==== 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 30-JUN-06 2HJS . COMPND 2 MOLECULE: USG-1 PROTEIN HOMOLOG; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR M.E.CUFF,E.EVDOKIMOVA,M.KUDRITSKA,A.EDWARDS,A.SAVCHENKO,A.JO . 334 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15514.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 236 70.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 38 11.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 36 10.8 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 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 . 25 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 81 24.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 3.9 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 1 0 0 0 0 0 1 0 1 3 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 2 3 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 PARALLEL BRIDGES PER LADDER . 2 0 0 1 1 0 0 1 1 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 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 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 3 A Q 0 0 231 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -85.1 -37.9 71.9 -15.6 2 4 A P - 0 0 84 0, 0.0 2,-0.7 0, 0.0 27,-0.1 -0.466 360.0-133.9 -66.1 138.9 -36.4 68.5 -14.5 3 5 A L - 0 0 41 25,-0.5 27,-2.9 -2,-0.2 2,-0.4 -0.830 19.8-167.4-101.2 112.4 -32.9 68.9 -13.0 4 6 A N - 0 0 28 -2,-0.7 62,-2.2 25,-0.2 63,-2.1 -0.806 6.7-161.8-102.8 138.3 -30.3 66.5 -14.2 5 7 A V E -ab 32 67A 0 26,-2.6 28,-2.5 -2,-0.4 2,-0.4 -0.909 11.1-163.7-124.8 138.1 -27.1 66.2 -12.3 6 8 A A E -ab 33 68A 0 61,-2.0 63,-2.4 -2,-0.4 2,-0.5 -0.954 6.8-157.6-110.6 142.0 -23.7 64.9 -13.2 7 9 A V E > -ab 34 69A 0 26,-2.9 28,-3.1 -2,-0.4 3,-0.7 -0.949 10.7-159.9-118.3 109.5 -21.0 64.1 -10.5 8 10 A V E 3 S+ab 35 70A 0 61,-2.8 63,-3.0 -2,-0.5 28,-0.2 -0.745 79.8 23.4 -88.6 126.2 -17.6 64.1 -12.1 9 11 A G T > S+ 0 0 7 26,-2.2 3,-1.6 -2,-0.4 6,-0.5 0.770 76.3 159.4 86.6 34.0 -15.0 62.2 -10.0 10 12 A A T < + 0 0 0 25,-2.2 9,-0.2 -3,-0.7 26,-0.1 0.707 66.3 55.0 -65.5 -24.4 -17.7 60.2 -8.4 11 13 A T T 3 S+ 0 0 20 24,-0.3 -1,-0.3 4,-0.1 25,-0.1 0.521 88.7 95.3 -91.3 -7.2 -15.4 57.3 -7.3 12 14 A G S <> S- 0 0 26 -3,-1.6 4,-3.0 59,-0.1 5,-0.2 -0.322 92.2-104.8 -75.5 169.9 -13.0 59.7 -5.4 13 15 A S H > S+ 0 0 31 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.937 122.1 40.9 -68.0 -41.9 -13.4 60.1 -1.7 14 16 A V H > S+ 0 0 35 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.925 115.7 51.7 -68.3 -41.9 -15.0 63.6 -2.0 15 17 A G H > S+ 0 0 0 -6,-0.5 4,-2.2 56,-0.5 -2,-0.2 0.918 110.1 49.3 -59.1 -45.6 -17.1 62.5 -5.0 16 18 A E H X S+ 0 0 103 -4,-3.0 4,-2.1 -7,-0.2 -1,-0.2 0.884 111.2 48.4 -59.8 -43.9 -18.4 59.5 -3.1 17 19 A A H X S+ 0 0 25 -4,-1.8 4,-2.1 -5,-0.2 -1,-0.2 0.912 110.5 52.8 -64.7 -38.2 -19.3 61.7 -0.1 18 20 A L H X S+ 0 0 0 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.903 107.8 49.6 -68.0 -39.8 -21.1 64.2 -2.4 19 21 A V H X S+ 0 0 2 -4,-2.2 4,-1.4 2,-0.2 -1,-0.2 0.920 110.3 50.9 -63.5 -44.6 -23.2 61.4 -4.0 20 22 A G H X S+ 0 0 34 -4,-2.1 4,-2.9 1,-0.2 -2,-0.2 0.887 109.5 51.7 -59.5 -39.0 -24.2 60.1 -0.6 21 23 A L H X S+ 0 0 1 -4,-2.1 4,-2.3 1,-0.2 6,-0.2 0.835 102.8 57.5 -67.5 -34.9 -25.2 63.7 0.4 22 24 A L H <>S+ 0 0 2 -4,-1.8 5,-2.4 2,-0.2 -1,-0.2 0.874 114.0 40.5 -58.1 -37.6 -27.4 64.1 -2.7 23 25 A D H ><5S+ 0 0 65 -4,-1.4 3,-1.8 3,-0.2 -2,-0.2 0.967 115.9 48.8 -77.1 -53.8 -29.3 61.1 -1.5 24 26 A E H 3<5S+ 0 0 111 -4,-2.9 -2,-0.2 1,-0.3 -3,-0.2 0.804 116.2 42.6 -50.1 -42.9 -29.3 62.0 2.3 25 27 A R T 3<5S- 0 0 90 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.303 109.1-121.8 -93.7 7.2 -30.5 65.5 1.7 26 28 A D T < 5 - 0 0 136 -3,-1.8 -3,-0.2 1,-0.2 -4,-0.1 0.889 31.0-158.6 48.9 49.2 -33.1 64.5 -1.0 27 29 A F < - 0 0 13 -5,-2.4 2,-2.0 -6,-0.2 -1,-0.2 -0.332 22.0-120.5 -55.5 130.8 -31.6 66.7 -3.6 28 30 A P + 0 0 84 0, 0.0 -25,-0.5 0, 0.0 -1,-0.2 -0.178 58.8 145.8 -80.5 53.2 -34.4 67.2 -6.2 29 31 A L - 0 0 33 -2,-2.0 -25,-0.2 -7,-0.1 3,-0.1 -0.464 39.8-158.3 -87.0 158.0 -32.7 65.7 -9.2 30 32 A H S S+ 0 0 108 -27,-2.9 2,-0.4 1,-0.4 -26,-0.2 0.870 80.6 13.2 -94.7 -69.4 -34.4 63.8 -12.0 31 33 A R - 0 0 155 -28,-0.1 -26,-2.6 2,-0.0 2,-0.4 -0.890 68.1-155.3-112.1 141.6 -31.5 61.8 -13.5 32 34 A L E -a 5 0A 22 -2,-0.4 2,-0.5 -28,-0.2 -26,-0.2 -0.971 5.7-166.4-113.5 129.6 -28.1 61.4 -11.9 33 35 A H E -a 6 0A 57 -28,-2.5 -26,-2.9 -2,-0.4 2,-0.5 -0.970 5.9-156.7-119.8 119.2 -24.9 60.6 -13.9 34 36 A L E -a 7 0A 3 -2,-0.5 21,-3.0 19,-0.5 2,-0.3 -0.820 19.0-179.0 -95.3 127.4 -21.8 59.4 -12.2 35 37 A L E +ac 8 55A 6 -28,-3.1 -26,-2.2 -2,-0.5 -25,-2.2 -0.935 12.5 155.6-131.7 150.9 -18.5 60.0 -14.1 36 38 A A E - c 0 56A 4 19,-2.2 21,-2.8 -2,-0.3 22,-0.3 -0.897 50.0 -66.3-152.0 179.7 -14.8 59.4 -13.7 37 39 A S >> - 0 0 36 -2,-0.3 4,-1.6 19,-0.2 3,-1.1 -0.444 58.8 -97.8 -70.5 151.3 -11.7 59.0 -15.7 38 40 A A T 34 S+ 0 0 58 1,-0.3 -1,-0.1 2,-0.2 18,-0.1 0.741 123.0 69.5 -41.8 -32.3 -11.5 55.9 -18.0 39 41 A E T 34 S+ 0 0 167 1,-0.2 -1,-0.3 3,-0.0 17,-0.0 0.969 111.5 26.4 -41.3 -68.2 -9.4 54.4 -15.1 40 42 A S T X4 S+ 0 0 34 -3,-1.1 