==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 30-NOV-12 4I7H . COMPND 2 MOLECULE: PEROXIDE STRESS SENSING REGULATOR; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS PYOGENES; . AUTHOR M.KUMARASWAMI . 295 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15894.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 185 62.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 2.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 44 14.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 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 . 7 2.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 97 32.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.7 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 1 0 0 0 2 0 0 3 3 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 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 PARALLEL BRIDGES PER LADDER . 5 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 2 A D 0 0 169 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -37.5 -70.0 -9.3 0.8 2 3 A I + 0 0 106 111,-0.0 2,-0.3 110,-0.0 110,-0.0 -0.428 360.0 134.8 -61.3 124.7 -72.4 -8.1 3.6 3 4 A H - 0 0 54 -2,-0.2 2,-0.3 0, 0.0 272,-0.0 -0.953 41.3-126.0-160.7 174.1 -73.2 -11.1 5.8 4 5 A S - 0 0 45 -2,-0.3 4,-0.1 108,-0.1 94,-0.0 -0.978 13.1-162.6-136.1 148.8 -73.5 -12.2 9.4 5 6 A H - 0 0 20 2,-0.4 3,-0.1 -2,-0.3 -1,-0.1 0.126 56.9-111.4-104.1 15.8 -72.0 -14.9 11.7 6 7 A Q S S+ 0 0 161 1,-0.1 2,-0.3 105,-0.1 -2,-0.0 0.720 93.2 65.4 53.0 26.9 -74.9 -14.3 14.2 7 8 A Q S S- 0 0 95 2,-0.0 -2,-0.4 92,-0.0 2,-0.2 -0.959 90.6 -97.4-161.9 155.3 -72.4 -12.8 16.7 8 9 A A + 0 0 36 -2,-0.3 2,-0.3 -4,-0.1 91,-0.2 -0.533 45.4 176.0 -70.2 141.8 -70.0 -9.9 17.1 9 10 A L B -A 98 0A 11 89,-1.9 89,-3.2 -2,-0.2 -2,-0.0 -0.985 23.5-132.1-146.8 136.9 -66.5 -10.8 16.2 10 11 A D > - 0 0 72 -2,-0.3 4,-3.0 87,-0.2 5,-0.2 -0.222 43.2 -87.4 -80.7-178.6 -63.4 -8.6 16.0 11 12 A A H > S+ 0 0 5 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.922 129.1 43.5 -56.5 -50.3 -61.0 -8.7 13.1 12 13 A Y H > S+ 0 0 69 2,-0.2 4,-1.8 1,-0.2 3,-0.3 0.958 116.0 46.3 -58.1 -57.0 -58.9 -11.6 14.5 13 14 A E H > S+ 0 0 90 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.852 110.6 56.5 -54.5 -38.0 -61.9 -13.6 15.6 14 15 A N H X S+ 0 0 0 -4,-3.0 4,-2.5 2,-0.2 -1,-0.2 0.892 103.2 51.4 -64.6 -41.7 -63.5 -13.0 12.2 15 16 A V H X S+ 0 0 0 -4,-1.8 4,-2.5 -3,-0.3 -1,-0.2 0.949 110.9 48.8 -61.1 -46.5 -60.7 -14.4 10.2 16 17 A L H X S+ 0 0 9 -4,-1.8 4,-2.7 2,-0.2 -1,-0.2 0.887 109.9 52.0 -60.8 -40.8 -60.7 -17.6 12.2 17 18 A E H X S+ 0 0 48 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.958 110.9 47.9 -58.7 -50.6 -64.5 -17.9 11.8 18 19 A H H X S+ 0 0 43 -4,-2.5 4,-0.7 2,-0.2 -2,-0.2 0.888 112.7 47.3 -57.7 -45.0 -64.2 -17.5 8.1 19 20 A L H ><>S+ 0 0 0 -4,-2.5 5,-2.4 1,-0.2 3,-1.3 0.950 111.3 51.7 -63.8 -49.9 -61.4 -20.1 7.8 20 21 A R H ><5S+ 0 0 118 -4,-2.7 3,-2.7 1,-0.3 -2,-0.2 0.907 102.8 58.8 -48.6 -50.1 -63.3 -22.6 10.0 21 22 A E H 3<5S+ 0 0 109 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.728 110.7 43.1 -55.4 -24.0 -66.4 -22.3 7.8 22 23 A K T <<5S- 0 0 134 -3,-1.3 -1,-0.3 -4,-0.7 -2,-0.2 0.209 115.1-119.4-103.5 11.8 -64.2 -23.5 4.9 23 24 A H T < 5 + 0 0 177 -3,-2.7 2,-0.4 1,-0.2 -3,-0.2 0.833 56.6 160.9 50.2 38.4 -62.6 -26.1 7.0 24 25 A I < - 0 0 38 -5,-2.4 -1,-0.2 -6,-0.1 -2,-0.1 -0.755 45.1-108.0 -86.4 133.6 -59.2 -24.6 6.5 25 26 A R - 0 0 207 -2,-0.4 2,-0.4 -3,-0.1 -1,-0.1 -0.279 28.1-158.0 -59.4 144.0 -56.6 -25.6 9.1 26 27 A I - 0 0 33 4,-0.0 -1,-0.1 -3,-0.0 2,-0.0 -0.828 13.1-175.4-128.2 96.1 -55.6 -23.0 11.6 27 28 A T > - 0 0 47 -2,-0.4 4,-1.8 1,-0.1 5,-0.1 -0.248 41.9-104.1 -76.6 171.5 -52.2 -23.6 13.3 28 29 A E H > S+ 0 0 123 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.879 123.2 51.8 -59.9 -40.2 -50.7 -21.5 16.0 29 30 A T H > S+ 0 0 14 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.913 106.8 51.4 -66.2 -41.5 -48.4 -20.0 13.4 30 31 A R H > S+ 0 0 31 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.893 110.9 49.8 -60.9 -38.3 -51.2 -19.0 11.2 31 32 A K H X S+ 0 0 51 -4,-1.8 4,-2.5 1,-0.2 -1,-0.2 0.889 109.7 51.0 -64.1 -42.2 -52.9 -17.4 14.2 32 33 A A H X S+ 0 0 20 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.840 111.3 47.6 -64.6 -37.2 -49.7 -15.5 15.0 33 34 A I H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.920 110.7 51.1 -72.1 -43.6 -49.4 -14.2 11.4 34 35 A I H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.952 113.2 46.2 -54.9 -50.7 -53.1 -13.1 11.3 35 36 A S H X S+ 0 0 51 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.912 112.0 50.5 -59.9 -47.2 -52.6 -11.2 14.6 36 37 A Y H X S+ 0 0 