==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 26-JAN-13 2M3V . COMPND 2 MOLECULE: PUTATIVE UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR D.KOVEAL,W.PETI,R.PAGE . 193 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11721.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 122 63.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 4.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 7 3.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 22 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 45 23.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.6 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 2 0 1 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 0 0 PARALLEL 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 26 A G 0 0 73 0, 0.0 2,-1.6 0, 0.0 20,-0.1 0.000 360.0 360.0 360.0-175.4 0.9 -0.1 0.5 2 27 A H + 0 0 193 19,-0.1 2,-0.4 2,-0.1 19,-0.0 -0.583 360.0 138.4 -91.9 73.8 2.7 1.3 -2.5 3 28 A M - 0 0 127 -2,-1.6 2,-1.0 17,-0.0 0, 0.0 -0.971 61.1-112.3-117.4 134.9 -0.2 3.2 -4.0 4 29 A A - 0 0 84 -2,-0.4 2,-1.4 1,-0.1 3,-0.2 -0.554 28.1-160.2 -72.6 101.5 0.3 6.7 -5.4 5 30 A E + 0 0 146 -2,-1.0 -1,-0.1 1,-0.2 3,-0.0 -0.716 64.9 93.9 -87.7 90.5 -1.7 8.9 -3.1 6 31 A T + 0 0 131 -2,-1.4 -1,-0.2 0, 0.0 2,-0.2 -0.022 69.7 88.3-162.8 26.4 -2.1 11.9 -5.3 7 32 A A + 0 0 67 -3,-0.2 -2,-0.0 2,-0.1 0, 0.0 -0.527 55.0 51.6-122.8-176.2 -5.5 11.0 -6.6 8 33 A A S S- 0 0 70 -2,-0.2 3,-0.1 3,-0.1 131,-0.1 0.181 89.3 -64.7 69.3 164.7 -9.2 11.4 -5.6 9 34 A P S S- 0 0 44 0, 0.0 -2,-0.1 0, 0.0 129,-0.0 -0.066 85.2 -47.5 -65.7-176.9 -10.9 14.8 -4.7 10 35 A R S S- 0 0 191 1,-0.2 -2,-0.0 2,-0.0 -3,-0.0 -0.324 98.0 -53.6 -58.0 145.1 -9.9 16.7 -1.6 11 36 A S - 0 0 103 1,-0.1 -1,-0.2 -3,-0.1 5,-0.1 0.183 66.0-126.9 -31.8 104.4 -9.6 14.5 1.5 12 37 A P - 0 0 20 0, 0.0 -1,-0.1 0, 0.0 123,-0.0 -0.331 11.4-155.2 -58.4 129.4 -13.0 12.7 1.8 13 38 A A S S+ 0 0 77 -2,-0.1 3,-0.1 1,-0.1 -2,-0.1 0.793 95.5 46.5 -72.3 -26.5 -14.6 13.0 5.1 14 39 A W S S+ 0 0 51 1,-0.2 2,-0.6 121,-0.0 12,-0.1 0.986 112.0 38.8 -78.1 -74.0 -16.4 9.8 4.3 15 40 A A + 0 0 4 120,-0.1 2,-0.4 10,-0.1 -1,-0.2 -0.711 65.0 162.2 -92.6 117.6 -13.8 7.4 3.0 16 41 A Q