3,-1.3 15,-0.1 -2,-0.2 0.575 96.1 119.5 -80.7 -15.5 -12.5 54.2 -12.8 41 43 A A T 3< + 0 0 28 -4,-1.6 14,-0.2 1,-0.2 3,-0.1 -0.159 64.5 36.0 -54.7 146.0 -15.1 53.9 -15.5 42 44 A G T 3 S+ 0 0 38 12,-3.0 -1,-0.2 1,-0.4 2,-0.2 0.197 86.7 114.2 96.9 -15.0 -17.3 50.8 -15.5 43 45 A Q < - 0 0 99 -3,-1.3 11,-3.0 11,-0.1 -1,-0.4 -0.499 61.1-122.3 -87.5 160.6 -17.6 50.2 -11.8 44 46 A R E -G 53 0B 149 9,-0.2 2,-0.3 -2,-0.2 9,-0.2 -0.731 21.2-168.2-107.8 151.6 -20.9 50.5 -9.8 45 47 A X E -G 52 0B 26 7,-2.2 7,-3.1 -2,-0.3 2,-0.2 -0.995 24.8-112.0-137.2 146.1 -21.9 52.7 -6.9 46 48 A G E +G 51 0B 61 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.495 36.0 167.6 -74.1 138.8 -24.9 52.8 -4.6 47 49 A F E > S-G 50 0B 29 3,-2.7 3,-2.1 -2,-0.2 -27,-0.1 -0.869 70.3 -17.2-153.2 122.9 -27.4 55.6 -4.8 48 50 A A T 3 S- 0 0 48 -2,-0.3 3,-0.1 1,-0.3 -28,-0.0 0.887 125.3 -55.8 48.8 46.2 -30.9 55.7 -3.1 49 51 A E T 3 S+ 0 0 211 1,-0.2 -1,-0.3 0, 0.0 2,-0.2 0.267 122.3 101.1 71.9 -9.1 -30.8 51.9 -2.6 50 52 A S E < S-G 47 0B 65 -3,-2.1 -3,-2.7 -5,-0.0 2,-0.5 -0.504 73.5-117.6 -99.1 172.3 -30.2 51.4 -6.4 51 53 A S E -G 46 0B 68 -5,-0.2 2,-0.4 -2,-0.2 -5,-0.2 -0.953 26.3-165.4-121.7 120.7 -27.0 50.7 -8.2 52 54 A L E -G 45 0B 28 -7,-3.1 -7,-2.2 -2,-0.5 2,-0.4 -0.845 18.4-127.0-111.6 139.0 -25.5 53.1 -10.8 53 55 A R E -G 44 0B 148 -2,-0.4 2,-0.5 -9,-0.2 -19,-0.5 -0.666 23.0-130.7 -80.9 131.7 -22.8 52.5 -13.5 54 56 A V - 0 0 0 -11,-3.0 -12,-3.0 -2,-0.4 -19,-0.2 -0.735 29.1-154.8 -79.8 125.4 -19.9 55.1 -13.4 55 57 A G E -c 35 0A 13 -21,-3.0 -19,-2.2 -2,-0.5 2,-0.5 -0.520 23.6 -92.5 -98.5 166.8 -19.3 56.4 -17.0 56 58 A D E >> -c 36 0A 39 -21,-0.2 3,-1.1 -2,-0.2 4,-0.5 -0.703 24.3-147.2 -82.0 120.4 -16.2 57.9 -18.6 57 59 A V G >4 S+ 0 0 2 -21,-2.8 3,-1.0 -2,-0.5 -1,-0.2 0.836 97.5 63.0 -53.0 -34.2 -16.2 61.7 -18.3 58 60 A D G 34 S+ 0 0 105 -22,-0.3 -1,-0.2 1,-0.2 -21,-0.1 0.816 106.7 43.1 -63.2 -30.8 -14.4 61.8 -21.8 59 61 A S G <4 S+ 0 0 106 -3,-1.1 -1,-0.2 2,-0.1 -2,-0.2 0.505 91.0 118.9 -87.8 -8.6 -17.5 60.3 -23.5 60 62 A F << - 0 0 40 -3,-1.0 2,-0.9 -4,-0.5 3,-0.1 -0.406 57.5-141.6 -82.1 138.2 -20.2 62.3 -21.7 61 63 A D > - 0 0 97 -2,-0.2 3,-1.8 1,-0.1 4,-0.1 -0.813 13.8-171.1 -92.2 99.5 -22.7 64.7 -23.2 62 64 A F G > S+ 0 0 12 -2,-0.9 3,-1.2 1,-0.3 -1,-0.1 0.621 78.5 75.3 -70.4 -14.5 -23.0 67.6 -20.8 63 65 A S G 3 S+ 0 0 72 1,-0.2 -1,-0.3 25,-0.1 -2,-0.0 0.752 86.4 67.2 -64.1 -17.7 -26.0 69.1 -22.6 64 66 A S G < S+ 0 0 45 -3,-1.8 2,-0.3 25,-0.0 -1,-0.2 0.650 98.7 57.9 -78.3 -15.6 -27.9 66.2 -21.0 65 67 A V < - 0 0 7 -3,-1.2 -60,-0.2 -4,-0.1 3,-0.1 -0.827 59.8-158.1-116.1 157.3 -27.5 67.7 -17.5 66 68 A G S S+ 0 0 33 -62,-2.2 24,-2.0 -2,-0.3 2,-0.3 0.622 83.5 27.8-100.8 -20.8 -28.4 71.0 -16.0 67 69 A L E -bd 5 90A 6 -63,-2.1 -61,-2.0 22,-0.2 2,-0.4 -0.994 63.7-168.5-143.2 140.8 -25.9 71.0 -13.0 68 70 A A E -bd 6 91A 0 22,-2.5 24,-3.0 -2,-0.3 2,-0.6 -0.997 11.7-154.6-134.5 128.8 -22.5 69.3 -12.6 69 71 A F E -bd 7 92A 0 -63,-2.4 -61,-2.8 -2,-0.4 2,-0.9 -0.919 12.9-155.8 -95.8 119.1 -20.3 68.8 -9.5 70 72 A F E +bd 8 93A 1 22,-3.1 24,-3.1 -2,-0.6 25,-0.5 -0.848 31.2 153.5 -97.8 100.3 -16.7 68.5 -10.5 71 73 A A + 0 0 17 -63,-3.0 -56,-0.5 -2,-0.9 -57,-0.2 -0.147 43.4 100.5-115.4 32.0 -15.0 66.6 -7.6 72 74 A A S S- 0 0 24 1,-0.2 5,-0.1 -58,-0.1 -63,-0.1 -0.440 85.2 -55.2-106.7-176.7 -12.2 65.1 -9.7 73 75 A A >> - 0 0 60 -2,-0.1 4,-1.4 1,-0.1 3,-0.8 -0.203 55.3-110.8 -54.0 152.0 -8.5 66.0 -10.2 74 76 A A H 3> S+ 0 0 30 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.821 117.6 61.8 -56.5 -33.3 -7.9 69.6 -11.3 75 77 A E H 3> S+ 0 0 125 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.867 100.5 53.1 -64.1 -35.4 -6.8 68.4 -14.8 76 78 A V H <> S+ 0 0 10 -3,-0.8 4,-1.6 2,-0.2 5,-0.3 0.912 109.8 48.6 -62.6 -43.4 -10.3 66.9 -15.3 77 79 A S H X S+ 0 0 1 -4,-1.4 4,-3.1 2,-0.2 5,-0.5 0.931 110.8 49.9 -60.7 -47.8 -11.8 70.3 -14.5 78 80 A R H < S+ 0 0 155 -4,-2.6 4,-0.2 1,-0.2 -2,-0.2 0.878 114.4 46.0 -57.5 -39.9 -9.4 72.1 -16.9 79 81 A A H < S+ 0 0 54 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.767 132.8 10.4 -75.3 -27.1 -10.3 69.6 -19.6 80 82 A H H X S+ 0 0 15 -4,-1.6 4,-2.8 -3,-0.2 -3,-0.2 0.669 98.3 83.6-129.5 -23.5 -14.1 69.8 -19.1 81 83 A A H X S+ 0 0 0 -4,-3.1 4,-1.8 -5,-0.3 -3,-0.1 0.921 100.6 39.9 -63.9 -45.2 -15.6 72.4 -16.8 82 84 A E H > S+ 0 0 101 -5,-0.5 4,-2.4 2,-0.2 3,-0.3 0.952 115.9 51.4 -65.9 -49.4 -15.7 75.3 -19.3 83 85 A R H > S+ 0 0 170 1,-0.2 4,-1.2 2,-0.2 -2,-0.2 0.898 109.6 52.2 -51.4 -43.9 -16.8 73.0 -22.2 84 86 A A H <>S+ 0 0 0 -4,-2.8 5,-1.8 1,-0.2 -1,-0.2 0.871 108.9 49.1 -60.1 -40.7 -19.6 71.7 -19.8 85 87 A R H ><5S+ 0 0 73 -4,-1.8 3,-1.9 -3,-0.3 -2,-0.2 0.894 105.9 55.9 -68.7 -37.6 -20.8 75.3 -19.1 86 88 A A H 3<5S+ 0 0 91 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.824 101.1 60.6 -59.8 -29.5 -20.9 76.1 -22.8 87 89 A A T 3<5S- 0 0 46 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.515 128.4-100.0 -81.0 -7.7 -23.2 73.1 -23.1 88 90 A G T < 5S+ 0 0 40 -3,-1.9 2,-0.5 1,-0.3 -3,-0.2 0.321 82.2 132.0 111.0 -1.9 -25.6 74.8 -20.7 89 91 A C < - 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