==== 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 UNKNOWN FUNCTION 02-FEB-10 3LNL . COMPND 2 MOLECULE: UPF0135 PROTEIN SA1388; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS SUBSP. AUREUS; . AUTHOR K.S.SINGH,M.CHRUSZCZ,X.ZHANG,W.MINOR,H.ZHANG . 656 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31077.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 438 66.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 44 6.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 98 14.9 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 . 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 . 2 0.3 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 . 43 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 54 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 160 24.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 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 2 0 3 0 6 6 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 6 4 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 . 2 2 6 1 0 2 1 2 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 1 1 2 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 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 D 0 0 152 0, 0.0 2,-0.2 0, 0.0 36,-0.0 0.000 360.0 360.0 360.0 167.6 -33.9 144.5 -25.3 2 4 A P - 0 0 80 0, 0.0 2,-0.2 0, 0.0 289,-0.0 0.303 360.0-101.0 -49.6 150.4 -32.0 144.2 -22.9 3 5 A M - 0 0 7 -2,-0.2 35,-2.8 35,-0.2 2,-0.2 -0.392 41.0-158.2 -65.0 127.4 -34.0 141.1 -22.0 4 6 A K B > -A 37 0A 71 33,-0.3 4,-2.3 -2,-0.2 3,-0.4 -0.653 34.2-103.7 -97.7 164.8 -36.5 141.5 -19.2 5 7 A I H > S+ 0 0 0 31,-2.4 4,-2.9 28,-0.3 30,-0.2 0.881 123.7 58.1 -51.5 -40.9 -38.0 138.9 -17.0 6 8 A A H > S+ 0 0 30 28,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.912 107.6 46.1 -58.4 -43.4 -41.2 139.2 -19.1 7 9 A D H > S+ 0 0 66 -3,-0.4 4,-1.8 27,-0.3 -1,-0.2 0.891 111.3 51.5 -68.2 -39.3 -39.2 138.4 -22.3 8 10 A L H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 5,-0.3 0.933 108.1 52.5 -61.5 -45.3 -37.5 135.4 -20.6 9 11 A M H X S+ 0 0 34 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.918 108.0 51.2 -58.1 -42.8 -40.9 134.1 -19.5 10 12 A T H X S+ 0 0 100 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.898 112.4 46.4 -58.5 -43.4 -42.2 134.3 -23.1 11 13 A L H X S+ 0 0 15 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.927 112.7 47.8 -67.0 -47.4 -39.2 132.3 -24.4 12 14 A L H X S+ 0 0 0 -4,-2.8 4,-3.2 1,-0.2 -2,-0.2 0.886 111.4 52.4 -62.3 -40.7 -39.3 129.6 -21.7 13 15 A D H < S+ 0 0 71 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.883 106.4 54.1 -62.6 -36.1 -43.0 129.3 -22.3 14 16 A H H < S+ 0 0 131 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.938 119.5 31.8 -63.1 -44.0 -42.3 128.8 -26.0 15 17 A H H < S+ 0 0 45 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.802 137.3 20.5 -88.2 -31.2 -39.9 126.0 -25.4 16 18 A V S < S- 0 0 0 -4,-3.2 -1,-0.2 -5,-0.2 -2,-0.2 -0.618 89.4-140.7-136.7 73.6 -41.4 124.4 -22.3 17 19 A P > - 0 0 23 0, 0.0 3,-1.8 0, 0.0 4,-0.2 -0.045 3.0-145.0 -52.2 128.5 -45.0 125.5 -22.2 18 20 A F G > S+ 0 0 29 1,-0.3 3,-1.3 2,-0.2 84,-0.1 0.742 96.4 68.3 -65.2 -22.0 -46.1 126.3 -18.7 19 21 A S G 3 S+ 0 0 107 1,-0.3 -1,-0.3 -6,-0.1 -6,-0.0 0.612 85.9 68.3 -73.7 -13.9 -49.6 125.0 -19.5 20 22 A T G < S+ 0 0 9 -3,-1.8 -1,-0.3 2,-0.0 -2,-0.2 0.499 80.4 103.1 -79.1 -4.8 -48.2 121.4 -19.8 21 23 A A S < S- 0 0 16 -3,-1.3 6,-0.0 -4,-0.2 -3,-0.0 -0.438 88.4 -91.4 -70.3 154.6 -47.6 121.6 -16.0 22 24 A E > - 0 0 68 1,-0.1 3,-1.4 -2,-0.1 -1,-0.1 -0.283 32.9-116.5 -63.4 151.8 -50.1 119.7 -13.8 23 25 A S T 3 S+ 0 0 123 1,-0.3 -1,-0.1 -3,-0.1 -2,-0.1 0.826 115.1 52.6 -63.6 -30.8 -53.1 121.6 -12.5 24 26 A W T 3 S+ 0 0 129 2,-0.1 -1,-0.3 0, 0.0 -2,-0.1 0.619 94.0 98.7 -75.6 -12.1 -52.0 121.3 -8.9 25 27 A D < - 0 0 19 -3,-1.4 2,-0.4 1,-0.0 46,-0.0 -0.162 66.9-138.3 -77.7 170.4 -48.5 122.6 -9.6 26 28 A N + 0 0 54 2,-0.0 2,-0.3 44,-0.0 44,-0.1 -0.902 39.1 155.5-129.7 102.5 -47.1 126.1 -9.1 27 29 A V + 0 0 37 -2,-0.4 2,-0.3 72,-0.1 72,-0.2 -0.829 27.7 42.6-129.8 162.7 -45.0 127.2 -12.0 28 30 A G E S-B 98 0B 6 70,-2.7 70,-2.5 -2,-0.3 2,-1.0 -0.698 105.7 -2.5 104.6-155.3 -43.8 130.4 -13.7 29 31 A L E +B 97 0B 58 -2,-0.3 68,-0.2 68,-0.2 3,-0.2 -0.613 64.9 167.4 -75.0 104.9 -42.6 133.6 -12.1 30 32 A L E + 0 0 32 66,-2.0 2,-0.4 -2,-1.0 -1,-0.2 0.847 67.7 15.7 -88.2 -38.2 -43.0 132.8 -8.4 31 33 A I E S+B 96 0B 12 65,-1.8 65,-3.1 2,-0.0 -1,-0.3 -0.974 101.7 46.2-140.0 121.1 -41.0 135.7 -6.9 32 34 A G S S- 0 0 48 -2,-0.4 2,-0.4 63,-0.2 63,-0.1 -0.960 75.1 -70.0 150.0-164.8 -40.0 138.8 -8.8 33 35 A D > - 0 0 86 -2,-0.3 3,-2.0 60,-0.1 -28,-0.3 -0.981 25.3-150.8-136.9 114.3 -40.8 141.7 -11.1 34 36 A E T 3 S+ 0 0 125 -2,-0.4 -28,-2.5 1,-0.3 -27,-0.3 0.682 93.7 62.6 -66.9 -17.1 -41.4 141.1 -14.7 35 37 A D T 3 S+ 0 0 98 -30,-0.2 -1,-0.3 -31,-0.1 2,-0.2 0.506 79.6 107.3 -81.8 -9.0 -40.1 144.5 -15.7 36 38 A V S < S- 0 0 44 -3,-2.0 -31,-2.4 1,-0.1 2,-0.3 -0.525 74.1-118.0 -79.8 139.1 -36.5 143.9 -14.4 37 39 A E B -A 4 0A 101 -33,-0.2 2,-0.4 -2,-0.2 -33,-0.3 -0.553 30.5-118.7 -74.3 131.9 -33.6 143.4 -16.9 38 40 A V - 0 0 13 -35,-2.8 -35,-0.2 -2,-0.3 3,-0.1 -0.628 27.4-175.9 -74.2 126.9 -32.0 139.9 -16.5 39 41 A T - 0 0 79 1,-0.4 255,-0.4 -2,-0.4 2,-0.2 0.667 67.1 -35.4 -94.1 -16.4 -28.3 140.2 -15.5 40 42 A G - 0 0 0 253,-0.1 22,-1.1 2,-0.0 2,-0.4 -0.822 58.6-115.1 162.2 152.8 -27.7 136.4 -15.7 41 43 A V E -cd 62 295B 0 253,-2.6 255,-2.4 -2,-0.2 2,-0.4 -0.956 16.2-167.4-121.2 