==== 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 TRANSFERASE 02-JUL-08 3DNS . COMPND 2 MOLECULE: RIBOSOMAL-PROTEIN-ALANINE ACETYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CLOSTRIDIUM ACETOBUTYLICUM; . AUTHOR B.NOCEK,R.HENDRICKS,G.COBB,A.JOACHIMIAK,MIDWEST CENTER FOR S . 260 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14003.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 186 71.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 4.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 92 35.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.5 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 . 13 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 46 17.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 0 3 1 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 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 PARALLEL BRIDGES PER LADDER . 2 0 1 0 4 0 2 4 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 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 0 A A 0 0 143 0, 0.0 11,-0.7 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 122.4 22.8 4.5 72.9 2 1 A X E -A 11 0A 93 9,-0.2 2,-0.4 2,-0.0 9,-0.2 -0.887 360.0-108.8-150.3 177.8 23.9 7.8 71.5 3 2 A L E -A 10 0A 38 7,-2.6 7,-2.5 -2,-0.3 2,-0.4 -0.979 29.4-161.0-125.1 136.5 26.7 10.3 70.8 4 3 A K E +A 9 0A 161 -2,-0.4 2,-0.2 5,-0.2 5,-0.2 -0.905 14.2 169.2-121.9 132.2 27.0 13.5 72.7 5 4 A G - 0 0 17 3,-2.3 60,-0.0 -2,-0.4 59,-0.0 -0.716 54.0 -87.9-124.4-173.3 28.9 16.6 71.8 6 5 A K S S+ 0 0 150 -2,-0.2 19,-0.0 1,-0.2 -1,-0.0 0.918 122.1 7.7 -65.4 -44.9 28.7 20.1 73.5 7 6 A Y S S+ 0 0 102 54,-0.1 18,-0.8 17,-0.1 2,-0.3 0.470 123.7 57.4-115.7 -2.0 25.8 21.3 71.2 8 7 A T E - B 0 24A 1 16,-0.2 -3,-2.3 17,-0.1 2,-0.3 -0.822 53.8-154.5-131.7 166.0 24.7 18.2 69.3 9 8 A K E -AB 4 23A 65 14,-2.2 14,-2.1 -2,-0.3 2,-0.4 -0.994 2.8-162.0-138.0 141.3 23.4 14.7 69.5 10 9 A I E +AB 3 22A 2 -7,-2.5 -7,-2.6 -2,-0.3 2,-0.4 -0.995 21.3 170.1-124.6 124.1 23.7 11.7 67.2 11 10 A E E -AB 2 21A 61 10,-2.3 10,-3.7 -2,-0.4 -9,-0.2 -0.992 36.7-107.7-137.7 145.8 21.3 8.8 67.7 12 11 A K E - B 0 20A 107 -11,-0.7 2,-0.5 -2,-0.4 8,-0.3 -0.409 40.4-112.9 -68.9 138.0 20.2 5.7 65.8 13 12 A V > - 0 0 35 6,-2.8 3,-0.9 3,-0.4 6,-0.2 -0.712 25.4-131.1 -80.4 124.7 16.8 5.9 64.3 14 13 A N T 3 S+ 0 0 176 -2,-0.5 -1,-0.1 1,-0.3 -2,-0.0 0.765 97.6 32.2 -49.5 -46.1 14.5 