==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 28-OCT-08 3F1T . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN Q9I3C8_PSEAE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR S.M.VOROBIEV,Y.CHEN,M.ABASHIDZE,J.SEETHARAMAN,D.WANG,E.L.FOO . 544 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20597.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 373 68.6 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 . 183 33.6 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 . 8 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 16 2.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 59 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 101 18.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.7 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 1 0 0 0 1 2 1 0 1 3 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 . 3 1 0 2 8 0 4 8 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 2 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 4 A N > 0 0 152 0, 0.0 4,-0.9 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -57.1 55.4 21.5 30.4 2 5 A P H > + 0 0 87 0, 0.0 4,-2.2 0, 0.0 3,-0.2 0.854 360.0 51.7 -65.5 -39.6 54.8 24.9 28.9 3 6 A L H > S+ 0 0 37 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.850 104.1 58.4 -59.7 -37.4 58.3 25.7 30.3 4 7 A L H > S+ 0 0 55 23,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.874 110.1 42.0 -59.8 -37.6 59.5 22.6 28.5 5 8 A E H X S+ 0 0 89 -4,-0.9 4,-1.5 2,-0.2 -2,-0.2 0.834 114.9 49.0 -82.7 -35.6 58.3 24.1 25.2 6 9 A R H X S+ 0 0 43 -4,-2.2 4,-2.4 2,-0.2 3,-0.2 0.949 111.3 50.7 -68.0 -43.6 59.6 27.6 25.9 7 10 A A H X S+ 0 0 0 -4,-3.1 4,-2.4 1,-0.2 -2,-0.2 0.894 110.6 48.9 -57.2 -45.7 62.9 26.2 27.0 8 11 A R H X S+ 0 0 114 -4,-1.6 4,-1.8 -5,-0.2 -1,-0.2 0.812 111.1 50.6 -61.6 -37.4 63.2 24.2 23.8 9 12 A R H < S+ 0 0 123 -4,-1.5 4,-0.4 -3,-0.2 -2,-0.2 0.805 109.1 50.3 -73.7 -35.2 62.2 27.3 21.7 10 13 A F H >< S+ 0 0 7 -4,-2.4 3,-1.8 1,-0.2 -2,-0.2 0.987 113.3 47.8 -55.8 -56.4 64.9 29.4 23.4 11 14 A L H >< S+ 0 0 9 -4,-2.4 3,-1.8 1,-0.3 -2,-0.2 0.784 104.5 56.5 -55.9 -45.2 67.5 26.7 22.7 12 15 A S T 3< S+ 0 0 69 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.1 0.632 98.1 65.4 -67.4 -13.8 66.6 26.2 19.0 13 16 A A T < S+ 0 0 43 -3,-1.8 2,-0.7 -4,-0.4 169,-0.3 0.491 86.2 85.7 -78.7 -10.7 67.3 29.9 18.6 14 17 A L < - 0 0 7 -3,-1.8 4,-0.3 -4,-0.2 167,-0.1 -0.880 57.3-172.8-102.1 109.0 70.9 29.2 19.4 15 18 A R S >> S+ 0 0 59 -2,-0.7 