==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 26-JUN-06 2HG6 . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR A.LEMAK,S.SRISAILAM,A.YEE,J.A.LUKIN,V.Y.OREKHOV, . 106 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7885.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 71 67.0 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 . 17 16.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.9 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 . 14 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 16.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 17 16.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.8 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 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 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 1 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 2 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 M 0 0 172 0, 0.0 2,-0.2 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 17.5 2.4 0.6 -0.9 2 2 A S - 0 0 88 1,-0.1 87,-0.2 0, 0.0 2,-0.2 -0.535 360.0 -80.3 -95.0 166.6 -0.1 3.4 -1.3 3 3 A I - 0 0 60 -2,-0.2 -1,-0.1 86,-0.1 91,-0.1 -0.439 50.4-142.4 -70.7 136.6 0.2 6.5 -3.6 4 4 A T - 0 0 45 1,-0.2 -1,-0.1 -2,-0.2 91,-0.0 -0.249 16.7 -94.6 -93.1-180.0 2.4 9.2 -2.1 5 5 A S > - 0 0 77 -2,-0.1 3,-2.7 90,-0.1 -1,-0.2 -0.028 63.3 -64.7 -81.6-170.6 2.3 13.0 -2.1 6 6 A T G > S+ 0 0 97 1,-0.3 3,-2.7 2,-0.2 4,-0.5 0.719 121.3 84.5 -51.5 -23.7 4.0 15.4 -4.6 7 7 A D G >> + 0 0 117 1,-0.3 4,-2.0 2,-0.2 3,-0.5 0.700 68.9 82.3 -52.4 -20.3 7.3 14.1 -3.1 8 8 A I G <4 S+ 0 0 1 -3,-2.7 4,-0.4 1,-0.2 -1,-0.3 0.835 85.4 56.9 -53.2 -33.9 6.8 11.4 -5.7 9 9 A C G X4 S+ 0 0 32 -3,-2.7 3,-0.8 1,-0.2 -1,-0.2 0.881 107.0 47.1 -65.8 -38.3 8.3 13.9 -8.2 10 10 A Q G X4 S+ 0 0 133 -3,-0.5 3,-2.3 -4,-0.5 4,-0.4 0.837 99.5 67.2 -74.1 -33.4 11.5 14.2 -6.1 11 11 A A G >< S+ 0 0 17 -4,-2.0 3,-0.6 1,-0.3 73,-0.6 0.660 85.8 72.5 -62.7 -15.7 11.8 10.4 -5.6 12 12 A A G < S+ 0 0 0 -3,-0.8 -1,-0.3 -4,-0.4 3,-0.2 0.666 91.4 57.8 -72.7 -15.8 12.6 10.3 -9.4 13 13 A D G < S+ 0 0 126 -3,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.693 89.1 73.8 -84.3 -19.8 15.9 11.8 -8.5 14 14 A A S < S+ 0 0 34 -3,-0.6 -1,-0.2 -4,-0.4 -2,-0.2 0.792 73.0 99.6 -65.9 -28.5 16.8 9.0 -6.2 15 15 A L - 0 0 0 -4,-0.5 2,-0.3 -3,-0.2 67,-0.2 -0.405 57.3-176.0 -62.0 128.7 17.3 6.7 -9.2 16 16 A K + 0 0 116 65,-2.8 2,-0.1 -2,-0.1 -2,-0.1 -0.959 25.1 75.0-132.4 148.0 21.1 6.4 -9.9 17 17 A G - 0 0 8 -2,-0.3 32,-2.8 15,-0.1 2,-0.6 -0.407 64.3-100.1 131.9 154.9 23.2 4.7 -12.5 18 18 A F E -AB 31 48A 55 13,-3.1 13,-3.5 30,-0.3 2,-0.4 -0.926 32.7-156.2-110.6 116.9 24.3 5.0 -16.1 19 19 A V E +AB 30 47A 2 28,-2.7 28,-2.3 -2,-0.6 2,-0.3 -0.770 19.6 167.0 -97.7 133.3 22.4 2.8 -18.6 20 20 A G E -A 29 0A 0 9,-3.6 9,-2.8 -2,-0.4 2,-0.7 -0.991 37.9-112.5-145.4 151.9 24.0 1.8 -21.9 21 21 A F E -A 28 0A 99 -2,-0.3 2,-0.4 21,-0.3 21,-0.3 -0.754 31.2-157.2 -89.9 113.6 23.5 -0.6 -24.7 22 22 A N E >> -A 27 0A 14 5,-2.2 4,-1.3 -2,-0.7 5,-1.1 -0.753 12.6-154.4 -94.1 134.6 26.2 -3.2 -24.8 23 23 A R T 45S+ 0 0 175 17,-0.6 -1,-0.1 -2,-0.4 18,-0.1 0.508 87.3 73.6 -83.2 -5.0 26.9 -5.0 -28.1 24 24 A K T 45S+ 0 0 191 1,-0.1 -1,-0.2 3,-0.1 -3,-0.0 0.925 119.8 10.2 -75.2 -46.6 28.3 -8.0 -26.2 25 25 A T T 45S- 0 0 75 2,-0.2 -2,-0.2 -3,-0.2 -1,-0.1 0.528 102.3-124.9-106.0 -12.5 25.0 -9.3 -24.9 26 26 A G T <5 + 0 0 43 -4,-1.3 2,-0.3 1,-0.3 -3,-0.2 0.937 68.7 110.1 69.6 47.5 22.9 -7.0 -27.1 27 27 A R E - 0 0 57 -15,-0.2 3,-1.2 1,-0.1 4,-0.2 -0.952 53.6-173.0-121.2 112.0 31.3 3.5 -14.5 34 34 A E G > S+ 0 0 107 -2,-0.5 3,-0.9 1,-0.2 -1,-0.1 0.754 87.9 64.1 -69.7 -23.1 31.1 5.5 -17.8 35 35 A D G 3 S+ 0 0 138 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.450 80.9 82.6 -80.8 -0.4 34.7 4.6 -18.4 36 36 A S G < S+ 0 0 63 -3,-1.2 2,-0.5 2,-0.1 -1,-0.2 0.751 82.1 67.3 -78.6 -23.2 33.9 0.9 -18.7 37 37 A F < + 0 0 49 -3,-0.9 -1,-0.0 -4,-0.2 -15,-0.0 -0.849 55.4 170.5-107.0 130.5 32.8 1.2 -22.3 38 38 A G S S- 0 0 57 -2,-0.5 3,-0.5 4,-0.0 -1,-0.1 0.551 70.0 -31.6 -98.7-109.7 35.1 1.9 -25.2 39 39 A M S S+ 0 0 180 1,-0.2 -2,-0.1 3,-0.1 3,-0.0 0.465 122.5 78.4 -95.4 -3.6 34.1 1.7 -28.9 40 40 A D S S+ 0 0 76 1,-0.1 -17,-0.6 2,-0.0 2,-0.4 0.618 96.9 46.2 -80.1 -13.5 31.7 -1.2 -28.3 41 41 A V S S- 0 0 12 -3,-0.5 2,-0.4 -19,-0.1 -1,-0.1 -0.997 