E -A 26 0A 72 10,-0.7 10,-2.6 -2,-0.6 2,-0.7 -0.981 47.1-102.8-129.7 142.9 -10.4 7.3 4.6 17 42 A A E +A 25 0A 49 -2,-0.4 8,-0.3 8,-0.3 -2,-0.0 -0.556 39.8 171.8 -68.5 108.6 -7.9 4.6 4.4 18 43 A V E S+ 0 0 66 6,-1.7 7,-0.2 -2,-0.7 -1,-0.2 0.867 80.7 14.4 -84.1 -42.1 -8.1 2.8 7.7 19 44 A D E >> -A 24 0A 35 5,-2.8 5,-2.6 -3,-0.2 4,-0.6 -0.921 61.8-174.6-136.5 107.2 -5.8 0.1 6.5 20 45 A P T 45S+ 0 0 66 0, 0.0 5,-0.1 0, 0.0 -1,-0.1 0.258 78.5 74.6 -82.5 10.8 -3.8 0.7 3.4 21 46 A S T 45S+ 0 0 76 3,-0.1 -19,-0.1 -20,-0.1 20,-0.1 0.895 114.8 16.4 -86.5 -49.8 -2.4 -2.8 3.5 22 47 A I T 45S- 0 0 3 -3,-0.3 14,-2.4 2,-0.1 13,-2.0 0.379 113.0-111.9-100.9 -0.5 -5.6 -4.5 2.3 23 48 A N T <5 + 0 0 20 -4,-0.6 2,-0.6 1,-0.2 -6,-0.0 0.880 58.7 163.0 68.1 44.6 -7.0 -1.2 1.0 24 49 A L E < -A 19 0A 0 -5,-2.6 -5,-2.8 10,-0.2 -6,-1.7 -0.829 13.1-176.7 -97.1 128.9 -9.7 -1.0 3.5 25 50 A Y E -AB 17 33A 37 8,-1.8 8,-0.8 -2,-0.6 2,-0.5 -0.698 31.6-104.9-113.3 167.4 -11.2 2.3 4.0 26 51 A R E +A 16 0A 111 -10,-2.6 -10,-0.7 -2,-0.3 2,-0.3 -0.817 46.6 166.0 -95.7 129.3 -13.8 3.4 6.3 27 52 A M - 0 0 7 -2,-0.5 4,-0.1 4,-0.4 5,-0.0 -0.635 54.8 -33.6-125.2-169.6 -17.0 3.9 4.6 28 53 A S > - 0 0 13 -2,-0.3 2,-2.7 1,-0.2 3,-1.5 -0.317 67.5-115.1 -56.8 126.9 -20.5 4.3 6.1 29 54 A P T 3 S+ 0 0 109 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.094 112.0 64.0 -60.4 28.1 -20.6 2.2 9.4 30 55 A T T 3 S+ 0 0 18 -2,-2.7 2,-0.3 1,-0.4 -2,-0.1 0.086 115.7 17.0-129.2 10.4 -23.2 -0.1 8.0 31 56 A L < - 0 0 0 -3,-1.5 -4,-0.4 -4,-0.1 -1,-0.4 -0.911 65.4-154.8-177.4 151.2 -20.8 -1.4 5.3 32 57 A Y E - c 0 104A 31 71,-2.4 73,-1.8 -2,-0.3 2,-0.4 -0.920 5.0-149.6-134.6 163.7 -17.2 -1.5 4.5 33 58 A R E +Bc 25 105A 2 -8,-0.8 -8,-1.8 -2,-0.3 2,-0.2 -0.993 23.9 148.5-139.6 141.8 -15.0 -1.8 1.4 34 59 A S E - c 0 106A 1 71,-0.7 73,-0.6 -2,-0.4 -11,-0.2 -0.749 29.9-148.8-148.3-167.6 -11.6 -3.3 0.9 35 60 A A S S+ 0 0 2 -13,-2.0 -12,-0.2 1,-0.3 -1,-0.1 0.430 72.5 63.3-138.5 -53.2 -9.7 -5.0 -1.9 36 61 A L - 0 0 43 -14,-2.4 2,-1.8 1,-0.1 -1,-0.3 -0.644 60.3-152.2 -91.0 122.3 -7.2 -7.6 -0.7 37 62 A P + 0 0 51 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.448 38.3 164.5 -83.2 64.5 -8.4 -10.6 1.3 38 63 A