0 0 27 -4,-1.5 -1,-0.4 194,-0.1 194,-0.2 -0.934 57.0-132.0-171.8 158.0 12.4 -13.9 34.5 13 13 A T - 0 0 7 192,-2.3 2,-0.2 -2,-0.3 194,-0.1 -0.752 29.1-101.5-115.3 164.0 13.3 -10.6 32.8 14 14 A P - 0 0 59 0, 0.0 2,-0.3 0, 0.0 -2,-0.0 -0.610 44.9-101.4 -80.3 149.4 11.3 -7.4 32.4 15 15 A V - 0 0 55 -2,-0.2 194,-0.2 1,-0.1 193,-0.1 -0.566 38.6-110.0 -76.3 128.7 9.6 -6.7 29.0 16 16 A D > - 0 0 11 192,-2.0 4,-3.2 -2,-0.3 5,-0.3 -0.249 16.9-129.3 -53.2 134.8 11.4 -4.2 26.8 17 17 A P H > S+ 0 0 90 0, 0.0 4,-1.2 0, 0.0 -1,-0.1 0.839 114.3 52.4 -55.5 -30.9 9.6 -0.9 26.3 18 18 A R H > S+ 0 0 77 2,-0.2 4,-1.4 1,-0.1 5,-0.1 0.887 111.3 45.5 -70.9 -40.2 10.1 -1.5 22.6 19 19 A V H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 3,-0.5 0.977 112.0 49.6 -66.4 -53.1 8.6 -5.0 22.9 20 20 A A H < S+ 0 0 44 -4,-3.2 4,-0.3 1,-0.2 -1,-0.2 0.795 107.1 57.3 -56.7 -30.4 5.6 -3.9 25.0 21 21 A E H >X S+ 0 0 92 -4,-1.2 3,-1.1 -5,-0.3 4,-0.6 0.908 105.8 47.8 -71.7 -41.5 4.8 -1.1 22.6 22 22 A K H >< S+ 0 0 66 -4,-1.4 3,-1.7 -3,-0.5 4,-0.2 0.925 105.8 60.3 -58.9 -44.9 4.5 -3.4 19.6 23 23 A M T 3< S+ 0 0 26 -4,-2.1 3,-0.4 1,-0.3 -1,-0.2 0.591 96.9 62.0 -62.7 -9.8 2.3 -5.7 21.7 24 24 A M T X> S+ 0 0 114 -3,-1.1 3,-0.8 -4,-0.3 4,-0.5 0.749 91.1 64.6 -85.5 -25.0 -0.1 -2.7 22.1 25 25 A Q T << S+ 0 0 98 -3,-1.7 7,-2.2 -4,-0.6 -1,-0.2 0.442 101.9 52.4 -77.5 1.1 -0.8 -2.5 18.4 26 26 A F T 34 S+ 0 0 30 -3,-0.4 221,-0.5 5,-0.2 -1,-0.3 -0.138 97.8 62.8-130.9 39.9 -2.4 -6.0 18.5 27 27 A M T <4 S+ 0 0 80 -3,-0.8 -2,-0.1 1,-0.1 -3,-0.1 0.713 80.7 53.8-127.0 -64.7 -5.0 -5.8 21.3 28 28 A T S >< S- 0 0 81 -4,-0.5 3,-2.7 1,-0.1 5,-0.3 -0.160 90.1 -87.0 -90.5 175.4 -8.0 -3.4 21.1 29 29 A M T 3 S+ 0 0 153 1,-0.3 4,-0.2 3,-0.1 5,-0.1 0.801 127.6 47.8 -50.9 -33.2 -10.8 -2.8 18.6 30 30 A D T 3 S+ 0 0 145 2,-0.1 -1,-0.3 3,-0.0 2,-0.1 0.437 107.0 67.6 -93.3 0.5 -8.6 -0.3 16.7 31 31 A G S < S- 0 0 22 -3,-2.7 2,-1.4 -7,-0.0 -5,-0.2 -0.294 108.5 -76.3 -99.3-167.7 -5.6 -2.5 16.6 32 32 A T + 0 0 37 -7,-2.2 -3,-0.1 1,-0.2 215,-0.1 -0.600 69.9 145.9 -91.7 74.2 -5.0 -5.8 14.8 33 33 A F + 0 0 87 -2,-1.4 -1,-0.2 -5,-0.3 213,-0.1 0.536 28.2 123.7 -88.7 -9.4 -7.1 -7.9 17.2 34 34 A G S S- 0 0 9 -3,-0.2 212,-0.2 9,-0.2 -2,-0.0 -0.009 70.8-103.0 -57.3 156.0 -8.4 -10.4 14.5 35 35 A N > - 0 0 58 1,-0.1 3,-2.6 210,-0.1 13,-0.1 -0.726 21.0-145.5 -83.5 117.2 -8.0 -14.1 14.7 36 36 A P T 3 S+ 0 0 7 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.409 98.0 64.3 -64.5 4.4 -5.2 -15.2 12.2 37 37 A A T 3 S+ 0 0 54 207,-0.1 2,-0.7 198,-0.0 8,-0.1 0.467 80.3 89.1-105.5 -6.6 -7.2 -18.3 11.7 38 38 A S < + 0 0 32 -3,-2.6 3,-0.3 1,-0.1 