84.6-122.5-134.6 131.6 29.1 1.2 -27.0 42 42 A A > - 0 0 57 -2,-0.4 3,-1.7 -21,-0.3 4,-0.3 -0.591 17.8-143.0 -70.5 126.7 27.9 4.5 -28.4 43 43 A D G > S+ 0 0 116 -2,-0.4 3,-1.1 1,-0.3 -1,-0.2 0.766 99.9 64.3 -66.0 -23.6 28.4 7.2 -25.7 44 44 A D G 3 S+ 0 0 159 1,-0.3 -1,-0.3 3,-0.0 -2,-0.0 0.735 98.0 55.9 -68.5 -22.6 25.1 8.8 -26.8 45 45 A S G < S+ 0 0 49 -3,-1.7 2,-0.7 -24,-0.1 -1,-0.3 0.476 88.3 90.9 -89.8 -4.0 23.3 5.6 -25.7 46 46 A I < + 0 0 17 -3,-1.1 -26,-0.2 -4,-0.3 -16,-0.1 -0.850 55.8 160.2 -94.4 116.5 24.8 6.0 -22.2 47 47 A T E -B 19 0A 40 -28,-2.3 -28,-2.7 -2,-0.7 2,-0.3 -1.000 45.4-109.4-141.6 134.7 22.4 8.0 -20.0 48 48 A P E >> -B 18 0A 47 0, 0.0 3,-1.6 0, 0.0 4,-1.4 -0.489 25.5-138.1 -59.1 123.9 21.9 8.5 -16.3 49 49 A T H 3> S+ 0 0 0 -32,-2.8 4,-1.0 -2,-0.3 -33,-0.1 0.700 98.4 75.0 -60.5 -18.1 18.7 6.8 -15.4 50 50 A S H 34 S+ 0 0 36 -33,-0.4 -1,-0.3 1,-0.2 -35,-0.1 0.882 113.0 21.3 -59.3 -40.4 18.0 9.8 -13.2 51 51 A E H X4 S+ 0 0 131 -3,-1.6 3,-1.1 1,-0.1 -2,-0.2 0.482 107.1 83.4-107.1 -7.8 17.2 11.9 -16.2 52 52 A F H 3< S+ 0 0 35 -4,-1.4 -2,-0.2 1,-0.3 -3,-0.2 0.828 86.7 57.1 -65.8 -31.4 16.4 9.0 -18.5 53 53 A V T 3< S+ 0 0 0 -4,-1.0 12,-2.6 -41,-0.2 2,-0.6 0.607 91.9 86.9 -76.9 -11.4 12.9 8.9 -17.2 54 54 A W E < -C 64 0B 37 -3,-1.1 2,-0.6 10,-0.2 10,-0.2 -0.805 60.5-166.2 -95.9 123.1 12.3 12.5 -18.2 55 55 A S E -C 63 0B 49 8,-3.2 8,-3.0 -2,-0.6 2,-0.5 -0.920 13.8-144.1-111.1 107.7 11.1 13.1 -21.7 56 56 A S E +C 62 0B 83 -2,-0.6 6,-0.3 6,-0.3 3,-0.1 -0.590 25.3 170.6 -73.3 117.7 11.5 16.8 -22.8 57 57 A V S S+ 0 0 59 4,-2.1 2,-0.2 -2,-0.5 -1,-0.2 0.643 75.4 20.5 -99.8 -23.0 8.5 17.7 -25.0 58 58 A R S S- 0 0 176 3,-1.8 0, 0.0 1,-0.1 0, 0.0 -0.604 103.3 -84.2-122.6-168.2 9.5 21.4 -24.9 59 59 A D S S+ 0 0 156 -2,-0.2 -1,-0.1 1,-0.2 -3,-0.0 0.993 123.3 6.0 -63.4 -62.8 12.7 23.1 -24.1 60 60 A D S S+ 0 0 69 -3,-0.1 2,-0.7 43,-0.0 43,-0.6 0.297 111.7 96.7-106.5 7.5 12.4 23.2 -20.3 61 61 A V E + D 0 102B 27 41,-0.2 -4,-2.1 39,-0.0 -3,-1.8 -0.871 51.4 180.0-105.4 108.7 9.2 21.2 -20.0 62 62 A M E -CD 56 101B 51 39,-3.2 39,-2.5 -2,-0.7 2,-0.4 -0.857 14.6-152.1-109.2 141.9 9.9 17.5 -19.3 63 63 A R E -CD 55 100B 105 -8,-3.0 -8,-3.2 -2,-0.4 2,-0.7 -0.928 22.4-120.5-111.0 136.1 7.2 14.8 -18.9 64 64 A L E -C 54 0B 6 35,-2.0 2,-1.0 -2,-0.4 35,-0.3 -0.659 21.7-158.3 -76.8 114.0 7.9 11.7 -16.8 65 65 A G > - 0 0 10 -12,-2.6 3,-1.9 -2,-0.7 4,-0.3 -0.807 7.6-172.1 -93.8 99.5 7.6 8.6 -18.9 66 66 A R T > S+ 0 0 86 -2,-1.0 3,-1.2 1,-0.3 4,-0.4 0.679 78.8 75.6 -68.8 -15.3 6.8 5.8 -16.5 67 67 A E T >> S+ 0 0 116 1,-0.3 3,-1.2 2,-0.2 4,-0.6 0.754 81.4 71.3 -63.4 -23.1 7.3 3.3 -19.3 68 68 A Q H X> S+ 0 0 38 -3,-1.9 3,-1.1 1,-0.3 4,-1.0 0.826 85.5 66.5 -60.3 -31.1 11.0 4.0 -18.9 69 69 A L H <> S+ 0 0 9 -3,-1.2 4,-2.0 -4,-0.3 -1,-0.3 0.779 89.4 64.4 -62.3 -27.6 10.7 2.0 -15.6 70 70 A Q H <> S+ 0 0 115 -3,-1.2 4,-1.2 -4,-0.4 -1,-0.3 0.815 97.4 55.4 -66.4 -29.2 10.0 -1.1 -17.6 71 71 A I H X>S+ 0 0 8 -4,-1.0 4,-1.8 1,-0.2 5,-0.6 0.807 104.4 62.4 -75.2 -31.4 14.7 -0.8 -15.5 73 73 A L H 3<5S+ 0 0 100 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.816 94.9 61.7 -60.7 -32.4 12.4 -3.7 -14.9 74 74 A E H 3<5S+ 0 0 146 -4,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.857 105.5 46.0 -60.7 -35.7 14.5 -5.6 -17.5 75 75 A Q H <<5S- 0 0 38 -4,-0.6 -2,-0.2 -3,-0.6 -1,-0.2 0.822 92.2-158.5 -77.5 -34.3 17.4 -5.1 -15.1 76 76 A N T <5 + 0 0 117 -4,-1.8 2,-0.8 1,-0.2 -3,-0.2 0.634 50.0 124.8 68.3 16.0 15.3 -6.2 -12.1 77 77 A I >< + 0 0 49 -5,-0.6 4,-1.8 1,-0.2 5,-0.2 -0.754 25.3 164.2-111.1 86.9 17.6 -4.5 -9.7 78 78 A N H >>S+ 0 0 77 -2,-0.8 5,-2.4 1,-0.2 4,-0.9 0.871 77.8 42.6 -71.8 -39.0 15.4 -2.1 -7.7 79 79 A E H 45S+ 0 0 186 3,-0.2 -1,-0.2 2,-0.2 -2,-0.1 0.804 110.8 56.7 -79.7 -29.6 17.9 -1.5 -4.8 80 80 A R H 45S+ 0 0 112 1,-0.2 -2,-0.2 2,-0.1 -1,-0.2 0.934 117.2 33.4 -66.8 -47.6 20.8 -1.2 -7.2 81 81 A L H <5S- 0 0 0 -4,-1.8 -65,-2.8 -66,-0.1 -1,-0.2 0.681 109.7-129.4 -77.8 -20.2 19.2 1.6 -9.2 82 82 A N T <5 - 0 0 74 -4,-0.9 2,-0.6 -67,-0.2 -3,-0.2 0.988 28.4-166.1 64.8 62.5 17.5 2.8 -6.0 83 83 A I < - 0 0 22 -5,-2.4 -1,-0.2 -68,-0.1 -71,-0.1 -0.733 19.4-125.8 -80.1 118.5 14.0 3.1 -7.3 84 84 A G > - 0 0 13 -2,-0.6 4,-1.6 -73,-0.6 3,-0.4 -0.186 13.1-118.6 -62.3 155.8 11.9 5.0 -4.8 85 85 A E H > S+ 0 0 145 1,-0.2 4,-2.2 2,-0.2 5,-0.3 0.898 117.0 57.1 -63.5 -42.9 