44 -4,-2.2 4,-0.9 1,-0.2 -1,-0.2 0.929 110.7 49.3 -55.2 -48.3 -49.3 -9.6 13.4 37 38 A M H >< S+ 0 0 2 -4,-2.7 3,-0.6 1,-0.2 56,-0.4 0.901 111.1 50.2 -61.8 -40.5 -50.9 -8.5 10.2 38 39 A I H 3< S+ 0 0 16 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.896 115.5 41.5 -65.1 -39.1 -53.9 -7.0 12.1 39 40 A Q H 3< S+ 0 0 90 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.453 86.1 118.9 -91.7 -0.1 -51.7 -5.0 14.5 40 41 A S << - 0 0 38 -4,-0.9 53,-0.1 -3,-0.6 3,-0.1 -0.451 45.1-165.0 -71.8 139.2 -49.1 -3.8 12.0 41 42 A T S S+ 0 0 81 -2,-0.1 2,-0.3 1,-0.1 -1,-0.1 0.498 77.3 33.0-101.6 -10.5 -48.7 -0.1 11.6 42 43 A E S S- 0 0 137 49,-0.0 -1,-0.1 0, 0.0 49,-0.1 -0.958 102.6 -88.3-136.7 157.5 -46.8 -0.1 8.4 43 44 A H - 0 0 84 -2,-0.3 49,-0.2 -3,-0.1 2,-0.1 -0.542 50.4-148.9 -70.8 110.7 -47.0 -2.7 5.5 44 45 A P - 0 0 6 0, 0.0 47,-2.4 0, 0.0 2,-0.2 -0.421 4.0-132.7 -79.1 153.0 -44.6 -5.4 6.4 45 46 A S B > -E 90 0B 16 45,-0.2 4,-2.0 -2,-0.1 5,-0.2 -0.541 33.7-103.9 -86.0 167.7 -42.6 -7.6 4.0 46 47 A A H > S+ 0 0 0 43,-0.6 4,-2.8 1,-0.2 5,-0.1 0.892 123.6 53.8 -60.2 -38.1 -42.5 -11.4 4.5 47 48 A D H > S+ 0 0 67 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.852 105.8 52.7 -66.6 -34.3 -39.0 -11.1 5.9 48 49 A K H > S+ 0 0 59 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.945 112.1 44.4 -64.0 -47.8 -40.1 -8.5 8.5 49 50 A I H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 5,-0.3 0.951 115.1 50.2 -59.9 -46.8 -42.9 -10.8 9.7 50 51 A Y H X S+ 0 0 62 -4,-2.8 4,-3.0 1,-0.2 -2,-0.2 0.946 111.1 46.5 -56.8 -56.1 -40.5 -13.7 9.7 51 52 A R H < S+ 0 0 129 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.839 115.6 47.0 -56.0 -37.9 -37.7 -11.9 11.7 52 53 A D H < S+ 0 0 67 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.867 122.1 33.2 -74.5 -35.8 -40.3 -10.7 14.2 53 54 A L H >< S+ 0 0 19 -4,-2.5 3,-2.2 -5,-0.2 4,-0.4 0.798 96.1 81.2 -93.2 -31.6 -42.1 -14.0 14.7 54 55 A Q G >< S+ 0 0 74 -4,-3.0 3,-2.0 -5,-0.3 6,-0.2 0.786 80.1 67.1 -50.4 -38.5 -39.4 -16.7 14.3 55 56 A P G 3 S+ 0 0 92 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.766 108.1 41.6 -55.8 -23.5 -37.9 -16.4 17.9 56 57 A N G < S+ 0 0 119 -3,-2.2 -2,-0.2 1,-0.2 3,-0.1 0.407 117.0 52.9 -98.6 -0.5 -41.2 -17.8 19.1 57 58 A F X + 0 0 31 -3,-2.0 3,-1.6 -4,-0.4 -1,-0.2 -0.703 51.2 172.0-140.1 84.3 -41.4 -20.4 16.4 58 59 A P T 3 S+ 0 0 124 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.764 86.7 60.7 -63.8 -23.2 -38.3 -22.6 15.9 59 60 A N T 3 S+ 0 0 113 -3,-0.1 2,-0.2 -5,-0.0 5,-0.1 0.728 88.0 103.5 -67.7 -25.4 -40.5 -24.6 13.4 60 61 A M < + 0 0 9 -3,-1.6 2,-0.3 -6,-0.2 -3,-0.1 -0.380 42.9 174.2 -77.0 134.6 -40.8 -21.5 11.2 61 62 A S > - 0 0 47 -2,-0.2 4,-1.2 1,-0.1 3,-0.3 -0.790 49.0-102.5-118.9 171.1 -39.0 -20.7 8.0 62 63 A L H > S+ 0 0 59 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.877 123.0 61.3 -60.0 -36.7 -39.5 -17.8 5.5 63 64 A A H > S+ 0 0 55 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.904 98.4 54.7 -54.9 -41.5 -41.4 -20.3 3.4 64 65 A T H > S+ 0 0 33 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.883 108.1 49.9 -65.1 -34.0 -44.0 -20.8 6.1 65 66 A V H X S+ 0 0 0 -4,-1.2 4,-2.6 -3,-0.2 -2,-0.2 0.968 112.6 45.7 -67.2 -51.1 -44.6 -17.0 6.2 66 67 A Y H X S+ 0 0 96 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.887 113.0 50.8 -55.2 -43.7 -45.0 -16.8 2.4 67 68 A N H X S+ 0 0 106 -4,-2.9 4,-1.9 -5,-0.2 -1,-0.2 0.927 112.4 45.6 -63.7 -44.7 -47.3 -19.9 2.4 68 69 A N H X S+ 0 0 12 -4,-2.2 4,-2.5 -5,-0.2 -2,-0.2 0.896 111.2 52.6 -64.7 -41.9 -49.5 -18.5 5.1 69 70 A L H X S+ 0 0 1 -4,-2.6 4,-3.0 1,-0.2 -2,-0.2 0.925 107.1 53.8 -60.3 -42.0 -49.7 -15.0 3.5 70 71 A K H X S+ 0 0 100 -4,-2.4 4,-3.1 2,-0.2 -1,-0.2 0.921 108.6 48.2 -58.4 -46.0 -50.8 -16.7 0.2 71 72 A V H X S+ 0 0 38 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.937 112.7 48.4 -60.9 -44.6 -53.6 -18.5 2.0 72 73 A L H <>S+ 0 0 2 -4,-2.5 5,-2.4 2,-0.2 6,-1.2 0.888 112.7 48.8 -63.7 -38.1 -54.7 -15.2 3.6 73 74 A V H ><5S+ 0 0 33 -4,-3.0 3,-1.6 4,-0.2 -2,-0.2 0.956 111.3 49.5 -63.1 -49.1 -54.5 -13.4 0.3 74 75 A D H 3<5S+ 0 0 105 -4,-3.1 -2,-0.2 1,-0.3 -1,-0.2 0.821 109.8 51.8 -60.9 -30.5 -56.5 -16.1 -1.4 75 76 A E T 3<5S- 0 0 55 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.438 118.1-111.3 -91.0 3.1 -59.1 -15.9 1.4 76 77 A G T < 5S+ 0 0 44 -3,-1.6 -3,-0.2 -4,-0.3 -2,-0.1 0.613 89.1 107.1 87.5 14.3 -59.5 -12.1 1.0 77 78 A F S - 0 0 87 5,-0.4 3,-1.0 3,-0.4 5,-0.0 -0.848 32.7 -83.2-123.3 163.6 -43.7 -0.0 -4.5 84 85 A S T 3 S+ 0 0 98 -2,-0.3 3,-0.1 1,-0.2 -1,-0.1 -0.300 107.9 8.9 -65.8 146.9 -41.3 1.8 -6.9 85 86 A N T 3 S+ 0 0 176 1,-0.1 2,-0.3 2,-0.0 -1,-0.2 0.748 110.0 93.2 