4,-1.7 165,-0.3 3,-1.2 0.904 84.3 50.7 -62.0 -57.3 73.0 28.2 16.4 16 19 A H H 3> S+ 0 0 16 1,-0.3 4,-1.3 2,-0.2 -1,-0.2 0.905 110.7 52.3 -53.5 -36.6 76.3 27.3 18.2 17 20 A C H 3>>S+ 0 0 3 2,-0.2 5,-1.7 1,-0.2 4,-0.8 0.619 100.5 62.4 -69.9 -22.3 74.2 25.1 20.5 18 21 A Q H X45S+ 0 0 98 -3,-1.2 3,-0.8 -4,-0.3 -2,-0.2 0.938 103.1 48.7 -66.2 -49.3 72.7 23.4 17.5 19 22 A V H 3<5S+ 0 0 56 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.851 111.3 50.6 -50.8 -41.0 76.1 22.2 16.6 20 23 A L H 3<5S- 0 0 0 -4,-1.3 -1,-0.2 -5,-0.2 20,-0.2 0.708 103.6-135.8 -80.0 -14.4 76.5 21.0 20.2 21 24 A G T <<5 - 0 0 26 -3,-0.8 -3,-0.2 -4,-0.8 -2,-0.1 0.839 33.5-179.3 63.6 36.3 73.2 19.2 20.0 22 25 A L < - 0 0 12 -5,-1.7 2,-0.3 14,-0.1 14,-0.2 -0.353 4.7-167.2 -62.3 141.4 72.1 20.4 23.5 23 26 A T E -A 35 0A 51 12,-1.6 12,-2.5 -12,-0.0 2,-0.5 -0.982 24.1-115.5-129.0 148.6 68.7 19.1 24.6 24 27 A V E +A 34 0A 21 -2,-0.3 10,-0.2 10,-0.2 3,-0.1 -0.731 28.5 179.0 -74.2 123.4 66.4 20.1 27.4 25 28 A E E - 0 0 86 8,-2.4 2,-0.3 -2,-0.5 9,-0.2 0.805 64.7 -9.7 -93.8 -34.5 66.0 17.3 29.9 26 29 A A E -A 33 0A 41 7,-1.4 7,-2.4 -23,-0.1 -1,-0.3 -0.986 48.9-167.5-162.4 154.9 63.7 19.0 32.4 27 30 A A E +A 32 0A 10 -2,-0.3 5,-0.2 5,-0.2 -23,-0.2 -0.639 24.3 155.2-154.9 95.0 62.2 22.3 33.3 28 31 A D - 0 0 80 3,-2.1 -2,-0.0 -2,-0.2 5,-0.0 -0.107 63.5 -98.5 -97.7-168.5 60.4 22.9 36.6 29 32 A E S S+ 0 0 99 1,-0.1 3,-0.1 -2,-0.0 -1,-0.1 0.339 126.6 65.8 -80.5 -1.5 59.6 25.8 38.9 30 33 A K S S- 0 0 147 1,-0.3 2,-0.3 72,-0.0 -1,-0.1 0.727 117.9 -88.6 -93.2 -19.8 62.7 24.2 40.5 31 34 A G - 0 0 5 71,-0.1 -3,-2.1 2,-0.0 2,-0.4 -0.945 46.5 -60.7 140.7-165.3 65.1 25.1 37.6 32 35 A L E -AB 27 101A 0 69,-2.9 69,-2.1 -2,-0.3 2,-0.4 -0.929 27.6-164.6-126.9 136.8 66.4 23.9 34.3 33 36 A T E -AB 26 100A 20 -7,-2.4 -8,-2.4 -2,-0.4 -7,-1.4 -0.985 10.5-179.0-118.5 131.7 68.4 20.8 33.1 34 37 A L E -AB 24 99A 0 65,-2.4 65,-2.4 -2,-0.4 2,-0.4 -0.833 15.8-140.4-120.6 159.0 70.2 20.6 29.8 35 38 A R E -AB 23 98A 56 -12,-2.5 -12,-1.6 -2,-0.3 63,-0.2 -0.991 5.5-161.8-125.2 128.3 72.2 17.7 28.3 36 39 A L E - B 0 97A 0 61,-3.7 61,-2.7 -2,-0.4 2,-0.3 -0.939 21.2-136.9-103.6 111.9 75.4 18.0 26.2 37 40 A P > - 0 0 17 0, 0.0 3,-1.2 0, 0.0 4,-0.4 -0.540 10.8-137.9 -69.0 128.0 76.1 14.8 24.3 38 41 A Y G > S+ 0 0 74 -2,-0.3 3,-1.1 1,-0.2 14,-0.2 0.818 98.7 60.9 -58.9 -28.0 79.8 13.9 24.6 39 42 A S G > S+ 0 0 66 1,-0.3 3,-0.6 2,-0.2 -1,-0.2 0.788 98.8 54.9 -75.5 -22.2 80.1 13.0 20.9 40 43 A Q