==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 29-SEP-08 3EOR . COMPND 2 MOLECULE: 2-C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATE . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI K-12; . AUTHOR W.N.HUNTER,N.L.RAMSDEN,A.DAWSON . 157 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7989.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 101 64.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 4.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 29 18.5 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 . 1 0.6 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 . 9 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 36 22.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 2.5 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 0 0 0 0 1 0 1 1 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 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 PARALLEL BRIDGES PER LADDER . 1 0 1 0 0 0 0 0 1 0 1 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 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 0 A E 0 0 128 0, 0.0 156,-2.1 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 113.0 138.1 77.7 74.8 2 1 A M E -A 156 0A 121 154,-0.2 2,-0.4 91,-0.0 154,-0.2 -0.926 360.0-157.5-114.5 149.5 138.1 80.0 71.7 3 2 A R E -A 155 0A 86 152,-2.9 152,-3.3 -2,-0.3 2,-0.3 -0.985 2.4-152.4-138.1 126.1 135.2 82.2 70.8 4 3 A I E -A 154 0A 129 -2,-0.4 2,-0.3 150,-0.2 150,-0.2 -0.643 14.3-172.5-101.3 147.0 134.3 83.7 67.4 5 4 A G E -A 153 0A 6 148,-2.4 148,-1.8 -2,-0.3 2,-0.4 -0.990 10.0-159.4-144.6 149.8 132.3 86.9 66.9 6 5 A H E -A 152 0A 106 -2,-0.3 2,-0.3 41,-0.3 146,-0.2 -0.983 9.6-178.8-129.3 140.1 130.7 88.9 64.1 7 6 A G E -A 151 0A 2 144,-2.3 144,-2.2 -2,-0.4 2,-0.3 -0.970 3.3-176.0-139.0 154.5 129.7 92.7 63.8 8 7 A F E +A 150 0A 104 -2,-0.3 2,-0.3 142,-0.2 142,-0.2 -0.962 7.4 172.4-150.1 128.1 128.1 94.8 61.2 9 8 A D E -A 149 0A 31 140,-2.4 140,-2.3 -2,-0.3 2,-0.3 -0.965 9.1-168.0-141.1 164.5 127.3 98.4 61.0 10 9 A V E -A 148 0A 52 -2,-0.3 2,-0.4 138,-0.2 138,-0.2 -0.998 2.1-175.1-147.1 138.1 126.1 101.1 58.6 11 10 A H E -A 147 0A 30 136,-1.9 136,-2.7 -2,-0.3 2,-0.3 -0.997 21.3-128.1-140.2 149.3 125.9 104.9 58.4 12 11 A A E -A 146 0A 44 21,-0.5 21,-2.5 -2,-0.4 134,-0.3 -0.605 