N > - 0 0 77 -2,-1.8 3,-1.8 1,-0.1 4,-0.2 -0.612 47.3-126.3 -89.0 147.2 -5.2 -10.9 3.2 39 64 A A G > S+ 0 0 35 1,-0.3 3,-1.0 -2,-0.3 4,-0.2 0.648 105.2 69.9 -67.5 -15.7 -4.9 -13.0 6.3 40 65 A Q G 3 S+ 0 0 151 1,-0.2 4,-0.5 2,-0.1 3,-0.4 0.552 80.8 77.5 -78.5 -4.8 -3.5 -10.1 8.3 41 66 A S G <> + 0 0 6 -3,-1.8 4,-2.7 1,-0.2 3,-0.4 0.711 69.9 88.5 -74.6 -18.2 -6.9 -8.5 8.1 42 67 A V H <> S+ 0 0 19 -3,-1.0 4,-2.0 1,-0.3 -1,-0.2 0.845 87.4 45.7 -52.6 -46.6 -8.3 -10.8 10.8 43 68 A A H > S+ 0 0 53 -3,-0.4 4,-1.5 1,-0.2 -1,-0.3 0.876 114.2 49.3 -65.6 -37.8 -7.3 -8.5 13.7 44 69 A L H > S+ 0 0 36 -4,-0.5 4,-2.1 -3,-0.4 6,-0.2 0.908 107.0 55.2 -69.2 -41.8 -8.7 -5.5 12.0 45 70 A L H X>S+ 0 0 0 -4,-2.7 5,-2.3 1,-0.2 4,-0.7 0.917 105.2 53.2 -57.3 -46.1 -12.0 -7.3 11.2 46 71 A Q H ><5S+ 0 0 94 -4,-2.0 3,-0.7 1,-0.2 -1,-0.2 0.889 109.4 48.7 -57.1 -43.2 -12.4 -8.1 14.9 47 72 A R H 3<5S+ 0 0 216 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.892 114.0 44.6 -65.3 -40.7 -12.0 -4.4 15.9 48 73 A L H 3<5S- 0 0 30 -4,-2.1 -1,-0.2 -5,-0.1 -2,-0.2 0.479 111.9-120.4 -85.2 -3.3 -14.4 -3.2 13.3 49 74 A Q T <<5 + 0 0 137 -4,-0.7 2,-1.4 -3,-0.7 -3,-0.2 0.644 55.5 161.5 69.2 20.5 -16.9 -5.9 14.3 50 75 A V < + 0 0 1 -5,-2.3 -1,-0.2 -6,-0.2 53,-0.1 -0.574 7.1 158.5 -77.2 93.4 -16.6 -7.1 10.7 51 76 A K + 0 0 30 -2,-1.4 20,-3.2 51,-0.8 2,-0.4 0.123 59.4 64.6-101.8 16.1 -17.9 -10.6 11.1 52 77 A T E +d 71 0A 2 50,-0.4 52,-2.9 18,-0.2 2,-0.4 -0.927 59.1 170.3-143.7 114.5 -18.8 -10.9 7.4 53 78 A V E -de 72 104A 2 18,-1.8 20,-1.6 -2,-0.4 2,-0.9 -0.993 28.4-138.4-128.7 129.1 -16.2 -10.8 4.7 54 79 A V + 0 0 18 50,-2.1 2,-0.3 -2,-0.4 52,-0.2 -0.790 49.0 134.6 -87.9 107.1 -16.8 -11.6 1.1 55 80 A S - 0 0 20 -2,-0.9 2,-0.5 18,-0.5 20,-0.1 -0.948 53.1-111.0-147.3 163.7 -13.8 -13.6 -0.1 56 81 A F + 0 0 188 -2,-0.3 2,-0.3 18,-0.1 18,-0.0 -0.892 44.0 151.2-108.1 125.0 -13.2 -16.8 -2.1 57 82 A I - 0 0 63 -2,-0.5 4,-0.1 1,-0.1 -2,-0.1 -0.984 38.6-150.7-148.1 147.0 -12.0 -19.9 -0.5 58 83 A K S S+ 0 0 159 -2,-0.3 -1,-0.1 2,-0.1 3,-0.1 0.891 89.2 39.4 -81.9 -46.8 -12.3 -23.7 -1.1 59 84 A D S S- 0 0 82 1,-0.2 2,-0.2 124,-0.1 -2,-0.1 0.053 114.6 -53.3 -85.8-166.5 -12.0 -24.6 2.5 60 85 A D > - 0 0 