3.4 66.1 15 14 A G T 3 S+ 0 0 77 1,-0.1 2,-0.5 2,-0.0 -1,-0.3 0.764 109.7 72.6 -83.7 -20.4 12.9 1.6 63.1 16 15 A V X - 0 0 61 -3,-0.9 3,-1.0 3,-0.1 -3,-0.4 -0.853 67.2-134.7-119.9 122.0 15.7 1.8 60.7 17 16 A E T 3 S+ 0 0 138 -2,-0.5 3,-0.1 1,-0.2 -2,-0.0 -0.369 90.0 10.3 -60.3 142.2 19.1 0.1 60.2 18 17 A R T 3 S+ 0 0 90 1,-0.2 17,-2.8 16,-0.1 2,-0.4 0.661 100.1 116.2 63.0 23.0 22.1 2.3 59.3 19 18 A E E < - C 0 34A 37 -3,-1.0 -6,-2.8 -6,-0.2 2,-0.4 -0.974 40.5-174.5-126.1 135.6 20.3 5.6 59.9 20 19 A Y E -BC 12 33A 39 13,-2.9 13,-2.9 -2,-0.4 2,-0.5 -0.988 17.2-137.4-132.7 142.8 21.1 8.2 62.5 21 20 A L E -BC 11 32A 44 -10,-3.7 -10,-2.3 -2,-0.4 2,-0.5 -0.814 10.9-155.5 -99.7 128.8 19.4 11.3 63.6 22 21 A I E +BC 10 31A 0 9,-3.2 8,-2.6 -2,-0.5 9,-1.3 -0.917 25.1 161.6-102.3 127.3 21.4 14.5 64.3 23 22 A T E -BC 9 29A 8 -14,-2.1 -14,-2.2 -2,-0.5 6,-0.2 -0.874 34.1-118.7-132.5 167.1 19.7 17.1 66.6 24 23 A D E > -B 8 0A 40 4,-2.2 3,-2.1 -2,-0.3 -16,-0.2 -0.417 51.0 -82.1 -93.8-175.6 20.7 20.0 68.8 25 24 A K T 3 S+ 0 0 101 -18,-0.8 -17,-0.1 1,-0.3 -18,-0.0 0.630 130.9 53.9 -66.3 -16.4 20.3 20.2 72.6 26 25 A Y T 3 S- 0 0 213 2,-0.1 -1,-0.3 0, 0.0 0, 0.0 0.377 120.4-109.6 -88.9 -1.3 16.6 21.2 72.3 27 26 A G < + 0 0 45 -3,-2.1 2,-0.3 1,-0.3 -2,-0.1 0.704 67.5 148.8 80.9 19.4 16.0 18.1 70.1 28 27 A I - 0 0 108 1,-0.1 -4,-2.2 2,-0.0 2,-0.4 -0.687 53.1-109.7 -83.9 136.4 15.5 20.0 66.8 29 28 A T E +C 23 0A 42 -2,-0.3 -6,-0.3 -6,-0.2 3,-0.1 -0.576 36.4 174.8 -74.8 125.9 16.7 18.0 63.8 30 29 A I E - 0 0 12 -8,-2.6 22,-2.8 -2,-0.4 2,-0.3 0.806 62.3 -65.6 -88.7 -45.2 19.8 19.3 62.0 31 30 A G E -CD 22 51A 2 -9,-1.3 -9,-3.2 20,-0.2 -1,-0.4 -0.950 48.8 -92.0 178.4-163.4 20.1 16.3 59.7 32 31 A R E -CD 21 50A 67 18,-1.8 18,-2.7 -2,-0.3 2,-0.4 -0.964 14.8-141.0-142.7 152.2 20.6 12.6 59.3 33 32 A I E -CD 20 49A 1 -13,-2.9 -13,-2.9 -2,-0.3 2,-0.5 -0.967 15.9-167.5-114.0 135.5 23.5 10.2 58.6 34 33 A F E -CD 19 48A 50 14,-2.7 14,-2.9 -2,-0.4 2,-0.5 -0.985 18.7-135.8-124.0 119.5 22.9 7.2 56.4 35 34 A I E + D 0 47A 20 -17,-2.8 12,-0.2 -2,-0.5 3,-0.1 -0.632 27.6 172.7 -76.7 124.5 25.5 4.4 56.3 36 35 A V E + 0 0 12 10,-2.1 2,-0.4 -2,-0.5 11,-0.2 0.817 66.2 11.8-103.3 -38.6 26.0 3.5 52.6 37 36 A D E + D 0 46A 20 9,-2.5 9,-3.3 2,-0.0 -1,-0.4 -0.998 60.3 170.9-149.8 132.9 28.9 1.1 52.8 38 37 A L E + D 0 45A 74 -2,-0.4 2,-0.4 7,-0.2 7,-0.2 -0.980 2.2 173.0-145.3 129.1 30.5 -0.7 