==== 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 20-NOV-06 2NYD . COMPND 2 MOLECULE: UPF0135 PROTEIN SA1388; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS SUBSP. AUREUS; . AUTHOR K.S.SINGH,X.ZHANG,H.ZHANG . 648 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31048.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 437 67.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 44 6.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 98 15.1 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 . 1 0.2 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 . 45 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 55 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 159 24.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 2.3 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 2 3 3 7 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 1 8 0 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 -1 A D 0 0 210 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 95.6 -32.9 146.0 -26.4 2 0 A P - 0 0 77 0, 0.0 2,-0.2 0, 0.0 283,-0.0 -0.121 360.0-106.8 -63.9 139.6 -32.1 144.2 -23.1 3 1 A M - 0 0 20 35,-0.2 35,-2.6 34,-0.1 2,-0.2 -0.401 35.0-161.9 -68.2 128.0 -34.1 141.1 -22.0 4 2 A K B >> -A 37 0A 72 33,-0.3 4,-2.1 -2,-0.2 3,-0.7 -0.651 37.3 -99.5 -99.8 166.5 -36.5 141.6 -19.1 5 3 A I H 3> S+ 0 0 0 31,-2.6 4,-2.9 28,-0.4 5,-0.2 0.893 124.9 57.3 -49.6 -43.5 -38.0 138.9 -16.9 6 4 A A H 3> S+ 0 0 29 28,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.845 107.0 47.5 -59.6 -36.8 -41.2 139.2 -19.1 7 5 A D H <> S+ 0 0 74 -3,-0.7 4,-2.0 27,-0.3 -1,-0.2 0.885 111.4 50.2 -71.8 -40.7 -39.2 138.3 -22.2 8 6 A L H X S+ 0 0 0 -4,-2.1 4,-2.9 2,-0.2 5,-0.3 0.949 108.5 53.2 -57.7 -50.6 -37.5 135.4 -20.5 9 7 A M H X S+ 0 0 36 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.886 108.5 50.2 -55.2 -41.8 -40.9 134.1 -19.4 10 8 A T H X S+ 0 0 98 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.918 112.3 46.1 -60.3 -46.6 -42.1 134.3 -23.1 11 9 A L H X S+ 0 0 14 -4,-2.0 4,-2.0 2,-0.2 5,-0.2 0.912 113.0 49.0 -63.4 -48.4 -39.1 132.3 -24.4 12 10 A L H X S+ 0 0 0 -4,-2.9 4,-3.0 1,-0.2 -1,-0.2 0.885 111.1 51.1 -57.9 -42.3 -39.3 129.6 -21.7 13 11 A D H < S+ 0 0 71 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.860 106.5 55.6 -65.7 -34.1 -43.0 129.2 -22.4 14 12 A H H < S+ 0 0 134 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.969 119.8 29.2 -60.3 -51.7 -42.3 128.8 -26.0 15 13 A H H < S+ 0 0 49 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.777 137.9 23.0 -84.5 -30.2 -39.9 125.9 -25.5 16 14 A V S < S- 0 0 0 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 -0.601 89.0-142.6-137.2 