25.8-116.4 -86.4 142.3 124.4 107.3 56.1 13 12 A F B +D 32 0B 19 132,-2.2 19,-0.3 -2,-0.3 2,-0.2 -0.505 51.3 137.7 -69.5 142.1 126.3 110.2 54.5 14 13 A G + 0 0 19 17,-3.9 17,-0.4 -2,-0.2 2,-0.1 -0.805 43.4 13.3 178.9 151.9 125.1 113.7 55.4 15 14 A G S S- 0 0 62 -2,-0.2 16,-0.6 15,-0.1 2,-0.3 -0.346 98.2 -38.1 72.3-158.9 126.3 117.1 56.3 16 15 A E S S- 0 0 175 14,-0.3 14,-0.2 1,-0.2 16,-0.2 -0.730 72.2 -98.7-108.0 148.2 130.0 118.1 55.9 17 16 A G + 0 0 29 11,-0.5 14,-0.2 -2,-0.3 -1,-0.2 0.281 66.6 103.0 -60.0-165.3 133.2 116.0 56.5 18 17 A P - 0 0 38 0, 0.0 14,-0.3 0, 0.0 2,-0.3 0.767 51.8-153.4 -73.9-176.2 135.5 114.9 57.7 19 18 A I E -E 26 0C 4 7,-2.3 7,-4.1 12,-0.2 2,-0.5 -0.867 10.1-132.9-106.6 157.5 134.5 111.4 58.9 20 19 A I E +E 25 0C 46 17,-0.4 2,-0.4 -2,-0.3 20,-0.3 -0.944 29.5 170.2-102.1 124.4 136.0 109.3 61.6 21 20 A I E > S-E 24 0C 0 3,-2.5 3,-2.5 -2,-0.5 18,-0.1 -0.989 71.7 -7.6-134.0 126.5 136.7 105.7 60.7 22 21 A G T 3 S- 0 0 0 -2,-0.4 95,-0.2 1,-0.3 94,-0.2 0.857 131.3 -57.5 63.9 35.6 138.7 103.4 62.9 23 22 A G T 3 S+ 0 0 14 1,-0.2 -1,-0.3 93,-0.1 2,-0.3 0.317 112.3 122.3 74.4 -7.9 139.4 106.3 65.0 24 23 A V E < -E 21 0C 15 -3,-2.5 -3,-2.5 1,-0.0 2,-0.8 -0.692 62.8-129.8 -99.7 145.7 141.0 108.3 62.1 25 24 A R E -E 20 0C 180 -2,-0.3 -5,-0.2 -5,-0.2 -1,-0.0 -0.774 31.7-171.7 -87.7 104.6 139.8 111.7 60.9 26 25 A I E -E 19 0C 2 -7,-4.1 -7,-2.3 -2,-0.8 2,-0.1 -0.866 20.9-124.6-108.8 129.1 139.5 111.3 57.2 27 26 A P + 0 0 93 0, 0.0 2,-0.3 0, 0.0 4,-0.0 -0.459 46.4 144.8 -71.5 141.4 138.7 114.3 55.0 28 27 A Y - 0 0 42 -2,-0.1 -11,-0.5 76,-0.1 -2,-0.0 -0.975 56.6-108.6-168.4 175.3 135.7 114.0 52.8 29 28 A E S S+ 0 0 161 -2,-0.3 2,-0.3 -13,-0.1 -12,-0.1 0.632 100.5 35.6 -99.2 -22.1 132.9 116.0 51.3 30 29 A K S S- 0 0 83 -14,-0.2 -14,-0.3 -16,-0.1 2,-0.2 -0.837 73.1-145.2-109.5 164.6 130.1 114.6 53.4 31 30 A G - 0 0 4 -16,-0.6 -17,-3.9 -17,-0.4 2,-0.5 -0.558 31.2 -92.0-108.5-171.8 130.2 113.6 57.0 32 31 A L B -D 13 0B 26 -14,-0.3 2,-0.3 -19,-0.3 -19,-0.2 -0.895 26.4-130.4-108.9 118.3 128.2 110.7 58.6 33 32 A L + 0 0 103 -21,-2.5 -21,-0.5 -2,-0.5 2,-0.3 -0.537 53.4 135.0 -63.8 127.8 124.7 111.1 60.2 34 33 A A - 0 0 40 -2,-0.3 -23,-0.0 -23,-0.1 -2,-0.0 -0.959 65.8-125.0-166.4 150.8 125.0 109.5 63.6 35 34 A H S S+ 0 0 171 -2,-0.3 