==== 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 HYDROLASE 28-OCT-10 3PFE . COMPND 2 MOLECULE: SUCCINYL-DIAMINOPIMELATE DESUCCINYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LEGIONELLA PNEUMOPHILA SUBSP. PNEUMOPH . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 471 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21005.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 320 67.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 32 6.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 58 12.3 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 28 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 140 29.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.5 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 3 0 0 2 1 2 3 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 0 1 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 PARALLEL BRIDGES PER LADDER . 4 1 2 0 2 1 1 0 0 1 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 2 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 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 G 0 0 120 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -90.8 12.9 44.7 35.0 2 1 A X + 0 0 134 147,-0.0 2,-0.5 2,-0.0 148,-0.1 0.847 360.0 75.1 -65.2 -39.1 15.6 44.4 32.3 3 2 A F - 0 0 32 146,-0.1 142,-0.0 1,-0.0 146,-0.0 -0.635 58.7-175.1 -81.1 124.5 17.6 41.4 33.7 4 3 A K > - 0 0 90 -2,-0.5 4,-1.7 1,-0.1 3,-0.4 -0.893 9.0-167.4-117.8 98.5 15.8 38.1 33.1 5 4 A P H > S+ 0 0 40 0, 0.0 4,-1.4 0, 0.0 -1,-0.1 0.862 90.5 47.4 -56.0 -36.1 17.7 35.3 34.8 6 5 A Q H > S+ 0 0 97 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.809 105.9 59.3 -75.3 -26.0 15.7 32.5 33.0 7 6 A G H > S+ 0 0 27 -3,-0.4 4,-2.2 2,-0.2 5,-0.3 0.891 101.6 55.4 -64.6 -36.1 16.2 34.4 29.7 8 7 A L H X S+ 0 0 0 -4,-1.7 4,-2.8 1,-0.2 -2,-0.2 0.956 110.2 45.3 -59.2 -49.2 19.9 34.0 30.2 9 8 A Y H X S+ 0 0 52 -4,-1.4 4,-3.0 1,-0.2 5,-0.3 0.927 110.6 52.6 -63.8 -44.2 19.5 30.2 30.6 10 9 A D H X S+ 0 0 102 -4,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.924 114.2 42.2 -58.9 -44.3 17.2 29.9 27.6 11 10 A Y H X S+ 0 0 27 -4,-2.2 4,-2.8 2,-0.2 -1,-0.2 0.936 114.3 51.1 -66.2 -46.4 19.6 31.7 25.3 12 11 A I H X S+ 0 0 0 -4,-2.8 4,-2.6 -5,-0.3 -2,-0.2 0.901 109.5 50.3 -61.5 -39.8 22.6 29.9 26.7 13 12 A C H X S+ 0 0 23 -4,-3.0 4,-2.3 2,-0.2 -1,-0.2 0.910 111.7 48.2 -63.0 -43.8 21.0 26.5 26.2 14 13 A Q H X S+ 0 0 63 -4,-1.8 4,-2.9 -5,-0.3 5,-0.4 0.930 112.3 49.1 -63.7 -42.6 20.1 27.4 22.5 15 14 A Q H X>S+ 0 0 11 -4,-2.8 5,-2.8 2,-0.2 4,-2.2 0.913 110.1 51.1 -61.7 -45.2 23.6 28.6 21.9 16 15 A W H <>S+ 0 0 2 -4,-2.6 5,-2.6 -5,-0.2 -2,-0.2 0.950 116.9 40.2 -57.5 -47.1 25.1 25.4 23.4 17 16 A Q H <5S+ 0 0 91 -4,-2.3 -2,-0.2 3,-0.2 -1,-0.2 0.920 129.5 24.4 -68.8 -45.3 22.9 23.2 21.2 18 17 A E H <5S+ 0 0 123 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.774 133.2 22.0 -98.8 -30.6 23.1 25.1 17.9 19 18 A E T X5S+ 0 0 74 -4,-2.2 4,-0.6 -5,-0.4 -3,-0.2 0.797 125.1 35.9-111.4 -43.1 26.3 27.1 18.0 20 19 A I H > S+ 0 0 68 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.929 116.5 43.9 -62.3 -38.9 29.0 21.4 16.4 23 22 A S H X S+ 0 0 16 -4,-0.6 4,-2.0 -3,-0.4 -2,-0.2 0.881 113.7 49.8 -68.8 -45.0 32.2 23.5 16.7 24 23 A L H X S+ 0 0 0 -4,-3.0 4,-1.7 2,-0.2 -1,-0.2 0.895 108.5 53.2 -62.2 -40.9 33.3 21.8 20.0 25 24 A C H X S+ 0 0 25 -4,-2.6 4,-0.9 -5,-0.3 3,-0.2 0.935 108.8 50.0 -57.8 -44.8 32.7 18.4 18.4 26 25 A D H >< S+ 0 0 82 -4,-1.9 3,-0.6 1,-0.2 4,-0.5 0.879 107.9 54.5 -64.8 -32.3 35.0 19.4 15.5 27 26 A Y H >< S+ 0 0 0 -4,-2.0 3,-1.2 1,-0.2 -1,-0.2 0.854 98.2 62.7 -65.7 -36.6 37.6 20.5 18.0 28 27 A I H 3< S+ 0 0 0 -4,-1.7 -1,-0.2 1,-0.2 98,-0.2 0.807 94.8 62.5 -60.3 -28.6 37.6 17.1 19.7 29 28 A K T << S+ 0 0 116 -4,-0.9 -1,-0.2 -3,-0.6 -2,-0.2 0.782 82.2 94.3 -68.7 -20.9 38.8 15.6 16.4 30 29 A I < - 0 0 3 -3,-1.2 2,-1.7 -4,-0.5 85,-0.0 -0.550 68.1-149.8 -80.4 121.0 42.1 17.7 16.6 31 30 A P + 0 0 29 0, 0.0 2,-1.9 0, 0.0 15,-0.2 -0.262 34.2 158.8 -89.1 56.8 44.9 15.6 18.2 32 31 A N - 0 0 1 -2,-1.7 68,-1.9 14,-0.3 2,-0.1 -0.475 19.3-171.5 -86.3 76.0 46.6 18.6 19.6 33 32 A K B -a 100 0A 49 -2,-1.9 68,-0.2 66,-0.2 14,-0.1 -0.417 30.1-104.5 -66.0 142.4 48.7 17.1 22.4 34 33 A S >> - 0 0 0 66,-2.6 3,-2.1 -2,-0.1 4,-0.5 -0.211 39.5 -99.1 -64.4 156.7 50.4 19.6 24.7 35 34 A P G >4 S+ 0 0 10 0, 0.0 3,-1.3 0, 0.0 6,-0.2 0.788 119.9 62.3 -57.4 -32.3 54.2 20.0 24.2 36 35 A H G 34 S+ 0 0 102 1,-0.3 3,-0.2 2,-0.1 129,-0.1 0.813 112.3 40.2 -59.4 -26.8 55.3 17.6 27.1 37 36 A F G <4 S+ 0 0 66 -3,-2.1 -1,-0.3 1,-0.3 2,-0.1 0.381 127.8 30.4-101.1 -2.1 53.5 14.9 25.2 38 37 A D X< - 0 0 25 -3,-1.3 3,-1.9 -4,-0.5 -1,-0.3 -0.592 57.0-175.1-159.5 90.6 54.6 15.9 21.7 39 38 A A T 3 S+ 0 0 96 1,-0.3 3,-0.3 -3,-0.2 -3,-0.1 0.766 91.3 53.7 -62.6 -22.0 58.0 17.6 21.3 40 39 A K T 3> + 0 0 124 1,-0.2 4,-2.5 2,-0.1 -1,-0.3 -0.026 68.8 126.3 -99.9 27.1 57.2 18.1 17.6 41 40 A W H <> S+ 0 0 30 -3,-1.9 4,-1.1 1,-0.2 6,-0.5 0.833 71.3 53.9 -53.5 -33.8 53.9 19.8 18.3 42 41 A E H >4 S+ 0 0 108 -3,-0.3 3,-0.6 1,-0.2 -1,-0.2 0.974 111.6 42.6 -70.2 -52.4 54.9 22.8 16.1 43 42 A E H 34 S+ 0 0 145 1,-0.2 -2,-0.2 2,-0.1 -1,-0.2 0.870 109.1 59.5 -54.2 -42.6 55.8 20.7 13.0 44 43 A H H 3< S- 0 0 81 -4,-2.5 -1,-0.2 1,-0.1 -2,-0.2 0.755 92.5-149.3 -68.7 -26.3 52.7 18.5 13.5 45 44 A G S+ 0 0 91 -5,-0.3 4,-2.5 2,-0.2 -14,-0.3 0.887 74.5 53.2 -72.9 -40.4 47.6 20.3 15.4 47 46 A X H > S+ 0 0 2 -6,-0.5 4,-2.4 1,-0.2 5,-0.2 0.920 110.8 47.6 -56.8 -44.9 48.1 23.0 18.0 48 47 A E H > S+ 0 0 66 -7,-0.3 4,-2.2 1,-0.2 -2,-0.2 0.890 110.0 53.0 -63.6 -40.1 47.8 25.7 15.3 49 48 A Q H X S+ 0 0 102 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.931 110.3 48.6 -58.6 -45.9 44.7 24.0 13.9 50 49 A A H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 5,-0.3 0.917 111.5 46.7 -63.6 -45.9 43.1 24.1 17.3 51 50 A V H X S+ 0 0 2 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.908 114.6 47.5 -69.0 -35.6 43.8 27.7 18.1 52 51 A N H X S+ 0 0 69 -4,-2.2 4,-2.5 -5,-0.2 -1,-0.2 0.870 110.3 53.4 -68.8 -33.9 42.6 28.8 14.6 53 52 A H H X S+ 0 0 47 -4,-2.1 4,-1.9 -5,-0.2 -2,-0.2 0.959 114.8 39.4 -63.0 -52.4 39.4 26.7 15.0 54 53 A I H X S+ 0 0 1 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.929 115.7 52.2 -67.1 -40.6 38.5 28.3 18.3 55 54 A A H X S+ 0 0 2 -4,-2.5 4,-2.6 -5,-0.3 -2,-0.2 0.916 107.2 53.3 -59.9 -43.6 39.5 31.7 17.1 56 55 A N H X S+ 0 0 112 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.912 111.1 46.7 -55.1 -45.3 37.4 31.4 13.9 57 56 A W H X S+ 0 0 13 -4,-1.9 4,-0.6 1,-0.2 -1,-0.2 0.913 110.9 51.1 -67.8 -43.3 34.3 30.5 16.1 58 57 A C H >< S+ 0 0 0 -4,-2.5 3,-1.1 1,-0.2 -2,-0.2 0.925 108.2 52.6 -61.4 -40.1 35.0 33.4 18.5 59 58 A K H >< S+ 0 0 133 -4,-2.6 3,-0.8 1,-0.3 -1,-0.2 0.847 110.6 47.0 -65.8 -33.9 35.3 35.9 15.6 60 59 A S H 3< S+ 0 0 80 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.492 118.9 41.1 -86.7 -0.9 31.9 34.8 14.2 61 60 A H T << S+ 0 0 14 -3,-1.1 -1,-0.2 -4,-0.6 -2,-0.2 -0.155 88.5 155.4-128.8 35.4 30.3 35.0 17.6 62 61 A A < - 0 0 43 -3,-0.8 3,-0.1 1,-0.1 -3,-0.1 -0.468 38.5-135.0 -79.5 127.9 32.0 38.2 18.8 63 62 A P > - 0 0 4 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 -0.269 54.7 -61.2 -58.3 169.1 30.6 40.6 21.4 64 63 A K T 3 S+ 0 0 140 1,-0.3 22,-0.4 20,-0.1 82,-0.0 -0.225 118.7 0.9 -60.5 132.8 30.7 44.3 20.6 65 64 A G T 3 S+ 0 0 59 1,-0.2 -1,-0.3 -3,-0.1 18,-0.1 0.556 86.1 167.7 75.5 9.6 34.1 45.8 20.0 66 65 A X < - 0 0 34 -3,-1.6 2,-0.5 18,-0.1 18,-0.2 -0.300 22.9-158.9 -65.9 132.9 36.0 42.6 20.6 67 66 A T E -B 83 0B 62 16,-2.5 16,-2.5 2,-0.0 2,-0.4 -0.971 12.8-172.5-102.5 127.6 39.7 42.5 19.6 68 67 A L E +B 82 0B 33 -2,-0.5 2,-0.3 14,-0.2 14,-0.2 -0.981 7.8 170.6-119.4 134.4 40.9 39.0 19.0 69 68 A E E -B 81 0B 112 12,-2.7 12,-2.7 -2,-0.4 2,-0.9 -0.996 34.2-139.4-142.6 137.7 44.6 38.1 18.4 70 69 A I E -B 80 0B 24 -2,-0.3 2,-0.4 10,-0.2 10,-0.2 -0.883 35.8-151.1 -90.2 103.5 46.5 34.9 18.3 71 70 A V E -B 79 0B 14 8,-3.2 8,-2.6 -2,-0.9 2,-0.4 -0.682 14.1-166.7 -83.4 136.0 49.6 36.1 20.2 72 71 A R - 0 0 132 -2,-0.4 2,-0.4 6,-0.2 5,-0.1 -0.985 16.4-176.5-135.9 126.5 52.8 34.4 19.3 73 72 A L > - 0 0 51 -2,-0.4 3,-2.2 4,-0.3 100,-0.0 -0.926 51.1 -80.2-110.7 147.6 56.3 34.3 20.9 74 73 A K T 3 S- 0 0 172 -2,-0.4 3,-0.1 1,-0.3 -1,-0.0 -0.149 110.0 -7.2 -51.5 124.8 59.2 32.5 19.2 75 74 A N T 3 S+ 0 0 107 1,-0.2 2,-0.3 -33,-0.0 -1,-0.3 0.625 109.4 118.2 62.9 14.3 59.1 28.7 19.7 76 75 A R S < S- 0 0 68 -3,-2.2 -1,-0.2 1,-0.1 -3,-0.1 -0.787 75.6 -96.9-107.5 154.8 56.3 29.1 22.2 77 76 A T - 0 0 2 -2,-0.3 -4,-0.3 1,-0.1 84,-0.1 -0.371 53.5-101.8 -58.6 143.9 52.7 27.6 22.0 78 77 A P - 0 0 5 0, 0.0 2,-0.5 0, 0.0 83,-0.3 -0.282 31.0-142.5 -68.6 158.9 50.3 30.3 20.7 79 78 A L E -B 71 0B 2 -8,-2.6 -8,-3.2 81,-0.1 2,-0.6 -0.985 4.4-140.9-129.5 124.2 48.1 32.2 23.0 80 79 A L E -BC 70 159B 0 79,-2.3 79,-2.7 -2,-0.5 2,-0.4 -0.748 26.0-175.8 -87.6 120.4 44.5 33.2 22.2 81 80 A F E -BC 69 158B 8 -12,-2.7 -12,-2.7 -2,-0.6 2,-0.4 -0.955 8.2-180.0-119.2 132.5 43.8 36.7 23.5 82 81 A X E -BC 68 157B 0 75,-2.5 75,-2.3 -2,-0.4 2,-0.5 -0.997 9.4-166.9-130.3 142.9 40.5 38.6 23.5 83 82 A E E -BC 67 156B 29 -16,-2.5 -16,-2.5 -2,-0.4 73,-0.2 -0.991 3.8-173.4-125.0 118.7 39.7 42.1 24.8 84 83 A I E - 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