==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 27-MAR-00 1E0G . COMPND 2 MOLECULE: MEMBRANE-BOUND LYTIC MUREIN TRANSGLYCOSYLASE D; . SOURCE 2 SYNTHETIC: YES; . AUTHOR A.BATEMAN,M.BYCROFT . 48 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 3710.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 31 64.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 10.4 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 . 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 . 6 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 16.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 10 20.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 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 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 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 D 0 0 159 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 164.3 -7.3 11.6 0.1 2 2 A S - 0 0 73 42,-0.0 2,-0.4 2,-0.0 44,-0.1 -0.908 360.0-143.4-110.2 130.6 -5.9 8.1 0.7 3 3 A I - 0 0 48 -2,-0.5 42,-3.1 44,-0.1 2,-0.5 -0.727 12.1-165.8 -91.7 138.4 -6.0 5.5 -2.0 4 4 A T E +A 44 0A 82 -2,-0.4 2,-0.4 40,-0.2 40,-0.2 -0.952 9.0 179.5-125.7 114.5 -6.6 1.8 -1.0 5 5 A Y E -A 43 0A 17 38,-2.2 38,-0.7 -2,-0.5 2,-0.6 -0.939 24.0-134.8-118.9 135.6 -5.9 -0.9 -3.6 6 6 A R E -A 42 0A 149 -2,-0.4 2,-0.8 36,-0.3 36,-0.3 -0.740 20.6-134.4 -88.6 121.9 -6.4 -4.6 -3.0 7 7 A V E -A 41 0A 8 34,-3.0 33,-2.8 -2,-0.6 34,-0.8 -0.628 29.6-173.4 -76.9 110.8 -3.4 -6.6 -4.3 8 8 A R > - 0 0 161 -2,-0.8 3,-2.8 31,-0.3 32,-0.0 -0.654 39.6 -75.8-102.6 161.7 -4.9 -9.5 -6.3 9 9 A K T 3 S+ 0 0 177 1,-0.3 -1,-0.1 -2,-0.2 3,-0.1 -0.263 125.8 25.3 -54.1 137.9 -2.9 -12.4 -7.9 10 10 A G T 3 S+ 0 0 85 1,-0.3 2,-0.5 -3,-0.1 -1,-0.3 0.265 98.2 116.1 88.8 -15.0 -1.2 -11.1 -11.0 11 11 A D < - 0 0 53 -3,-2.8 2,-0.3 4,-0.0 -1,-0.3 -0.748 51.0-159.8 -89.9 128.8 -1.2 -7.6 -9.5 12 12 A S > - 0 0 66 -2,-0.5 4,-3.4 1,-0.1 5,-0.3 -0.794 24.8-122.7-107.4 151.8 2.2 -6.1 -8.8 13 13 A L H > S+ 0 0 39 -2,-0.3 4,-2.3 2,-0.2 5,-0.1 0.977 115.9 37.5 -55.0 -57.5 3.0 -3.3 -6.4 14 14 A S H > S+ 0 0 84 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.945 116.8 52.6 -61.7 -45.8 4.6 -1.2 -9.2 15 15 A S H > S+ 0 0 63 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.925 108.0 52.1 -57.0 -41.7 2.1 -2.3 -11.8 16 16 A I H >X S+ 0 0 7 -4,-3.4 3,-0.9 1,-0.2 4,-0.8 0.952 104.8 55.5 -61.2 -45.8 -0.7 -1.3 -9.4 17 17 A A H >X>S+ 0 0 5 -4,-2.3 3,-2.0 1,-0.3 5,-1.4 0.936 100.3 60.0 -52.2 -46.0 0.9 2.2 -9.1 18 18 A K H ><5S+ 0 0 175 -4,-2.2 3,-1.2 1,-0.3 -1,-0.3 0.889 94.1 64.8 -51.1 -37.5 0.7 2.4 -12.9 19 19 A R H <<5S+ 0 0 219 -4,-1.3 -1,-0.3 -3,-0.9 -2,-0.2 0.851 119.6 23.5 -56.4 -30.8 -3.0 2.1 -12.6 20 20 A H H <<5S- 0 0 56 -3,-2.0 -1,-0.3 -4,-0.8 -2,-0.2 0.211 108.7-116.7-118.2 13.9 -3.0 5.4 -10.7 21 21 A G T <<5 + 0 0 58 -3,-1.2 -3,-0.2 -4,-0.6 2,-0.2 0.969 69.6 144.0 49.8 53.6 0.3 6.8 -12.2 22 22 A V < - 0 0 14 -5,-1.4 2,-0.9 -8,-0.2 -1,-0.2 -0.708 59.2-108.4-120.1 173.0 1.7 6.7 -8.6 23 23 A N >> - 0 0 85 -2,-0.2 4,-1.8 25,-0.2 3,-1.6 -0.789 19.7-167.7-105.4 95.5 5.1 6.0 -7.0 24 24 A I H 3> S+ 0 0 18 -2,-0.9 4,-2.8 1,-0.3 5,-0.3 0.825 89.6 67.1 -52.7 -24.1 4.9 2.7 -5.2 25 25 A K H 3> S+ 0 0 142 2,-0.2 4,-1.2 1,-0.2 -1,-0.3 0.945 98.9 49.5 -63.3 -39.9 8.2 3.7 -3.6 26 26 A D H <> S+ 0 0 35 -3,-1.6 4,-2.2 2,-0.2 3,-0.4 0.939 107.3 55.6 -62.5 -39.9 6.3 6.5 -1.8 27 27 A V H X S+ 0 0 1 -4,-1.8 4,-2.3 1,-0.3 -2,-0.2 0.951 110.0 43.7 -56.9 -44.6 3.9 3.7 -0.9 28 28 A M H < S+ 0 0 108 -4,-2.8 -1,-0.3 1,-0.2 -2,-0.2 0.698 107.5 64.9 -73.3 -14.2 6.9 1.9 0.7 29 29 A R H < S+ 0 0 190 -4,-1.2 -2,-0.2 -3,-0.4 -1,-0.2 0.924 111.7 30.6 -74.9 -42.8 7.9 5.3 2.1 30 30 A W H < S+ 0 0 98 -4,-2.2 2,-0.4 -3,-0.1 -2,-0.2 0.866 117.9 62.4 -83.9 -35.7 4.8 5.5 4.4 31 31 A N < - 0 0 46 -4,-2.3 3,-0.2 -5,-0.3 -1,-0.0 -0.737 55.1-178.8 -91.9 135.9 4.5 1.8 4.9 32 32 A S S S+ 0 0 112 -2,-0.4 2,-0.4 1,-0.2 -1,-0.1 0.609 79.3 46.1-105.0 -16.7 7.3 -0.0 6.7 33 33 A D > + 0 0 122 1,-0.1 3,-0.6 2,-0.0 -1,-0.2 -0.761 55.9 166.4-127.9 87.5 5.8 -3.5 6.5 34 34 A T G > + 0 0 41 -2,-0.4 3,-1.9 1,-0.2 -1,-0.1 0.252 46.9 111.5 -85.3 18.2 4.4 -4.2 3.0 35 35 A A G 3 + 0 0 77 1,-0.3 -1,-0.2 2,-0.0 -2,-0.0 0.632 62.0 75.8 -66.7 -6.6 4.2 -7.9 4.0 36 36 A N G < + 0 0 92 -3,-0.6 2,-2.6 1,-0.1 -1,-0.3 0.449 61.0 111.8 -83.4 3.4 0.4 -7.4 3.8 37 37 A L < + 0 0 39 -3,-1.9 -1,-0.1 -31,-0.1 -24,-0.1 -0.420 46.9 144.1 -76.5 74.8 0.6 -7.4 0.0 38 38 A Q > - 0 0 110 -2,-2.6 3,-2.2 4,-0.1 2,-1.8 -0.696 68.1 -82.5-109.1 164.7 -1.3 -10.7 -0.3 39 39 A P T 3 S+ 0 0 83 0, 0.0 -31,-0.3 0, 0.0 -30,-0.1 -0.467 126.0 19.9 -69.0 86.7 -3.8 -11.7 -3.0 40 40 A G T 3 S+ 0 0 40 -33,-2.8 2,-0.3 -2,-1.8 -32,-0.2 0.471 96.1 119.6 128.0 13.8 -6.8 -9.9 -1.5 41 41 A D E < -A 7 0A 49 -3,-2.2 -34,-3.0 -34,-0.8 -1,-0.4 -0.837 59.5-122.4-108.8 147.4 -5.2 -7.3 0.9 42 42 A K E -A 6 0A 99 -2,-0.3 2,-0.4 -36,-0.3 -36,-0.3 -0.427 24.4-157.8 -83.0 160.1 -5.6 -3.6 0.6 43 43 A L E -A 5 0A 7 -38,-0.7 -38,-2.2 -2,-0.1 2,-0.4 -0.996 20.2-116.0-142.0 136.6 -2.7 -1.2 0.2 44 44 A T E -A 4 0A 39 -2,-0.4 -40,-0.2 -40,-0.2 3,-0.2 -0.549 25.7-177.0 -72.2 125.0 -2.2 2.5 0.9 45 45 A L + 0 0 0 -42,-3.1 -41,-0.1 -2,-0.4 -1,-0.1 -0.382 22.5 152.2-117.0 55.3 -1.5 4.4 -2.3 46 46 A F + 0 0 91 -43,-0.1 -1,-0.2 -44,-0.1 -42,-0.1 0.806 41.7 120.3 -53.6 -23.0 -0.9 7.9 -0.8 47 47 A V 0 0 0 -3,-0.2 -44,-0.1 -24,-0.1 -2,-0.1 0.014 360.0 360.0 -39.6 143.4 1.2 8.2 -3.9 48 48 A K 0 0 188 -25,-0.1 -25,-0.2 0, 0.0 -1,-0.1 -0.749 360.0 360.0 -99.2 360.0 0.0 11.1 -6.2