G < S+ 0 0 101 -3,-1.2 -1,-0.3 -20,-0.2 -2,-0.2 0.508 113.4 41.6 -86.9 -4.4 79.1 16.5 19.7 41 44 A A G < S+ 0 0 1 -3,-1.1 11,-3.3 -4,-0.4 -1,-0.2 -0.108 76.6 146.4-140.0 36.5 81.8 18.3 21.7 42 45 A I B < -L 51 0B 30 -3,-0.6 2,-0.5 9,-0.3 111,-0.3 -0.505 33.6-153.5 -76.6 139.7 85.0 16.2 21.4 43 46 A I - 0 0 29 7,-2.1 2,-0.3 -2,-0.2 7,-0.2 -0.991 67.1 -18.4-109.7 120.9 88.5 17.8 21.4 44 47 A G S S+ 0 0 59 -2,-0.5 -2,-0.1 107,-0.4 8,-0.0 -0.610 121.8 19.6 92.4-144.4 91.0 15.6 19.6 45 48 A N - 0 0 84 -2,-0.3 5,-0.4 1,-0.2 3,-0.3 -0.462 57.6-151.5 -64.2 122.6 90.6 11.9 18.9 46 49 A P S S+ 0 0 89 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 0.825 94.9 71.0 -61.8 -25.8 86.9 10.8 19.1 47 50 A E S S+ 0 0 156 2,-0.1 2,-0.1 -3,-0.0 -3,-0.0 0.918 94.2 60.3 -52.5 -55.0 88.3 7.4 20.1 48 51 A S S S- 0 0 51 -3,-0.3 46,-0.1 1,-0.1 -6,-0.0 -0.368 96.8-120.6 -67.8 164.1 89.3 8.9 23.5 49 52 A G + 0 0 2 -2,-0.1 45,-1.7 44,-0.1 46,-0.3 0.264 55.5 147.8 -93.9 10.9 86.4 10.3 25.4 50 53 A V - 0 0 68 -5,-0.4 -7,-2.1 43,-0.2 2,-0.4 -0.325 29.1-163.8 -82.3 115.3 87.5 13.9 25.7 51 54 A V B -L 42 0B 13 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.3 -0.768 30.5-111.0 -87.0 132.1 84.9 16.6 25.9 52 55 A H >> - 0 0 31 -11,-3.3 3,-1.8 -2,-0.4 4,-1.5 -0.517 15.4-139.3 -61.5 129.1 86.1 20.2 25.2 53 56 A G H 3> S+ 0 0 25 -2,-0.3 4,-2.4 1,-0.3 -1,-0.2 0.809 103.9 64.1 -56.7 -30.3 85.9 22.2 28.4 54 57 A G H 3> S+ 0 0 4 2,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.766 98.9 52.3 -68.5 -26.0 84.6 25.0 26.1 55 58 A A H <> S+ 0 0 0 -3,-1.8 4,-2.7 -14,-0.2 -1,-0.2 0.929 107.5 51.1 -73.1 -45.0 81.5 23.0 25.3 56 59 A I H X S+ 0 0 3 -4,-1.5 4,-2.6 1,-0.2 -2,-0.2 0.942 109.4 52.2 -57.1 -40.2 80.8 22.5 29.0 57 60 A T H X S+ 0 0 2 -4,-2.4 4,-2.8 1,-0.3 -1,-0.2 0.879 109.6 47.6 -61.4 -47.6 81.1 26.2 29.4 58 61 A T H X S+ 0 0 5 -4,-1.6 4,-2.3 2,-0.2 -1,-0.3 0.863 110.3 54.0 -55.8 -43.5 78.7 26.8 26.6 59 62 A L H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.945 112.7 42.9 -59.0 -45.3 76.4 24.3 28.2 60 63 A X H X S+ 0 0 1 -4,-2.6 4,-2.8 2,-0.2 5,-0.3 0.942 112.6 50.2 -70.9 -47.7 76.5 26.1 31.5 61 64 A D H X S+ 0 0 5 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.923 115.4 46.0 -54.6 -43.6 76.1 29.6 30.1 62 65 A T H X S+ 0 0 6 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.844 110.2 51.9 -68.9 -41.5 73.1 28.4 28.1 63 66 A T H X S+ 0 0 2 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.940 114.6 42.5 -60.0 -52.7 71.6 