7,-0.2 -0.826 48.1 170.6 -88.5 112.4 -10.2 -16.5 10.1 39 39 A R + 0 0 87 -2,-0.7 -1,-0.1 1,-0.2 406,-0.1 0.266 58.1 81.1-109.5 17.0 -9.5 -16.2 6.4 40 40 A S S S+ 0 0 105 1,-0.0 2,-0.3 5,-0.0 -1,-0.2 0.502 98.3 33.8 -95.6 -4.5 -12.9 -14.9 5.1 41 41 A H S > S- 0 0 75 -3,-0.3 4,-1.4 1,-0.1 3,-0.3 -0.938 85.0-104.3-145.4 170.4 -12.0 -11.3 6.0 42 42 A R H > S+ 0 0 115 -2,-0.3 4,-2.2 1,-0.2 5,-0.3 0.832 108.2 68.0 -63.5 -37.9 -9.2 -8.8 6.3 43 43 A F H > S+ 0 0 78 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.928 105.6 40.7 -47.7 -55.3 -9.0 -8.9 10.1 44 44 A G H > S+ 0 0 0 -3,-0.3 4,-2.7 1,-0.2 -1,-0.2 0.929 111.9 54.8 -61.4 -49.5 -7.6 -12.5 10.1 45 45 A W H X S+ 0 0 5 -4,-1.4 4,-1.3 1,-0.2 -1,-0.2 0.876 110.1 43.9 -57.0 -46.0 -5.3 -12.1 7.1 46 46 A Q H X S+ 0 0 68 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.827 111.9 54.5 -70.8 -32.1 -3.3 -9.1 8.4 47 47 A A H X S+ 0 0 0 -4,-1.4 4,-2.3 -5,-0.3 -2,-0.2 0.946 105.9 52.3 -61.7 -48.2 -3.1 -10.8 11.9 48 48 A E H X S+ 0 0 46 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.832 105.9 55.6 -58.4 -31.4 -1.6 -13.8 10.2 49 49 A E H X S+ 0 0 44 -4,-1.3 4,-2.3 2,-0.2 -1,-0.2 0.919 104.7 51.7 -65.6 -44.4 0.9 -11.5 8.6 50 50 A A H X S+ 0 0 10 -4,-1.8 4,-1.9 1,-0.2 -2,-0.2 0.948 109.8 50.2 -56.5 -51.3 2.0 -10.2 12.0 51 51 A V H X S+ 0 0 3 -4,-2.3 4,-2.7 1,-0.2 -1,-0.2 0.916 110.9 49.6 -49.1 -47.6 2.5 -13.7 13.2 52 52 A D H X S+ 0 0 7 -4,-2.1 4,-1.4 1,-0.2 -1,-0.2 0.820 106.9 53.4 -68.4 -33.7 4.6 -14.4 10.1 53 53 A I H X S+ 0 0 65 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.870 114.5 43.0 -66.8 -35.1 6.8 -11.4 10.5 54 54 A A H X S+ 0 0 1 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.881 107.3 58.5 -77.2 -38.8 7.5 -12.5 14.1 55 55 A R H X S+ 0 0 13 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.855 110.8 44.9 -59.4 -35.0 8.0 -16.2 13.2 56 56 A N H X S+ 0 0 13 -4,-1.4 4,-2.7 2,-0.2 5,-0.2 0.937 106.6 56.8 -73.8 -49.3 10.8 -15.0 10.8 57 57 A Q H X S+ 0 0 41 -4,-1.9 4,-0.8 1,-0.2 -2,-0.2 0.906 111.9 45.6 -43.6 -48.2 12.3 -12.6 13.3 58 58 A I H >X S+ 0 0 0 -4,-2.5 3,-1.3 1,-0.2 4,-1.0 0.970 110.1 52.8 -62.0 -54.0 12.6 -15.7 15.6 59 59 A A H 3<>S+ 0 0 0 -4,-2.0 5,-2.1 1,-0.3 3,-0.4 0.846 103.9 57.3 -49.4 -42.0 14.0 -18.0 12.9 60 60 A D H 3<5S+ 0 0 90 -4,-2.7 3,-0.4 1,-0.2 -1,-0.3 0.758 98.5 59.7 -70.1 -23.6 16.8 -15.5 11.9 61 61 A L H <<5S+ 0 0 19 -3,-1.3 129,-0.5 -4,-0.8 -1,-0.2 0.915 116.5 31.4 -65.9 -41.1 18.2 -15.5 15.4 62 62 A V T <5S- 0 0 1 -4,-1.0 130,-2.6 -3,-0.4 -1,-0.2 0.127 110.5-110.2-110.9 18.6 18.9 -19.2 15.4 63 63 A G T 5S+ 0 0 30 -3,-0.4 -3,-0.2 -4,-0.3 -4,-0.1 0.736 74.0 