2,-0.2 0, 0.0 -2,-0.1 0.205 103.0 16.5 -78.4 13.6 124.1 110.1 67.2 36 35 A S S S- 0 0 51 35,-0.1 37,-0.1 38,-0.0 -2,-0.1 -0.754 126.0 -42.0-157.6-168.3 127.8 109.5 68.0 37 36 A D - 0 0 40 35,-0.7 -17,-0.4 -2,-0.2 -5,-0.2 0.893 64.3-140.4 -32.0 -49.4 131.1 109.5 66.2 38 37 A G + 0 0 0 1,-0.2 2,-1.7 -19,-0.1 -1,-0.1 0.707 43.6 160.7 71.4 23.2 129.3 107.5 63.4 39 38 A D > - 0 0 0 1,-0.2 4,-2.2 -18,-0.1 3,-0.2 -0.587 18.4-176.4 -76.1 86.6 132.6 105.5 63.3 40 39 A V H > S+ 0 0 0 -2,-1.7 4,-2.2 -20,-0.3 5,-0.2 0.733 75.8 56.7 -52.9 -35.6 131.2 102.4 61.5 41 40 A A H > S+ 0 0 3 2,-0.2 4,-2.3 -21,-0.2 -1,-0.2 0.933 110.9 41.2 -72.4 -45.7 134.5 100.5 61.8 42 41 A L H > S+ 0 0 2 -3,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.868 114.3 55.0 -69.8 -28.5 134.8 100.7 65.6 43 42 A H H X S+ 0 0 17 -4,-2.2 4,-2.5 2,-0.2 15,-0.2 0.980 111.4 42.6 -65.2 -42.9 131.1 100.0 65.9 44 43 A A H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 107,-0.2 0.929 115.6 49.3 -70.3 -42.0 131.3 96.8 63.9 45 44 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.898 108.0 53.4 -60.1 -41.3 134.4 95.7 65.6 46 45 A T H X S+ 0 0 1 -4,-2.4 4,-2.9 1,-0.3 -2,-0.2 0.954 110.1 49.0 -65.0 -46.0 132.9 96.4 69.1 47 46 A D H X S+ 0 0 31 -4,-2.5 4,-2.6 2,-0.2 -41,-0.3 0.803 107.0 53.2 -55.7 -39.4 130.0 94.2 68.2 48 47 A A H X S+ 0 0 0 -4,-2.2 4,-1.8 -43,-0.2 105,-0.2 0.939 112.5 46.7 -63.7 -41.7 132.2 91.4 66.9 49 48 A L H X S+ 0 0 1 -4,-2.6 4,-1.6 2,-0.2 -2,-0.2 0.967 115.4 44.3 -65.1 -51.6 134.1 91.5 70.3 50 49 A L H <>S+ 0 0 0 -4,-2.9 5,-2.7 1,-0.2 6,-0.4 0.911 112.4 53.1 -52.4 -45.9 130.8 91.6 72.4 51 50 A G H ><5S+ 0 0 34 -4,-2.6 3,-1.3 1,-0.2 -1,-0.2 0.877 105.7 52.4 -61.9 -35.3 129.3 88.9 70.3 52 51 A A H 3<5S+ 0 0 1 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.882 113.1 45.1 -71.3 -32.6 132.2 86.5 70.8 53 52 A A T 3<5S- 0 0 7 -4,-1.6 -1,-0.3 -3,-0.2 -2,-0.2 0.313 113.3-121.4 -84.7 7.6 131.9 87.0 74.6 54 53 A A T < 5S+ 0 0 73 -3,-1.3 -3,-0.2 -5,-0.1 -2,-0.1 0.906 73.4 131.8 46.9 42.3 128.1 86.6 74.3 55 54 A L < - 0 0 31 -5,-2.7 2,-0.9 1,-0.2 6,-0.2 0.343 66.8-123.8 -99.2 12.8 127.5 90.1 75.8 56 55 A G - 0 0 36 -6,-0.4 2,-0.3 -5,-0.1 -1,-0.2 -0.785 45.8 -69.8 94.8-107.3 125.0 91.2 73.2 57 56 A D > - 0 0 63 -2,-0.9 4,-2.5 1,-0.1 3,-0.4 -0.964 47.5 -77.2-175.4 167.0 126.2 94.3 71.4 58 57 A I H > S+ 0 0 26 -2,-0.3 4,-4.5 -15,-0.2 -1,-0.1 0.922 122.0 58.6 -39.7 -60.3 126.7 98.1 71.7 59 58 A G H 4 S+ 0 0 45 1,-0.2 -1,-0.2 2,-0.2 5,-0.1 0.822 113.0 38.8 -50.9 -43.7 122.9 98.9 71.4 60 59 A K H 4 S+ 0 0 144 -3,-0.4 -1,-0.2 1,-0.1 -2,-0.2 0.995 121.4 43.4 -59.8 -67.9 122.2 96.7 74.5 61 60 A L H < S+ 0 0 28 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.2 0.786 128.2 27.7 -52.6 -36.1 125.3 97.8 76.4 62 61 A F S < S- 0 0 8 -4,-4.5 -1,-0.3 -5,-0.3 2,-0.1 -0.711 79.3-155.0-136.0 82.8 124.9 101.4 75.5 63 62 A P > - 0 0 32 0, 0.0 3,-2.5 0, 0.0 6,-0.2 -0.364 19.0-141.3 -58.6 124.4 121.3 102.7 74.8 64 63 A D T 3 S+ 0 0 128 1,-0.3 -5,-0.0 -2,-0.1 5,-0.0 0.717 112.9 51.5 -41.6 -24.1 121.0 105.7 72.6 65 64 A T T 3 S+ 0 0 129 2,-0.0 -1,-0.3 5,-0.0 -3,-0.0 0.245 104.7 80.3-102.7 11.2 118.3 106.3 75.2 66 65 A D S < S- 0 0 73 -3,-2.5 4,-0.5 1,-0.1 3,-0.3 -0.530 70.5 -95.6-132.0-178.2 120.5 105.8 78.2 67 66 A P S S+ 0 0 89 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.136 82.2 29.2 -99.5 173.9 123.0 107.3 80.5 68 67 A A S S+ 0 0 93 1,-0.2 -6,-0.0 2,-0.0 0, 0.0 0.386 118.6 50.5 78.4 -9.5 126.7 107.7 81.2 69 68 A F + 0 0 61 -3,-0.3 -1,-0.2 -6,-0.2 8,-0.1 0.529 67.4 99.7-145.6 -28.3 127.5 107.3 77.5 70 69 A K S S+ 0 0 170 -4,-0.5 2,-0.9 1,-0.3 -2,-0.0 0.748 86.9 58.7 -50.4 -26.8 125.4 109.7 75.4 71 70 A G S S+ 0 0 76 2,-0.0 2,-0.4 -35,-0.0 -1,-0.3 -0.708 90.6 134.6 -98.9 80.0 128.4 111.9 75.3 72 71 A A - 0 0 25 -2,-0.9 -35,-0.7 4,-0.0 2,-0.3 -0.985 50.0-152.1-144.1 125.9 130.7 109.3 73.8 73 72 A D >> - 0 0 71 -2,-0.4 4,-1.5 -37,-0.1 3,-1.4 -0.722 38.8-114.1 -86.7 152.5 133.3 108.8 71.0 74 73 A S H 3> S+ 0 0 1 -2,-0.3 4,-2.0 1,-0.3 5,-0.1 0.701 112.2 64.0 -69.1 -16.9 133.4 105.3 69.6 75 74 A R H 3> S+ 0 0 54 2,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.777 103.3 46.8 -79.7 -25.9 136.9 104.7 71.0 76 75 A E H <> S+ 0 0 91 -3,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.841 111.2 51.9 -77.6 -37.6 135.7 105.0 74.6 77 76 A L H X S+ 0 0 14 -4,-1.5 4,-2.9 2,-0.2 -2,-0.2 0.920 111.0 48.5 -60.7 -43.5 132.8 102.6 73.8 78 77 A L H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.919 113.3 46.3 -60.4 -46.0 135.3 100.2 72.4 79 78 A R H X S+ 0 0 72 -4,-1.5 4,-1.3 2,-0.2 -1,-0.2 0.816 