==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 13-AUG-04 1W66 . COMPND 2 MOLECULE: LIPOYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR Q.MA,M.WILMANNS . 218 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9663.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 146 67.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 6.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 38 17.4 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 . 2 0.9 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 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 45 20.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.8 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 0 1 0 0 0 0 0 0 0 0 0 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 0 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 0 PARALLEL BRIDGES PER LADDER . 2 1 1 2 1 0 0 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 1 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 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 0 100 0, 0.0 3,-1.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-162.7 -10.0 3.8 21.4 2 0 A A T 3 + 0 0 66 1,-0.3 0, 0.0 0, 0.0 0, 0.0 0.746 360.0 50.7 -68.2 -20.5 -8.3 4.1 18.1 3 1 A M T 3 S+ 0 0 47 212,-0.1 -1,-0.3 106,-0.1 4,-0.1 0.574 91.8 93.3 -92.7 -12.1 -5.2 2.4 19.2 4 2 A A S < S+ 0 0 56 -3,-1.5 211,-0.2 212,-0.1 212,-0.1 -0.293 76.1 21.5 -76.3 163.8 -6.9 -0.7 20.6 5 3 A G S S- 0 0 45 210,-0.4 2,-0.4 209,-0.2 211,-0.0 -0.183 98.4 -57.2 69.9-171.0 -7.5 -3.8 18.6 6 4 A S - 0 0 46 2,-0.1 208,-0.2 209,-0.1 207,-0.1 -0.921 22.7-163.4-115.9 141.5 -5.6 -4.9 15.5 7 5 A I + 0 0 16 206,-2.2 92,-2.7 -2,-0.4 2,-0.2 0.471 66.9 101.4 -87.4 -13.9 -5.0 -3.1 12.2 8 6 A R B -A 98 0A 18 205,-0.5 90,-0.3 90,-0.3 -2,-0.1 -0.464 66.2-146.2 -80.4 153.7 -3.8 -6.3 10.6 9 7 A S S S+ 0 0 68 88,-2.1 2,-0.4 1,-0.2 89,-0.1 0.695 89.2 37.1 -84.6 -20.5 -5.8 -8.6 8.4 10 8 A K - 0 0 67 87,-0.5 2,-1.1 2,-0.1 -1,-0.2 -0.998 69.4-145.2-139.6 131.0 -4.1 -11.8 9.7 11 9 A L + 0 0 132 -2,-0.4 2,-0.3 -3,-0.1 3,-0.0 -0.545 53.5 124.2 -96.0 71.1 -3.1 -12.6 13.2 12 10 A S S S- 0 0 42 -2,-1.1 -2,-0.1 1,-0.0 32,-0.1 -0.839 72.2 -79.2-120.2 158.4 0.0 -14.6 12.7 13 11 A A - 0 0 88 -2,-0.3 31,-0.3 1,-0.1 2,-0.3 -0.337 46.8-119.0 -63.8 136.4 3.4 -13.8 14.2 14 12 A I - 0 0 22 29,-0.1 2,-0.9 1,-0.1 31,-0.2 -0.550 21.2-126.0 -72.2 134.9 5.4 -11.1 12.4 15 13 A D E -b 45 0B 65 29,-2.9 31,-2.7 -2,-0.3 2,-0.6 -0.758 25.9-157.7 -80.3 106.4 8.7 -12.3 11.0 16 14 A V E -b 46 0B 49 -2,-0.9 2,-0.6 29,-0.2 31,-0.2 -0.822 6.7-167.3 -90.9 124.7 11.2 -9.9 12.4 17 15 A R E -b 47 0B 87 29,-3.0 31,-2.5 -2,-0.6 2,-1.1 -0.936 8.5-159.6-116.4 109.0 14.4 -9.7 10.3 18 16 A Q E +b 48 0B 83 -2,-0.6 31,-0.2 