133.3 62.0 24.5 19.6 -19.8 11.7 64 64 A A < - 0 0 14 -5,-2.1 -1,-0.2 -6,-0.2 129,-0.1 -0.346 60.8-108.1 -94.0 177.6 16.4 -21.8 11.2 65 65 A D > - 0 0 39 -2,-0.1 3,-2.9 1,-0.1 4,-0.3 -0.886 28.0-122.2-101.5 142.0 13.7 -21.6 8.6 66 66 A P G > S+ 0 0 3 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.812 113.7 63.9 -51.0 -32.5 10.3 -20.0 9.7 67 67 A R G 3 S+ 0 0 39 1,-0.3 341,-0.0 341,-0.0 -11,-0.0 0.543 97.8 57.8 -70.8 -5.3 8.7 -23.3 8.6 68 68 A E G < S+ 0 0 18 -3,-2.9 150,-2.4 149,-0.0 2,-0.5 0.453 86.9 94.2 -99.0 -5.5 10.7 -25.0 11.4 69 69 A I E < -F 217 0C 0 -3,-1.5 2,-0.5 -4,-0.3 148,-0.2 -0.809 54.5-168.8 -98.2 123.3 9.3 -22.7 14.2 70 70 A V E -F 216 0C 0 146,-2.2 146,-2.0 -2,-0.5 2,-0.3 -0.931 20.1-127.8-111.0 126.5 6.4 -24.0 16.2 71 71 A F E +F 215 0C 3 -2,-0.5 144,-0.2 144,-0.2 2,-0.2 -0.534 34.6 167.7 -79.3 134.8 4.5 -21.7 18.6 72 72 A T E -F 214 0C 2 142,-3.1 142,-1.6 -2,-0.3 3,-0.1 -0.753 47.4-108.1-131.7 178.6 4.0 -22.8 22.2 73 73 A S S S- 0 0 59 1,-0.3 2,-0.3 140,-0.3 139,-0.1 0.436 89.9 -36.5 -91.3 -2.0 2.8 -21.2 25.5 74 74 A G > - 0 0 10 138,-0.2 4,-2.2 140,-0.1 -1,-0.3 -0.893 69.5 -74.7 162.8 168.3 6.3 -21.3 26.9 75 75 A A H > S+ 0 0 13 138,-0.3 4,-2.4 -2,-0.3 5,-0.2 0.876 124.0 61.0 -55.7 -38.4 9.6 -23.1 27.2 76 76 A T H > S+ 0 0 80 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.954 107.2 44.6 -54.4 -48.2 7.9 -25.6 29.6 77 77 A E H > S+ 0 0 19 1,-0.2 4,-3.7 2,-0.2 5,-0.2 0.941 109.3 55.3 -64.0 -44.7 5.6 -26.6 26.8 78 78 A S H X S+ 0 0 0 -4,-2.2 4,-3.4 1,-0.2 5,-0.2 0.898 108.9 49.1 -52.1 -43.4 8.3 -26.8 24.1 79 79 A D H X S+ 0 0 1 -4,-2.4 4,-2.1 2,-0.2 5,-0.3 0.883 114.5 43.6 -65.9 -43.6 10.2 -29.3 26.4 80 80 A N H X>S+ 0 0 43 -4,-2.0 4,-2.5 -5,-0.2 5,-0.8 0.948 117.8 46.1 -60.1 -52.5 7.1 -31.4 26.9 81 81 A L H X5S+ 0 0 3 -4,-3.7 4,-2.6 1,-0.2 5,-0.4 0.966 115.8 45.6 -53.9 -58.5 6.2 -31.2 23.2 82 82 A A H X5S+ 0 0 0 -4,-3.4 4,-2.3 -5,-0.2 5,-0.3 0.910 120.4 37.2 -54.8 -51.2 9.8 -31.9 22.0 83 83 A I H X5S+ 0 0 0 -4,-2.1 4,-2.4 -5,-0.2 -1,-0.2 0.938 125.0 34.4 -76.0 -50.1 10.5 -34.8 24.3 84 84 A K H X5S+ 0 0 41 -4,-2.5 4,-2.1 -5,-0.3 5,-0.3 0.858 119.3 54.6 -71.7 -37.1 7.1 -36.7 24.5 85 85 A G H X< S+ 0 0 33 -4,-2.3 3,-2.9 1,-0.2 4,-0.5 0.311 78.7 116.9-102.3 7.5 10.0 -42.9 17.3 91 91 A Q G > + 0 0 68 -3,-0.5 3,-0.6 -4,-0.4 -1,-0.2 0.668 68.1 66.1 -54.4 -20.4 9.1 -45.5 19.9 92 92 A K G 3 S+ 0 0 208 -3,-0.3 -1,-0.3 1,-0.2 3,-0.1 0.702 96.3 55.6 -76.0 -17.6 9.3 -48.2 17.3 93 93 A K G < S- 0 0 114 -3,-2.9 2,-0.2 1,-0.4 -1,-0.2 0.597 131.2 -59.7 -84.2 -12.8 13.1 -47.7 17.0 94 94 A G < - 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