3 1,-0.1 3,-2.3 123,-0.0 -1,-0.2 -0.514 42.7-124.1 -76.2 145.6 -13.4 -22.9 5.5 61 86 A D T >> S+ 0 0 0 1,-0.3 4,-2.0 -2,-0.2 3,-1.9 0.692 105.6 79.6 -56.5 -23.0 -12.7 -19.3 6.0 62 87 A R H 3> S+ 0 0 14 1,-0.3 4,-2.5 2,-0.2 128,-0.3 0.717 73.7 80.0 -60.0 -21.2 -11.3 -20.3 9.4 63 88 A A H <4 S+ 0 0 53 -3,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.729 110.8 20.3 -61.1 -25.0 -8.2 -21.3 7.4 64 89 A W H <4 S+ 0 0 42 -3,-1.9 -2,-0.2 -4,-0.1 -22,-0.2 0.641 124.6 54.7-115.9 -25.4 -7.1 -17.6 7.3 65 90 A L H >< S- 0 0 3 -4,-2.0 2,-1.9 1,-0.2 3,-1.1 0.798 82.0-166.7 -74.6 -35.7 -9.2 -16.2 10.2 66 91 A G T 3< S- 0 0 5 -4,-2.5 124,-2.3 1,-0.3 125,-0.4 -0.537 74.1 -7.1 87.0 -79.3 -7.8 -18.7 12.6 67 92 A Q T 3 S+ 0 0 98 -2,-1.9 -1,-0.3 122,-0.2 -5,-0.1 0.375 101.6 116.5-128.2 -2.8 -10.1 -18.4 15.5 68 93 A A < - 0 0 1 -3,-1.1 2,-1.3 -6,-0.1 -3,-0.1 -0.580 61.0-142.1 -75.6 121.4 -12.1 -15.4 14.4 69 94 A P + 0 0 113 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.083 49.7 146.1 -78.5 42.2 -15.8 -16.4 13.9 70 95 A V - 0 0 5 -2,-1.3 2,-0.7 -9,-0.1 -18,-0.2 -0.538 47.1-131.2 -78.5 138.5 -16.1 -14.2 10.9 71 96 A R E -d 52 0A 77 -20,-3.2 -18,-1.8 -2,-0.2 2,-0.5 -0.879 12.4-155.5 -99.7 112.2 -18.4 -15.5 8.2 72 97 A V E -d 53 0A 5 -2,-0.7 2,-0.4 -20,-0.2 -18,-0.2 -0.755 20.2-152.4 -80.3 127.8 -17.0 -15.4 4.8 73 98 A V - 0 0 12 -20,-1.6 2,-0.7 -2,-0.5 -18,-0.5 -0.875 14.5-136.0-114.7 141.8 -19.8 -15.3 2.4 74 99 A S - 0 0 81 -2,-0.4 -18,-0.1 -20,-0.1 -20,-0.1 -0.845 30.0-163.2 -92.4 111.3 -20.2 -16.5 -1.1 75 100 A L - 0 0 23 -2,-0.7 15,-0.1 2,-0.2 11,-0.0 -0.726 30.3-128.1-100.0 150.2 -22.0 -13.8 -3.1 76 101 A P S S+ 0 0 34 0, 0.0 2,-1.6 0, 0.0 7,-0.1 0.575 87.6 102.3 -65.4 -11.0 -23.7 -14.0 -6.6 77 102 A T + 0 0 28 4,-0.1 -2,-0.2 9,-0.1 2,-0.1 -0.631 54.5 163.5 -78.3 91.5 -21.5 -11.1 -7.4 78 103 A H > - 0 0 106 -2,-1.6 3,-0.6 29,-0.0 4,-0.4 -0.372 60.4 -80.1 -96.5-178.5 -19.0 -12.9 -9.4 79 104 A A T 3 S- 0 0 61 1,-0.3 2,-0.1 -2,-0.1 -2,-0.0 0.923 125.1 -8.7 -49.7 -48.3 -16.4 -11.5 -11.9 80 105 A D T 3 S+ 0 0 143 77,-0.0 -1,-0.3 1,-0.0 -3,-0.1 -0.595 108.5 95.8-152.3 81.3 -19.3 -11.4 -14.3 81 106 A R < + 0 0 148 -3,-0.6 2,-0.2 -2,-0.1 5,-0.2 0.475 44.0 