26.5 31.1 64 67 A C H X S+ 0 0 0 -4,-2.8 4,-0.6 2,-0.2 -2,-0.2 0.943 115.3 52.3 -51.8 -51.6 71.8 29.7 33.2 65 68 A G H >< S+ 0 0 9 -4,-2.7 3,-0.5 -5,-0.3 13,-0.3 0.882 115.4 38.6 -56.3 -43.8 70.6 31.7 30.3 66 69 A I H >< S+ 0 0 0 -4,-2.8 3,-2.5 1,-0.2 -1,-0.2 0.770 97.6 76.8 -81.3 -24.6 67.5 29.6 29.6 67 70 A S H >< S+ 0 0 1 -4,-2.0 3,-2.2 1,-0.3 36,-0.3 0.720 75.5 81.4 -63.1 -15.6 66.7 29.0 33.3 68 71 A T G XX S+ 0 0 0 -4,-0.6 4,-2.1 -3,-0.5 3,-1.4 0.746 77.0 71.5 -57.4 -22.5 65.3 32.5 33.3 69 72 A V G <4 S+ 0 0 2 -3,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.586 82.6 70.3 -72.3 -10.3 62.1 31.0 31.7 70 73 A C G <4 S+ 0 0 25 -3,-2.2 -1,-0.3 -4,-0.2 -2,-0.2 0.423 114.0 24.8 -83.0 -3.2 61.3 29.4 35.0 71 74 A V T <4 S+ 0 0 60 -3,-1.4 -2,-0.2 1,-0.2 -1,-0.1 0.528 104.4 81.1-133.7 -29.2 60.5 32.8 36.5 72 75 A L < - 0 0 4 -4,-2.1 -1,-0.2 1,-0.2 4,-0.1 -0.786 60.4-162.4 -77.0 115.7 59.6 35.0 33.5 73 76 A P S S+ 0 0 119 0, 0.0 -1,-0.2 0, 0.0 2,-0.2 0.904 79.2 53.6 -65.6 -39.0 55.9 34.1 32.7 74 77 A D S S- 0 0 122 -3,-0.1 2,-0.6 1,-0.0 -3,-0.1 -0.509 99.4-104.9 -87.0 163.3 56.4 35.7 29.2 75 78 A F + 0 0 49 -2,-0.2 2,-0.3 2,-0.0 -6,-0.0 -0.812 52.6 144.0 -97.0 119.8 59.2 34.6 26.9 76 79 A E - 0 0 58 -2,-0.6 2,-0.7 -4,-0.1 -4,-0.1 -0.970 47.0-118.4-143.5 159.4 62.2 36.9 26.4 77 80 A I - 0 0 61 -2,-0.3 -11,-0.1 -9,-0.0 -12,-0.0 -0.882 27.7-150.0-101.2 116.8 66.0 36.5 25.9 78 81 A C - 0 0 6 -2,-0.7 57,-0.2 -13,-0.3 3,-0.1 -0.719 13.5-132.4 -94.1 110.6 67.9 38.1 28.8 79 82 A P - 0 0 74 0, 0.0 55,-2.8 0, 0.0 2,-0.2 -0.169 32.4 -97.8 -56.5 156.0 71.4 39.4 27.8 80 83 A T E +C 133 0A 13 53,-0.2 53,-0.2 1,-0.2 3,-0.1 -0.521 39.4 172.3 -84.2 132.7 74.3 38.5 30.0 81 84 A L E S- 0 0 5 51,-3.0 144,-2.5 1,-0.4 2,-0.3 0.749 70.4 -4.9 -99.7 -44.1 75.5 40.9 32.7 82 85 A D E -CD 132 224A 4 50,-1.8 50,-2.0 142,-0.2 -1,-0.4 -0.993 59.4-176.7-151.8 149.4 78.0 38.7 34.5 83 86 A L E -CD 131 223A 3 140,-2.6 140,-2.5 -2,-0.3 2,-0.4 -0.991 3.6-178.2-154.8 126.4 79.2 35.1 34.5 84 87 A R E -CD 130 222A 6 46,-2.7 46,-2.2 -2,-0.3 2,-0.4 -0.994 1.8-176.6-123.4 134.3 81.6 33.0 36.5 85 88 A I E -CD 129 221A 1 136,-2.4 136,-2.5 -2,-0.4 2,-0.4 -0.996 3.2-174.1-123.5 126.3 82.4 29.4 35.9 86 89 A D E -CD 128 220A 0 42,-3.0 42,-2.8 -2,-0.4 2,-0.4 -0.986 16.0-143.2-125.7 118.8 84.8 27.5 38.2 87 90 A Y E -C 127 0A 14 132,-2.9 40,-0.3 -2,-0.4 39,-0.1 -0.705 14.5-175.2 -84.3 130.9 85.9 24.0 37.4 88 91 A X - 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