55.8 39 38 A N E >> - D 0 44A 43 5,-2.7 5,-2.6 -2,-0.4 4,-0.6 -0.915 16.7-167.7-146.0 111.0 33.1 -3.4 55.5 40 39 A K T 45S+ 0 0 173 -2,-0.4 3,-0.3 3,-0.2 -1,-0.1 0.847 91.1 55.0 -70.7 -34.8 34.8 -4.8 58.6 41 40 A D T 45S+ 0 0 139 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.915 117.2 37.7 -65.1 -37.0 37.5 -6.7 56.6 42 41 A N T 45S- 0 0 22 2,-0.1 -1,-0.2 198,-0.1 -2,-0.2 0.546 103.1-134.6 -86.2 -4.6 38.4 -3.4 54.8 43 42 A R T <5 + 0 0 74 -4,-0.6 37,-3.2 -3,-0.3 38,-1.9 0.909 59.4 146.0 50.2 44.2 37.8 -1.5 58.0 44 43 A F E < +De 39 81A 1 -5,-2.6 -5,-2.7 35,-0.2 2,-0.4 -0.912 31.6 179.7-121.4 132.7 36.0 0.9 55.7 45 44 A C E -De 38 82A 0 36,-2.1 38,-2.2 -2,-0.4 2,-0.4 -0.971 0.8-179.5-135.7 125.7 32.9 3.0 56.4 46 45 A X E +De 37 83A 1 -9,-3.3 -9,-2.5 -2,-0.4 -10,-2.1 -0.990 12.6 173.2-123.6 127.9 31.2 5.3 53.8 47 46 A F E -De 35 84A 1 36,-2.4 38,-2.7 -2,-0.4 2,-0.5 -0.945 30.2-128.7-134.7 159.5 28.1 7.4 54.7 48 47 A R E -De 34 85A 14 -14,-2.9 -14,-2.7 -2,-0.3 2,-0.6 -0.911 21.0-158.2-102.5 127.2 25.9 10.1 53.3 49 48 A X E -D 33 0A 2 36,-2.6 38,-0.5 -2,-0.5 2,-0.4 -0.949 4.8-165.9-111.7 115.5 25.2 13.1 55.6 50 49 A K E -D 32 0A 84 -18,-2.7 -18,-1.8 -2,-0.6 2,-0.4 -0.862 4.6-172.0 -98.0 133.4 22.1 15.1 54.9 51 50 A I E -D 31 0A 28 -2,-0.4 -20,-0.2 -20,-0.2 3,-0.1 -0.999 28.2-114.9-126.6 131.2 21.9 18.5 56.5 52 51 A Y - 0 0 124 -22,-2.8 2,-0.3 -2,-0.4 -21,-0.0 -0.295 45.2 -90.0 -64.0 147.5 18.7 20.5 56.3 53 52 A K - 0 0 165 1,-0.1 2,-0.3 2,-0.0 -1,-0.1 -0.440 51.9-143.4 -62.5 122.0 19.0 23.7 54.3 54 53 A Q - 0 0 83 -2,-0.3 -1,-0.1 1,-0.1 4,-0.1 -0.690 21.2-154.2 -97.2 142.6 20.1 26.3 56.9 55 54 A G S S+ 0 0 85 -2,-0.3 2,-0.2 2,-0.1 -1,-0.1 0.739 86.5 30.2 -78.5 -24.5 19.0 30.0 57.1 56 55 A K S S- 0 0 176 -3,-0.0 2,-0.3 1,-0.0 -2,-0.1 -0.738 99.5 -80.6-125.0 172.9 22.3 30.8 58.9 57 56 A S + 0 0 96 -2,-0.2 -2,-0.1 1,-0.1 3,-0.0 -0.593 40.6 169.6 -69.3 132.2 25.9 29.5 59.2 58 57 A I >> + 0 0 36 -2,-0.3 4,-2.3 -4,-0.1 3,-1.2 -0.022 30.9 130.1-128.9 28.7 26.1 26.4 61.4 59 58 A N H 3> S+ 0 0 18 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.873 70.1 56.5 -54.7 -37.9 29.7 25.6 60.5 60 59 A T H 3> S+ 0 0 108 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.858 110.6 46.7 -60.5 -35.0 30.8 25.3 64.2 61 60 A Y H <> S+ 0 0 71 -3,-1.2 4,-2.8 2,-0.2 -2,-0.2 0.926 110.2 50.3 -74.3 -45.5 28.0 22.6 64.6 62 61 A I H X S+ 0 0 3 -4,-2.3 4,-2.5 