113.7 49.5 -70.9 -30.3 137.6 100.5 75.5 80 79 A E H X S+ 0 0 36 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.939 111.6 47.3 -69.7 -50.9 134.6 100.1 77.8 81 80 A A H X S+ 0 0 0 -4,-2.9 4,-2.7 1,-0.2 -2,-0.2 0.927 113.3 48.9 -57.0 -45.9 133.3 97.0 76.0 82 81 A W H X S+ 0 0 12 -4,-2.5 4,-2.6 2,-0.2 5,-0.3 0.865 107.6 56.4 -59.9 -36.2 136.8 95.5 76.0 83 82 A R H X S+ 0 0 139 -4,-1.3 4,-1.5 1,-0.2 -2,-0.2 0.953 112.1 40.7 -66.0 -48.9 136.9 96.4 79.7 84 83 A R H X S+ 0 0 89 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.906 111.6 59.4 -51.4 -46.5 133.8 94.4 80.3 85 84 A I H <>S+ 0 0 0 -4,-2.7 5,-1.2 1,-0.3 -2,-0.2 0.864 107.5 43.1 -64.8 -36.6 135.0 91.7 77.9 86 85 A Q H ><5S+ 0 0 94 -4,-2.6 3,-2.7 1,-0.2 -1,-0.3 0.832 102.0 68.1 -74.2 -33.6 138.2 91.0 79.9 87 86 A A H 3<5S+ 0 0 83 -4,-1.5 -2,-0.2 1,-0.3 -1,-0.2 0.859 97.3 55.5 -55.3 -34.7 136.2 91.1 83.2 88 87 A K T 3<5S- 0 0 140 -4,-1.4 -1,-0.3 -3,-0.2 -2,-0.2 0.238 130.3 -96.6 -83.9 19.9 134.6 87.8 81.9 89 88 A G T < 5S+ 0 0 43 -3,-2.7 2,-0.3 1,-0.2 -3,-0.2 0.663 75.7 143.8 91.3 9.1 138.0 86.2 81.5 90 89 A Y < - 0 0 23 -5,-1.2 2,-0.3 67,-0.2 67,-0.3 -0.609 28.5-168.3 -97.4 155.1 138.6 86.8 77.8 91 90 A T E -B 156 0A 70 65,-4.1 65,-2.8 -2,-0.3 2,-0.2 -0.928 32.0 -92.6-134.2 153.4 141.7 87.6 76.0 92 91 A L E +B 155 0A 23 -2,-0.3 63,-0.2 63,-0.2 3,-0.1 -0.454 35.0 170.5 -74.7 134.4 142.4 88.8 72.4 93 92 A G E - 0 0 15 61,-2.5 2,-0.3 1,-0.4 62,-0.2 0.799 62.8 -55.3 -95.3 -82.9 143.1 86.3 69.6 94 93 A N E -B 154 0A 79 60,-0.7 60,-2.1 29,-0.0 -1,-0.4 -0.908 45.6-143.0-146.0-171.3 143.0 88.5 66.5 95 94 A V E -Bc 153 128A 1 32,-1.4 34,-3.2 -2,-0.3 2,-0.4 -0.957 8.4-171.1-160.0 128.1 140.6 90.9 64.7 96 95 A D E -Bc 152 129A 43 56,-2.3 56,-2.2 -2,-0.3 2,-0.4 -0.989 7.5-169.4-133.3 124.7 139.8 91.6 61.1 97 96 A V E -Bc 151 130A 1 32,-2.3 34,-2.5 -2,-0.4 2,-0.6 -0.897 7.8-160.3-121.7 138.2 137.7 94.5 59.9 98 97 A T E -Bc 150 131A 35 52,-3.7 52,-2.2 -2,-0.4 2,-0.3 -0.908 6.4-159.7-123.9 104.7 136.3 95.1 56.4 99 98 A I E -Bc 149 132A 0 32,-3.4 34,-2.8 -2,-0.6 2,-0.6 -0.669 5.4-159.6 -81.8 135.9 135.2 98.6 55.5 100 99 A I E +Bc 148 133A 25 48,-3.9 48,-2.3 -2,-0.3 2,-0.3 -0.927 34.8 130.8-119.6 103.8 132.8 98.7 52.6 101 100 A A - 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