125.4 -29.4 133.1 -15.0 42 44 A L E -cd 63 296B 0 20,-2.5 22,-2.5 -2,-0.4 2,-0.3 -0.920 16.7-145.1-107.1 128.7 -28.5 130.4 -12.4 43 45 A T E +cd 64 297B 0 253,-2.2 255,-2.8 -2,-0.4 2,-0.3 -0.773 24.4 171.7 -97.7 145.9 -30.2 127.0 -12.7 44 46 A A E -c 65 0B 0 20,-2.2 22,-1.0 -2,-0.3 3,-0.2 -0.953 38.9-149.0-151.1 151.5 -31.2 125.0 -9.6 45 47 A L S S+ 0 0 1 1,-0.5 22,-2.6 -2,-0.3 21,-0.7 0.881 99.1 12.6 -82.5 -66.9 -33.1 121.9 -8.5 46 48 A D S S- 0 0 8 20,-0.2 2,-1.5 19,-0.1 -1,-0.5 -0.945 78.1-131.9-107.6 132.8 -34.0 123.4 -5.1 47 49 A C + 0 0 5 -2,-0.4 2,-0.1 20,-0.4 18,-0.1 -0.678 40.9 173.1 -83.0 85.1 -33.6 127.0 -4.4 48 50 A T > - 0 0 28 -2,-1.5 4,-2.2 1,-0.1 5,-0.2 -0.402 49.9-100.9 -84.4 169.9 -31.9 126.8 -1.0 49 51 A L H > S+ 0 0 55 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.915 125.6 55.2 -57.4 -43.6 -30.5 129.7 0.9 50 52 A E H > S+ 0 0 125 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.882 105.7 52.0 -57.0 -37.1 -27.0 128.7 -0.4 51 53 A V H > S+ 0 0 1 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.914 108.1 50.8 -67.6 -42.8 -28.3 128.9 -4.0 52 54 A V H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.925 110.4 50.0 -57.5 -44.5 -29.6 132.4 -3.4 53 55 A N H X S+ 0 0 56 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.868 108.8 52.5 -61.0 -38.0 -26.1 133.4 -2.0 54 56 A E H X S+ 0 0 5 -4,-2.1 4,-2.4 2,-0.2 6,-0.2 0.941 108.5 49.6 -62.8 -48.3 -24.5 131.9 -5.0 55 57 A A H X>S+ 0 0 0 -4,-2.5 5,-2.5 1,-0.2 4,-0.5 0.936 112.6 47.9 -53.9 -49.4 -26.7 134.0 -7.4 56 58 A I H ><5S+ 0 0 61 -4,-2.2 3,-0.8 1,-0.2 -1,-0.2 0.894 112.0 49.6 -57.8 -41.9 -25.8 137.1 -5.4 57 59 A E H 3<5S+ 0 0 157 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.852 111.8 47.6 -71.9 -37.1 -22.1 136.3 -5.5 58 60 A K H 3<5S- 0 0 67 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.462 114.3-114.3 -82.0 -1.4 -22.1 135.7 -9.3 59 61 A G T <<5 + 0 0 47 -3,-0.8 2,-0.5 -4,-0.5 -3,-0.2 0.709 68.0 144.0 73.6 23.5 -24.0 138.9 -10.0 60 62 A Y < - 0 0 15 -5,-2.5 -1,-0.2 -6,-0.2 -2,-0.1 -0.825 34.2-173.4-101.1 131.8 -27.1 137.0 -11.2 61 63 A N + 0 0 19 -2,-0.5 34,-3.3 -21,-0.3 2,-0.4 0.254 67.1 69.5-105.5 14.5 -30.7 138.3 -10.5 62 64 A T E -ce 41 95B 0 -22,-1.1 -20,-2.5 32,-0.2 2,-0.4 -0.991 53.1-178.7-138.5 128.6 -32.5 135.4 -12.0 63 65 A I E -ce 42 96B 0 32,-2.9 34,-2.9 -2,-0.4 2,-0.5 -0.983 8.6-163.8-120.9 131.3 -32.8 131.8 -10.7 64 66 A I E -ce 43 97B 0 -22,-2.5 -20,-2.2 -2,-0.4 2,-0.3 -0.984 17.6-179.7-112.6 114.6 -34.7 129.0 -12.5 65 67 A S E -ce 44 98B 0 32,-2.4 34,-2.8 -2,-0.5 -20,-0.2 -0.728 30.7-142.2-105.9 159.0 -35.4 126.1 -10.2 66 68 A H S S+ 0 0 0 -22,-1.0 -1,-0.2 -21,-0.7 -20,-0.2 0.920 90.1 60.3 -77.5 -57.3 -37.2 122.8 -11.0 67 69 A H S S- 0 0 4 -22,-2.6 2,-0.4 33,-0.1 -20,-0.4 -0.520 93.7-118.3 -78.5 132.3 -38.9 122.6 -7.6 68 70 A P - 0 0 17 0, 0.0 -1,-0.1 0, 0.0 -41,-0.1 -0.588 13.0-153.0 -74.9 123.0 -41.2 125.5 -6.7 69 71 A L S S+ 0 0 24 -2,-0.4 2,-0.6 1,-0.2 17,-0.1 0.848 93.4 43.3 -62.8 -36.2 -39.9 127.2 -3.6 70 72 A I S S+ 0 0 31 1,-0.1 -1,-0.2 -44,-0.1 3,-0.1 -0.972 70.9 148.9-107.5 120.3 -43.5 128.3 -2.9 71 73 A F + 0 0 84 1,-0.6 2,-0.2 -2,-0.6 -1,-0.1 0.661 65.9 27.1-119.5 -71.7 -45.8 125.4 -3.5 72 74 A K S S- 0 0 132 1,-0.1 -1,-0.6 -46,-0.0 -46,-0.0 -0.546 114.1 -77.5 -80.5 161.9 -48.8 125.5 -1.3 73 75 A G - 0 0 68 -2,-0.2 2,-0.4 -3,-0.1 -1,-0.1 -0.326 45.9-126.6 -61.6 143.0 -49.5 129.1 -0.3 74 76 A V - 0 0 64 1,-0.1 3,-0.1 -3,-0.1 -1,-0.1 -0.723 15.5-163.0 -90.5 133.6 -47.2 130.5 2.4 75 77 A T S S+ 0 0 147 -2,-0.4 2,-0.3 1,-0.2 -1,-0.1 0.559 71.6 21.5 -97.0 -11.5 -49.2 131.9 5.3 76 78 A S - 0 0 64 2,-0.1 2,-0.3 0, 0.0 -1,-0.2 -0.991 55.2-151.3-150.1 161.6 -46.2 133.9 6.7 77 79 A L + 0 0 80 -2,-0.3 2,-0.2 -3,-0.1 -3,-0.0 -0.705 39.1 153.7-130.9 79.0 -42.9 135.4 5.6 78 80 A K - 0 0 137 -2,-0.3 2,-2.5 2,-0.2 9,-0.2 -0.598 60.3 -95.6-104.1 166.5 -40.7 135.5 8.6 79 81 A A S S+ 0 0 71 -2,-0.2 2,-0.3 4,-0.1 3,-0.0 -0.281 98.1 82.0 -77.6 58.1 -36.9 135.4 9.1 80 82 A N S > S- 0 0 105 -2,-2.5 3,-1.5 0, 0.0 4,-0.5 -0.989 90.0 -19.1-159.9 143.6 -37.0 131.6 9.6 81 83 A G T >> S- 0 0 5 529,-0.3 3,-1.3 -2,-0.3 4,-0.8 -0.148 129.1 -8.8 61.8-139.3 -37.1 128.5 7.5 82 84 A Y H 3> S+ 0 0 54 1,-0.3 4,-2.3 2,-0.2 -1,-0.3 0.765 129.5 72.0 -62.6 -26.5 -38.3 129.0 3.9 83 85 A G H <> S+ 0 0 8 -3,-1.5 4,-2.7 1,-0.2 -1,-0.3 0.832 92.4 56.7 -54.5 -37.4 -39.2 132.5 4.9 84 86 A L H <> S+ 0 0 75 -3,-1.3 4,-2.2 -4,-0.5 -1,-0.2 0.899 108.2 45.5 -68.5 -38.7 -35.5 133.4 5.0 85 87 A I H X S+ 0 0 2 -4,-0.8 4,-2.4 2,-0.2 -2,-0.2 0.946 114.7 46.5 -69.6 -47.5 -35.0 132.3 1.5 86 88 A I H X S+ 0 0 6 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.931 114.5 47.7 -62.2 -44.3 -38.0 134.1 0.1 87 89 A R H X S+ 0 0 94 -4,-2.7 4,-3.0 -9,-0.2 -1,-0.2 0.890 109.5 53.5 -65.4 -40.6 -37.2 137.3 2.0 88 90 A K H X S+ 0 0 62 -4,-2.2 4,-1.6 -5,-0.2 -2,-0.2 0.915 107.9 50.7 -61.0 -44.5 -33.5 137.1 0.9 89 91 A L H <>S+ 0 0 0 -4,-2.4 5,-3.0 2,-0.2 3,-0.3 0.949 114.6 43.9 -50.5 -55.8 -34.6 136.9 -2.8 90 92 A I H ><5S+ 0 0 94 -4,-2.2 3,-1.8 1,-0.2 -2,-0.2 0.938 111.8 51.0 -60.8 -48.2 -36.9 139.9 -2.4 91 93 A Q H 3<5S+ 0 0 135 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.770 115.7 43.4 -67.4 -18.8 -34.4 142.0 -0.5 92 94 A H T 3<5S- 0 0 86 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.257 111.7-117.5-106.0 13.9 -31.8 141.3 -3.1 93 95 A D T < 5 + 0 0 124 -3,-1.8 2,-0.5 1,-0.2 -3,-0.2 0.897 58.4 158.9 52.7 45.3 -34.1 141.9 -6.1 94 96 A I < - 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