29,-0.2 2,-0.1 -0.789 25.8 179.5 -85.9 94.5 17.3 -7.9 12.0 19 17 A L E - 0 0 49 29,-2.6 3,-0.1 -2,-1.1 -2,-0.0 -0.434 20.6-131.7 -91.4 169.7 19.4 -7.0 9.0 20 18 A G E - 0 0 43 1,-0.2 30,-2.2 -2,-0.1 2,-0.6 0.431 63.4 -28.6 -91.8-130.4 22.7 -5.2 8.8 21 19 A T E -b 50 0B 95 28,-0.2 2,-0.4 30,-0.0 30,-0.2 -0.856 69.0-179.8 -96.6 118.0 23.7 -2.3 6.6 22 20 A V - 0 0 28 28,-2.8 27,-0.0 -2,-0.6 -3,-0.0 -0.986 31.1-111.5-130.3 124.5 21.6 -2.6 3.3 23 21 A D > - 0 0 84 -2,-0.4 4,-2.5 28,-0.2 5,-0.3 -0.232 32.0-116.8 -52.8 143.4 21.8 -0.3 0.3 24 22 A Y H > S+ 0 0 7 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.897 112.4 44.7 -51.5 -52.5 18.6 1.7 -0.1 25 23 A R H > S+ 0 0 121 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.905 111.4 52.5 -64.8 -40.0 17.7 0.2 -3.5 26 24 A T H > S+ 0 0 73 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.932 111.7 46.6 -60.6 -42.1 18.4 -3.3 -2.4 27 25 A A H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.884 109.7 54.2 -68.0 -37.2 16.2 -2.9 0.6 28 26 A W H X S+ 0 0 14 -4,-2.0 4,-2.1 -5,-0.3 -2,-0.2 0.928 107.8 50.2 -64.4 -40.8 13.4 -1.4 -1.5 29 27 A Q H X S+ 0 0 110 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.923 110.7 49.4 -60.1 -45.5 13.5 -4.4 -3.9 30 28 A L H X S+ 0 0 42 -4,-2.1 4,-2.9 1,-0.2 5,-0.2 0.915 107.1 55.1 -63.2 -41.7 13.2 -6.7 -0.9 31 29 A Q H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.933 109.8 46.6 -53.7 -46.7 10.3 -4.7 0.5 32 30 A R H X S+ 0 0 104 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.910 111.6 50.5 -64.9 -41.1 8.5 -5.2 -2.8 33 31 A E H X S+ 0 0 134 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.922 113.1 46.7 -62.0 -44.6 9.3 -8.9 -2.9 34 32 A L H X S+ 0 0 15 -4,-2.9 4,-2.3 2,-0.2 -2,-0.2 0.873 109.6 53.4 -67.0 -36.4 8.0 -9.4 0.6 35 33 A A H X S+ 0 0 8 -4,-2.3 4,-2.5 -5,-0.2 -1,-0.2 0.924 109.3 48.2 -65.5 -44.3 4.9 -7.4 -0.1 36 34 A D H X S+ 0 0 91 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.905 110.8 52.1 -61.6 -40.8 4.1 -9.6 -3.1 37 35 A A H <>S+ 0 0 52 -4,-2.1 5,-2.7 1,-0.2 -2,-0.2 0.890 108.7 50.8 -63.8 -36.0 4.7 -12.7 -0.9 38 36 A R H ><5S+ 0 0 23 -4,-2.3 3,-2.0 3,-0.2 -2,-0.2 0.924 108.4 50.1 -67.0 -43.7 2.3 -11.3 1.7 39 37 A V H 3<5S+ 0 0 73 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.884 105.2 59.5 -60.7 -33.4 -0.4 -10.7 -0.8 40 38 A A T 3<5S- 0 0 88 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.445 135.4 -88.1 -75.7 0.8 0.2 -14.3 -2.0 41 39 A G T < 5S+ 0 0 48 -3,-2.0 -3,-0.2 1,-0.2 -2,-0.2 0.452 86.7 130.9 110.3 7.3 -0.7 -15.5 1.5 42 40 A G < - 0 0 28 -5,-2.7 -1,-0.2 1,-0.2 2,-0.1 0.092 57.7 -60.0 -82.0-166.2 2.7 -15.3 3.2 43 41 A A - 0 0 47 1,-0.1 2,-0.3 53,-0.0 -1,-0.2 -0.332 41.0-113.6 -78.6 154.0 3.9 -13.7 6.5 44 42 A