53.3 31.8 -37.6 0.8 -6.9 86 87 A D < - 0 0 52 -3,-1.0 -3,-0.4 2,-0.1 -1,-0.1 -0.964 54.8-163.3-151.0 136.2 -38.1 -2.2 -4.7 87 88 A L + 0 0 163 -2,-0.3 2,-0.1 -5,-0.1 -1,-0.1 0.571 61.1 106.0 -94.6 -14.0 -38.7 -5.8 -5.8 88 89 A T S S- 0 0 54 1,-0.1 -5,-0.4 -43,-0.0 2,-0.3 -0.395 70.0-125.2 -71.0 140.2 -40.0 -7.0 -2.4 89 90 A T - 0 0 25 -2,-0.1 -43,-0.6 -7,-0.1 2,-0.3 -0.687 22.9-159.4 -82.4 137.9 -43.7 -7.6 -1.8 90 91 A Y E -EF 45 81B 48 -9,-2.8 -9,-2.5 -2,-0.3 2,-0.4 -0.846 10.2-135.7-115.1 158.4 -45.4 -5.8 1.0 91 92 A Y E - F 0 80B 6 -47,-2.4 2,-0.4 -2,-0.3 -11,-0.2 -0.892 13.2-166.6-124.6 145.6 -48.6 -6.8 2.7 92 93 A D E - F 0 79B 60 -13,-2.5 -13,-2.3 -2,-0.4 2,-0.5 -0.991 20.3-133.4-129.2 128.5 -51.8 -5.1 3.9 93 94 A F E + F 0 78B 17 -2,-0.4 -15,-0.2 -56,-0.4 -16,-0.1 -0.710 29.7 167.3 -81.3 127.0 -54.5 -6.5 6.2 94 95 A M + 0 0 97 -17,-3.0 2,-0.2 -2,-0.5 -16,-0.2 0.128 22.7 134.8-126.5 19.2 -57.9 -5.9 4.8 95 96 A G - 0 0 5 -18,-0.7 -18,-0.1 1,-0.1 23,-0.1 -0.511 42.0-141.1 -76.6 142.2 -60.3 -8.1 6.9 96 97 A H - 0 0 18 -2,-0.2 2,-0.3 -85,-0.1 19,-0.2 -0.049 11.8-144.3 -81.2-175.1 -63.6 -6.8 8.2 97 98 A Q E - B 0 114A 23 17,-2.5 17,-3.1 -83,-0.1 2,-0.5 -0.893 11.3-116.3-143.6-178.8 -65.3 -7.4 11.6 98 99 A H E -AB 9 113A 2 -89,-3.2 -89,-1.9 -2,-0.3 2,-0.3 -0.982 27.3-174.6-127.8 124.7 -68.8 -7.8 13.1 99 100 A V E - B 0 112A 3 13,-2.2 13,-2.3 -2,-0.5 2,-0.2 -0.899 18.7-123.0-123.5 147.3 -70.3 -5.4 15.6 100 101 A N E - B 0 111A 40 37,-0.4 39,-2.7 -2,-0.3 2,-0.4 -0.504 10.0-157.7 -83.4 150.6 -73.5 -5.5 17.6 101 102 A V E -cB 139 110A 0 9,-3.1 9,-2.1 37,-0.2 2,-0.5 -0.997 13.0-156.2-120.6 136.3 -76.3 -3.0 17.8 102 103 A V E -cB 140 109A 35 37,-2.4 39,-2.1 -2,-0.4 2,-0.4 -0.936 15.8-128.2-114.1 126.4 -78.5 -3.1 20.9 103 104 A C E > -c 141 0A 2 5,-2.1 4,-1.6 -2,-0.5 39,-0.2 -0.633 13.8-146.6 -73.6 127.0 -82.0 -1.8 20.9 104 105 A E T 4 S+ 0 0 81 37,-2.4 -1,-0.1 -2,-0.4 38,-0.1 0.643 91.3 41.2 -70.6 -15.7 -82.4 0.7 23.8 105 106 A I T 4 S+ 0 0 117 36,-0.3 -1,-0.2 3,-0.1 37,-0.1 0.904 131.7 13.6 -96.3 -55.0 -86.1 -0.2 24.4 106 107 A C T 4 S- 0 0 78 2,-0.1 -2,-0.2 37,-0.0 36,-0.1 0.598 91.5-125.1-103.8 -16.8 -86.4 -3.9 24.1 107 108 A G < + 0 0 42 -4,-1.6 2,-0.1 1,-0.3 -3,-0.1 0.519 49.0 158.7 85.3 5.1 -82.8 -5.1 24.1 108 109 A K - 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