74.6 -41.4 124.4 -22.3 17 15 A P > - 0 0 21 0, 0.0 3,-1.9 0, 0.0 4,-0.2 -0.052 3.6-144.9 -51.3 124.9 -45.1 125.5 -22.2 18 16 A F G > S+ 0 0 27 1,-0.3 3,-1.3 2,-0.2 84,-0.1 0.737 96.4 69.2 -66.2 -20.3 -46.1 126.3 -18.7 19 17 A S G 3 S+ 0 0 105 1,-0.2 -1,-0.3 -6,-0.1 -6,-0.0 0.633 85.7 67.7 -73.4 -14.0 -49.6 124.9 -19.5 20 18 A T G < S+ 0 0 9 -3,-1.9 -1,-0.2 2,-0.0 -2,-0.2 0.532 80.7 102.5 -78.5 -6.8 -48.2 121.4 -19.8 21 19 A A S < S- 0 0 16 -3,-1.3 6,-0.0 -4,-0.2 -3,-0.0 -0.422 89.1 -91.6 -70.0 152.2 -47.6 121.6 -16.0 22 20 A E > - 0 0 70 1,-0.1 3,-1.4 -2,-0.1 -1,-0.1 -0.265 32.4-117.3 -62.2 153.0 -50.1 119.7 -13.8 23 21 A S T 3 S+ 0 0 127 1,-0.3 -1,-0.1 -3,-0.1 -2,-0.1 0.815 115.0 53.4 -67.1 -26.6 -53.1 121.7 -12.5 24 22 A W T 3 S+ 0 0 137 2,-0.0 -1,-0.3 0, 0.0 -2,-0.1 0.612 94.0 98.7 -76.7 -12.8 -52.0 121.2 -8.9 25 23 A D < - 0 0 19 -3,-1.4 2,-0.5 1,-0.0 46,-0.0 -0.187 66.9-138.4 -79.6 167.7 -48.5 122.6 -9.6 26 24 A N + 0 0 54 2,-0.0 2,-0.3 44,-0.0 44,-0.1 -0.899 39.6 154.9-130.5 102.6 -47.1 126.1 -9.1 27 25 A V + 0 0 35 -2,-0.5 2,-0.3 -9,-0.1 72,-0.2 -0.809 27.0 42.2-128.1 164.5 -45.0 127.2 -12.0 28 26 A G E S-B 98 0B 7 70,-2.6 70,-2.7 -2,-0.3 2,-0.9 -0.688 105.9 -2.7 102.8-157.0 -43.8 130.4 -13.7 29 27 A L E +B 97 0B 56 -2,-0.3 68,-0.2 68,-0.2 3,-0.2 -0.625 65.0 167.9 -71.3 108.2 -42.6 133.6 -12.1 30 28 A L E + 0 0 31 66,-2.1 2,-0.4 -2,-0.9 -1,-0.2 0.813 68.5 15.5 -91.6 -37.1 -43.0 132.9 -8.4 31 29 A I E S+B 96 0B 12 65,-1.7 65,-3.2 2,-0.0 -1,-0.3 -0.969 101.8 51.8-140.6 118.1 -41.0 135.7 -6.9 32 30 A G S S- 0 0 49 -2,-0.4 2,-0.4 63,-0.2 63,-0.1 -0.964 73.7 -74.9 156.0-165.2 -40.0 138.8 -8.8 33 31 A D > - 0 0 87 -2,-0.3 3,-1.8 60,-0.1 -28,-0.4 -0.980 24.7-151.7-138.5 113.1 -40.8 141.8 -11.1 34 32 A E T 3 S+ 0 0 124 -2,-0.4 -28,-2.6 1,-0.3 -27,-0.3 0.627 93.7 62.2 -67.4 -14.2 -41.3 141.1 -14.8 35 33 A D T 3 S+ 0 0 101 -30,-0.2 -1,-0.3 -31,-0.1 2,-0.2 0.510 80.2 108.7 -84.6 -10.6 -40.1 144.5 -15.8 36 34 A V S < S- 0 0 40 -3,-1.8 -31,-2.6 -32,-0.1 2,-0.3 -0.489 73.7-119.3 -76.2 138.0 -36.6 143.8 -14.4 37 35 A E B -A 4 0A 101 -33,-0.3 2,-0.4 -2,-0.2 -33,-0.3 -0.594 29.0-119.0 -76.4 129.5 -33.6 143.3 -16.8 38 36 A V - 0 0 12 -35,-2.6 -35,-0.2 -2,-0.3 3,-0.1 -0.597 28.5-177.8 -70.4 121.9 -32.0 139.9 -16.5 39 37 A T - 0 0 79 -2,-0.4 249,-0.4 1,-0.4 2,-0.2 0.669 67.9 -32.7 -91.2 -17.6 -28.3 140.2 -15.5 40 38 A G - 0 0 0 247,-0.1 22,-1.1 2,-0.0 2,-0.5 -0.868 57.8-116.6 166.4 157.0 -27.8 136.4 -15.6 41 39 A V E -cd 62 289B 0 247,-2.6 249,-2.6 -2,-0.2 2,-0.5 -0.959 16.2-168.5-124.7 122.6 -29.5 133.1 -15.0 42 40 A L E -cd 63 290B 0 20,-2.5 22,-2.6 -2,-0.5 2,-0.3 -0.929 17.0-144.6-106.5 127.7 -28.6 130.4 -12.4 43 41 A T E +cd 64 