D - 0 0 0 -31,-0.3 -29,-2.9 -32,-0.1 2,-0.3 -0.652 43.0-158.6 -71.1 143.7 3.8 -10.2 7.7 45 43 A T E -bC 15 95B 3 50,-2.2 50,-3.2 -2,-0.3 2,-0.4 -0.949 21.6-159.5-133.5 145.4 7.5 -9.0 8.0 46 44 A L E -bC 16 94B 1 -31,-2.7 -29,-3.0 -2,-0.3 2,-0.5 -0.961 13.0-162.6-124.9 113.2 9.4 -6.3 9.9 47 45 A L E -bC 17 93B 0 46,-2.3 46,-2.6 -2,-0.4 2,-0.4 -0.810 5.3-172.8 -89.1 134.6 12.8 -5.4 8.4 48 46 A L E +bC 18 92B 0 -31,-2.5 -29,-2.6 -2,-0.5 2,-0.3 -0.997 27.8 129.3-127.7 125.9 15.1 -3.5 10.8 49 47 A L E - C 0 91B 0 42,-2.5 42,-3.0 -2,-0.4 2,-0.4 -0.919 50.4-112.3-158.6 173.1 18.3 -2.2 9.2 50 48 A E E -b 21 0B 31 -30,-2.2 -28,-2.8 -2,-0.3 40,-0.1 -0.960 26.2-145.9-118.3 144.1 20.7 0.6 8.6 51 49 A H - 0 0 1 38,-0.4 38,-0.2 -2,-0.4 -28,-0.2 -0.854 23.2-109.6 -98.8 148.2 21.2 2.3 5.2 52 50 A P - 0 0 59 0, 0.0 -28,-0.2 0, 0.0 33,-0.1 -0.367 68.4 -62.7 -58.4 154.2 24.4 3.8 3.8 53 51 A A S S+ 0 0 70 31,-0.1 2,-0.3 -2,-0.0 33,-0.3 -0.141 78.8 149.4 -49.4 127.5 24.1 7.6 3.7 54 52 A V E -J 85 0C 26 31,-2.5 31,-2.6 -3,-0.1 2,-0.4 -0.975 41.0-139.3-161.6 141.2 21.4 8.6 1.3 55 53 A Y E -J 84 0C 16 17,-0.5 19,-2.9 -2,-0.3 2,-0.4 -0.912 25.2-168.7 -97.0 139.1 18.8 11.3 0.7 56 54 A T E -Jk 83 74C 0 27,-2.1 27,-2.3 -2,-0.4 2,-0.4 -0.960 5.0-161.2-130.4 147.3 15.4 10.1 -0.4 57 55 A A E -Jk 82 75C 1 17,-2.6 19,-2.6 -2,-0.4 25,-0.2 -0.974 8.0-147.1-131.5 121.9 12.5 12.2 -1.8 58 56 A G > - 0 0 1 23,-2.2 3,-2.1 -2,-0.4 19,-0.2 -0.308 43.8 -92.2 -74.8 170.5 8.9 11.3 -2.1 59 57 A R T 3 S+ 0 0 249 19,-0.4 22,-0.1 17,-0.4 -1,-0.1 0.812 123.0 60.7 -57.7 -33.5 6.9 12.7 -4.9 60 58 A R T 3 S+ 0 0 161 20,-0.6 -1,-0.3 21,-0.1 21,-0.2 0.602 75.1 121.8 -72.1 -12.0 5.7 15.7 -2.9 61 59 A T < - 0 0 15 -3,-2.1 2,-0.3 19,-0.4 -4,-0.1 -0.304 56.3-140.8 -54.9 134.4 9.3 17.0 -2.4 62 60 A E > - 0 0 95 1,-0.1 3,-2.0 20,-0.0 4,-0.4 -0.699 18.4-113.3 -98.2 153.8 9.8 20.5 -3.8 63 61 A T G > S+ 0 0 123 1,-0.3 3,-1.6 -2,-0.3 -1,-0.1 0.858 113.5 53.7 -55.1 -44.7 12.9 21.6 -5.6 64 62 A H G 3 S+ 0 0 124 1,-0.3 -1,-0.3 111,-0.0 -3,-0.0 0.612 99.5 63.5 -70.0 -12.4 14.0 24.1 -3.0 65 63 A E G < S+ 0 0 4 -3,-2.0 111,-1.7 110,-0.1 -1,-0.3 0.532 84.0 100.5 -83.9 -11.4 13.9 21.4 -0.2 66 64 A R S < S- 0 0 74 -3,-1.6 4,-0.1 -4,-0.4 5,-0.0 -0.186 93.8 -58.9 -74.9 166.5 16.6 19.4 -1.9 67 65 A P > - 0 0 13 0, 0.0 3,-1.8 0, 0.0 108,-0.2 -0.180 38.1-144.3 -56.9 133.3 20.2 19.5 -0.7 68 66 A I T 3 S+ 0 0 137 106,-2.4 107,-0.1 1,-0.3 -2,-0.0 0.489 101.7 53.6 -72.9 -2.9 21.7 23.0 -0.8 69 67 A D T 3 S- 0 0 99 105,-0.2 -1,-0.3 2,-0.1 105,-0.0 0.176 116.9-110.3-113.5 10.5 25.0 21.4 -1.8 70 68 A G < + 0 0 64 -3,-1.8 -2,-0.1 1,-0.2 3,-0.1 0.569 55.2 166.9 72.9 11.4 23.7 19.5 -4.8 71 69 A T - 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