8.7 3.6 -3.3 86 86 A P H > S+ 0 0 23 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.799 107.5 51.7 -52.7 -28.2 6.7 6.5 -4.8 87 87 A L H > S+ 0 0 1 -3,-0.4 4,-1.1 2,-0.2 -2,-0.2 0.865 105.0 53.8 -77.4 -37.9 8.2 5.2 -8.1 88 88 A L H < S+ 0 0 77 -4,-1.6 4,-0.3 1,-0.2 3,-0.2 0.895 114.1 41.4 -62.6 -41.7 7.1 1.7 -7.4 89 89 A V H >X S+ 0 0 7 -4,-2.2 4,-2.2 1,-0.2 3,-1.6 0.836 106.5 63.6 -74.9 -32.6 3.5 2.9 -6.9 90 90 A Y H 3< S+ 0 0 2 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.758 91.5 66.1 -63.0 -25.8 3.7 5.3 -9.8 91 91 A L T 3< S+ 0 0 83 -4,-1.1 -1,-0.3 -3,-0.2 -2,-0.2 0.788 116.9 26.7 -64.5 -25.3 4.2 2.2 -12.0 92 92 A R T <4 S- 0 0 144 -3,-1.6 -2,-0.2 1,-0.4 2,-0.2 0.868 134.2 -11.4-100.6 -70.4 0.6 1.3 -11.1 93 93 A R < - 0 0 179 -4,-2.2 -1,-0.4 0, 0.0 2,-0.3 -0.619 63.9-146.2-125.4-175.1 -1.3 4.5 -10.2 94 94 A Q - 0 0 68 -2,-0.2 -91,-0.1 1,-0.1 4,-0.0 -0.979 26.1-150.6-153.2 158.4 -0.4 8.1 -9.6 95 95 A D S S+ 0 0 90 1,-0.4 -1,-0.1 -2,-0.3 3,-0.1 0.826 105.9 39.2 -89.9 -58.4 -1.2 11.4 -7.7 96 96 A L S S- 0 0 61 1,-0.2 -1,-0.4 -91,-0.1 3,-0.2 -0.856 87.9-141.2 -86.5 120.8 0.0 13.5 -10.6 97 97 A P S S+ 0 0 94 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 0.931 90.6 7.8 -48.2 -56.6 -1.1 11.8 -13.8 98 98 A E S S- 0 0 86 -3,-0.1 2,-0.7 -33,-0.1 -33,-0.1 -0.996 85.5-124.4-127.7 124.7 2.1 12.6 -15.5 99 99 A I - 0 0 5 -2,-0.4 -35,-2.0 -35,-0.3 2,-0.5 -0.571 35.7-169.9 -71.9 110.5 5.0 14.1 -13.5 100 100 A T E -D 63 0B 82 -2,-0.7 2,-0.5 -37,-0.2 -37,-0.2 -0.897 11.2-173.2-111.1 129.8 5.8 17.3 -15.3 101 101 A A E +D 62 0B 31 -39,-2.5 -39,-3.2 -2,-0.5 2,-0.3 -0.981 14.3 157.5-124.5 120.8 8.8 19.5 -14.6 102 102 A Q E -D 61 0B 129 -2,-0.5 2,-0.4 -41,-0.2 -41,-0.2 -0.998 18.0-165.1-142.5 141.5 9.3 22.9 -16.2 103 103 A R - 0 0 189 -43,-0.6 2,-0.3 -2,-0.3 -43,-0.0 -0.993 9.3-179.8-130.4 129.1 11.3 25.9 -15.3 104 104 A Q - 0 0 137 -2,-0.4 -2,-0.0 1,-0.1 0, 0.0 -0.908 21.3-167.8-127.6 154.8 11.0 29.4 -16.7 105 105 A L 0 0 176 -2,-0.3 -1,-0.1 0, 0.0 -2,-0.0 0.056 360.0 360.0-128.5 21.4 12.8 32.7 -16.1 106 106 A R 0 0 295 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 0.925 360.0 360.0 -82.7 360.0 10.5 35.0 -17.9