291B 0 247,-2.7 249,-2.5 -2,-0.5 2,-0.3 -0.700 24.6 173.7 -94.0 148.4 -30.3 127.0 -12.8 44 42 A A E -c 65 0B 0 20,-2.3 22,-1.0 -2,-0.3 3,-0.2 -0.976 38.1-151.4-151.9 148.0 -31.2 125.0 -9.6 45 43 A L S S+ 0 0 1 1,-0.4 22,-2.6 -2,-0.3 21,-0.8 0.880 98.5 12.2 -82.0 -64.7 -33.0 121.9 -8.5 46 44 A D S S- 0 0 8 20,-0.2 2,-1.6 19,-0.1 -1,-0.4 -0.953 77.9-132.5-109.4 133.7 -34.0 123.3 -5.1 47 45 A C + 0 0 6 -2,-0.4 2,-0.1 20,-0.4 18,-0.1 -0.664 40.4 172.6 -86.1 86.7 -33.6 127.0 -4.4 48 46 A T > - 0 0 30 -2,-1.6 4,-2.0 1,-0.1 5,-0.2 -0.384 50.3-100.8 -86.2 170.7 -31.9 126.8 -1.0 49 47 A L H > S+ 0 0 56 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.874 125.8 55.6 -57.5 -38.4 -30.4 129.8 0.9 50 48 A E H > S+ 0 0 121 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.888 105.4 51.6 -62.5 -37.3 -27.0 128.7 -0.4 51 49 A V H > S+ 0 0 1 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.883 109.1 49.8 -66.6 -42.1 -28.3 128.9 -4.0 52 50 A V H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.931 110.4 50.7 -58.0 -47.5 -29.6 132.4 -3.4 53 51 A N H X S+ 0 0 57 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.862 109.6 51.9 -56.7 -38.0 -26.1 133.3 -1.9 54 52 A E H X S+ 0 0 4 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.925 108.0 49.5 -66.0 -50.9 -24.5 131.9 -5.0 55 53 A A H X>S+ 0 0 0 -4,-2.5 5,-3.0 2,-0.2 4,-0.5 0.926 112.8 48.0 -49.2 -50.0 -26.7 134.0 -7.4 56 54 A I H ><5S+ 0 0 57 -4,-2.3 3,-1.2 3,-0.2 -2,-0.2 0.939 111.8 50.5 -57.3 -50.4 -25.8 137.1 -5.4 57 55 A E H 3<5S+ 0 0 156 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.884 112.3 46.2 -52.4 -48.6 -22.1 136.2 -5.5 58 56 A K H 3<5S- 0 0 63 -4,-2.6 -1,-0.3 -5,-0.1 -2,-0.2 0.490 114.0-116.4 -78.3 -1.9 -22.2 135.6 -9.3 59 57 A G T <<5 + 0 0 46 -3,-1.2 2,-0.4 -4,-0.5 -3,-0.2 0.799 66.4 145.6 66.5 32.9 -24.1 138.9 -9.9 60 58 A Y < - 0 0 15 -5,-3.0 -1,-0.2 -6,-0.2 -19,-0.1 -0.856 33.7-172.7-104.0 132.8 -27.1 137.0 -11.2 61 59 A N + 0 0 20 -2,-0.4 34,-3.2 -21,-0.4 2,-0.4 0.310 66.1 68.8-107.1 12.7 -30.6 138.3 -10.6 62 60 A T E -ce 41 95B 0 -22,-1.1 -20,-2.5 32,-0.2 2,-0.4 -0.997 54.1-176.1-136.2 126.3 -32.5 135.4 -12.0 63 61 A I E -ce 42 96B 0 32,-2.9 34,-2.9 -2,-0.4 2,-0.5 -0.985 7.5-164.0-117.6 130.6 -32.8 131.8 -10.7 64 62 A I E -ce 43 97B 0 -22,-2.6 -20,-2.3 -2,-0.4 2,-0.3 -0.977 17.7-179.6-112.2 114.4 -34.7 129.0 -12.5 65 63 A S E -ce 44 98B 0 32,-2.6 34,-2.5 -2,-0.5 -20,-0.2 -0.712 30.5-143.6-107.9 157.8 -35.4 126.1 -10.2 66 64 A H S S+ 0 0 0 -22,-1.0 -1,-0.2 -21,-0.8 -20,-0.2 0.904 89.5 60.3 -78.3 -57.2 -37.2 122.8 -11.0 67 65 A H S S- 0 0 3 -22,-2.6 -20,-0.4 33,-0.1 2,-0.4 -0.528 93.8-118.0 -77.2 132.0 -38.9 122.6 -7.6 68 66 A P - 0 0 18 0, 0.0 -1,-0.1 0, 0.0 -41,-0.1 -0.553 13.4-153.4 -73.4 125.1 -41.2 125.4 -6.7 69 67 A L S S+ 0 0 22 -2,-0.4 2,-0.6 1,-0.2 17,-0.1 0.821 93.7 42.1 -64.9 -33.7 -40.0 127.2 -3.6 70 68 A I S S+ 0 0 30 -44,-0.1 -1,-0.2 1,-0.1 3,-0.1 -0.985 70.4 148.0-109.6 119.2 -43.6 128.3 -2.9 71 69 A F + 0 0 94 1,-0.6 2,-0.2 -2,-0.6 -1,-0.1 0.638 67.2 29.3-116.0 -71.4 -45.8 125.3 -3.6 72 70 A K S S- 0 0 171 1,-0.1 -1,-0.6 -46,-0.0 -46,-0.0 -0.568 114.9 -75.5 -79.4 155.7 -48.8 125.5 -1.3 73 71 A G - 0 0 72 -2,-0.2 2,-0.3 -3,-0.1 -1,-0.1 -0.262 47.8-118.1 -55.5 138.7 -49.6 129.1 -0.3 74 72 A V - 0 0 69 1,-0.2 3,-0.1 -3,-0.1 -1,-0.1 -0.590 21.2-166.2 -75.0 134.1 -47.2 130.7 2.2 75 73 A T S S+ 0 0 149 -2,-0.3 2,-0.3 1,-0.3 -1,-0.2 0.702 71.2 8.3 -98.4 -26.0 -49.0 131.7 5.3 76 74 A S - 0 0 59 2,-0.1 -1,-0.3 0, 0.0 2,-0.3 -0.974 55.8-146.1-150.1 165.2 -46.3 133.9 6.7 77 75 A L + 0 0 77 -2,-0.3 2,-0.2 -3,-0.1 -3,-0.0 -0.681 39.8 153.0-135.5 80.5 -42.9 135.4 5.6 78 76 A K - 0 0 136 -2,-0.3 2,-2.3 2,-0.2 9,-0.2 -0.537 59.9 -94.6-106.2 168.1 -40.7 135.5 8.6 79 77 A A S S+ 0 0 67 -2,-0.2 2,-0.3 4,-0.1 3,-0.0 -0.327 98.2 78.1 -81.8 60.9 -36.9 135.4 9.0 80 78 A N S > S- 0 0 106 -2,-2.3 3,-1.4 0, 0.0 4,-0.4 -0.979 90.8 -13.3-161.9 145.9 -36.9 131.7 9.6 81 79 A G T >> S- 0 0 4 521,-0.4 3,-1.1 -2,-0.3 4,-0.8 -0.223 130.3 -11.8 64.0-141.8 -37.2 128.5 7.5 82 80 A Y H 3> S+ 0 0 58 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.773 130.4 72.9 -64.1 -25.3 -38.3 129.0 4.0 83 81 A G H <> S+ 0 0 8 -3,-1.4 4,-2.7 1,-0.2 -1,-0.2 0.853 92.8 56.9 -54.8 -35.1 -39.3 132.6 5.0 84 82 A L H <> S+ 0 0 72 -3,-1.1 4,-2.3 -4,-0.4 -1,-0.2 0.892 107.9 44.2 -68.2 -42.5 -35.5 133.3 5.1 85 83 A I H X S+ 0 0 3 -4,-0.8 4,-2.6 -3,-0.3 -1,-0.2 0.934 115.1 47.4 -70.6 -46.1 -34.9 132.3 1.5 86 84 A I H X S+ 0 0 6 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.937 114.5 47.6 -60.1 -47.0 -38.0 134.1 0.1 87 85 A R H X S+ 0 0 92 -4,-2.7 4,-3.0 -9,-0.2 5,-0.2 0.903 109.9 52.7 -61.8 -44.5 -37.1 137.2 2.0 88 86 A K H X S+ 0 0 63 -4,-2.3 4,-1.5 -5,-0.2 -2,-0.2 0.921 108.2 51.2 -58.4 -44.8 -33.5 137.1 0.9 89 87 A L H <>S+ 0 0 0 -4,-2.6 5,-3.4 2,-0.2 3,-0.4 0.954 114.7 42.3 -51.6 -56.7 -34.6 136.9 -2.8 90 88 A I H ><5S+ 0 0 95 -4,-2.1 3,-1.8 1,-0.2 -2,-0.2 0.936 112.4 52.2 -58.8 -50.0 -36.9 139.9 -2.5 91 89 A Q H 3<5S+ 0 0 130 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.753 115.7 42.3 -63.4 -20.3 -34.5 142.0 -0.4 92 90 A H T 3<5S- 0 0 87 -4,-1.5 -1,-0.3 -3,-0.4 -2,-0.2 0.266 112.7-117.2-107.5 12.0 -31.7 141.4 -3.1 93 91 A D T < 5 + 0 0 121 -3,-1.8 2,-0.5 1,-0.2 -3,-0.2 0.881 58.0 159.7 55.1 41.8 -34.1 141.8 -6.0 94 92 A I < - 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