124.8-126.7 -28.8 -22.4 -13.1 -13.1 82 107 A V + 0 0 16 -4,-0.4 2,-0.2 4,-0.1 75,-0.1 -0.096 31.8 165.8 -57.1 101.4 -24.4 -10.3 -11.7 83 108 A D > - 0 0 36 -2,-0.2 4,-2.6 -7,-0.1 75,-0.2 -0.451 57.5 -89.1 -97.3-177.6 -27.7 -10.2 -13.4 84 109 A D H > S+ 0 0 54 73,-0.3 4,-0.8 1,-0.2 79,-0.1 0.791 133.6 45.7 -64.8 -26.5 -30.8 -8.2 -12.3 85 110 A A H > S+ 0 0 18 77,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.861 111.5 50.6 -83.6 -36.0 -31.7 -11.3 -10.2 86 111 A E H > S+ 0 0 43 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.857 103.1 59.6 -71.4 -35.3 -28.2 -11.7 -8.8 87 112 A V H X S+ 0 0 12 -4,-2.6 4,-2.9 2,-0.2 3,-0.2 0.923 107.4 45.6 -60.3 -42.4 -28.0 -8.1 -7.7 88 113 A L H X S+ 0 0 90 -4,-0.8 4,-3.0 1,-0.3 5,-0.2 0.896 108.4 57.4 -65.9 -41.0 -31.0 -8.5 -5.4 89 114 A S H < S+ 0 0 43 -4,-1.6 4,-0.3 1,-0.2 -1,-0.3 0.817 110.4 43.3 -59.7 -35.3 -29.5 -11.7 -4.2 90 115 A V H >X S+ 0 0 0 -4,-1.7 4,-1.7 -3,-0.2 3,-1.5 0.959 111.9 54.0 -72.0 -52.4 -26.5 -9.7 -3.2 91 116 A L H 3X S+ 0 0 25 -4,-2.9 4,-1.7 1,-0.3 -2,-0.2 0.889 109.4 46.4 -50.0 -52.0 -28.6 -6.8 -1.7 92 117 A R H 3< S+ 0 0 144 -4,-3.0 4,-0.3 1,-0.2 -1,-0.3 0.628 107.6 60.0 -71.0 -11.6 -30.6 -9.0 0.6 93 118 A Q H X> S+ 0 0 36 -3,-1.5 4,-2.1 -4,-0.3 3,-0.5 0.939 106.6 41.9 -82.3 -46.9 -27.5 -10.9 1.8 94 119 A L H 3X S+ 0 0 0 -4,-1.7 4,-2.4 1,-0.3 -2,-0.2 0.921 112.5 53.2 -72.0 -38.1 -25.6 -7.9 3.3 95 120 A Q H 3< S+ 0 0 54 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.710 110.3 50.6 -68.5 -18.1 -28.7 -6.4 4.9 96 121 A A H X4 S+ 0 0 46 -3,-0.5 3,-1.0 -4,-0.3 -1,-0.2 0.867 111.6 45.8 -81.2 -39.6 -29.2 -9.8 6.5 97 122 A A H >X S+ 0 0 3 -4,-2.1 3,-2.3 1,-0.2 4,-0.5 0.787 97.3 74.8 -72.9 -27.8 -25.7 -10.0 7.7 98 123 A E T 3< S+ 0 0 28 -4,-2.4 3,-0.2 1,-0.3 -1,-0.2 0.658 80.2 73.3 -57.7 -17.4 -26.0 -6.3 9.0 99 124 A R T <4 S+ 0 0 190 -3,-1.0 -1,-0.3 1,-0.2 -2,-0.2 0.674 101.0 42.4 -72.3 -17.0 -28.1 -7.7 11.8 100 125 A E T <4 S- 0 0 138 -3,-2.3 -1,-0.2 1,-0.5 -2,-0.2 0.495 130.5 -76.6-104.3 -12.7 -24.9 -9.1 13.3 101 126 A G S < S- 0 0 16 -4,-0.5 -1,-0.5 -3,-0.2 -52,-0.1 -0.800 76.6 -17.3 141.8-176.5 -22.8 -6.0 12.6 102 127 A P - 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