1,-0.2 5,-0.2 0.916 109.5 52.6 -55.9 -46.9 28.9 20.7 61.4 63 62 A K H X S+ 0 0 64 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.872 110.8 48.0 -54.0 -43.8 32.5 20.6 62.7 64 63 A E H X S+ 0 0 32 -4,-1.4 4,-3.3 -5,-0.2 5,-0.3 0.920 109.8 51.3 -65.0 -44.9 31.3 19.2 66.0 65 64 A I H X S+ 0 0 1 -4,-2.8 4,-2.6 1,-0.2 5,-0.2 0.958 113.8 44.2 -59.5 -47.9 29.1 16.6 64.3 66 65 A L H X S+ 0 0 1 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.906 114.5 49.2 -62.6 -41.0 31.9 15.4 62.2 67 66 A S H X S+ 0 0 48 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.936 112.9 47.4 -66.3 -46.6 34.4 15.4 65.1 68 67 A V H X S+ 0 0 26 -4,-3.3 4,-1.7 1,-0.2 -2,-0.2 0.914 115.9 43.6 -57.0 -49.3 32.0 13.5 67.3 69 68 A F H X S+ 0 0 2 -4,-2.6 4,-2.6 -5,-0.3 -2,-0.2 0.862 112.0 52.4 -72.2 -36.5 31.2 10.9 64.7 70 69 A X H X S+ 0 0 3 -4,-2.5 4,-3.1 -5,-0.2 5,-0.4 0.930 107.3 52.2 -64.7 -44.4 34.8 10.4 63.5 71 70 A E H X>S+ 0 0 90 -4,-2.1 4,-2.4 -5,-0.2 5,-0.7 0.929 111.8 48.5 -54.8 -46.0 36.0 9.8 67.1 72 71 A F H X5S+ 0 0 54 -4,-1.7 4,-1.1 3,-0.2 -2,-0.2 0.905 116.8 40.2 -55.9 -52.4 33.2 7.2 67.3 73 72 A L H X5S+ 0 0 9 -4,-2.6 6,-1.9 3,-0.2 4,-0.5 0.933 124.2 36.2 -66.9 -49.3 34.2 5.5 64.0 74 73 A F H <5S+ 0 0 4 -4,-3.1 4,-0.3 -5,-0.2 -3,-0.2 0.850 130.5 25.9 -72.5 -39.9 38.0 5.7 64.4 75 74 A K H <5S+ 0 0 79 -4,-2.4 -3,-0.2 -5,-0.4 -2,-0.1 0.684 130.7 32.6-108.1 -21.9 38.4 5.1 68.1 76 75 A S H < - F 0 119A 29 -38,-0.5 3,-1.9 -2,-0.3 32,-0.2 -0.382 37.6-119.6 -56.6 141.0 25.3 17.5 48.8 88 87 A E T 3 S+ 0 0 65 30,-2.0 4,-0.2 1,-0.3 -1,-0.1 0.697 109.2 71.9 -67.6 -16.0 27.4 20.3 47.4 89 88 A E T 3 S+ 0 0 106 29,-0.3 -1,-0.3 2,-0.1 2,-0.1 0.718 76.9 96.2 -63.1 -25.1 25.1 22.8 49.1 90 89 A V S < S- 0 0 21 -3,-1.9 2,-0.3 1,-0.1 -4,-0.1 -0.439 95.9 -95.5 -69.9 145.6 26.6 21.8 52.5 91 90 A S - 0 0 40 1,-0.2 4,-0.4 -2,-0.1 -1,-0.1 -0.466 32.7-164.1 -68.4 119.1 29.4 24.1 53.7 92 91 A T S > S+ 0 0 44 -2,-0.3 4,-2.1 1,-0.2 5,-0.2 0.580 72.7 86.1 -82.7 -10.2 32.7 22.4 52.7 93 92 A Q H > S+ 0 0 88 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.920 84.0 52.9 -57.3 -48.6 34.7 24.7 55.1 94 93 A P H > S+ 0 0 0 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.892 109.6 50.5 -58.7 -37.4 34.2 22.5 58.1 95 94 A F H 4>S+ 0 0 0 -4,-0.4 5,-2.4 2,-0.2 4,-0.5 0.914 112.1 45.0 -65.6 -45.3 35.5 19.4 56.2 96 95 A V H ><5S+ 0 0 78 -4,-2.1 3,-1.0 1,-0.2 -1,-0.2 0.907 111.6 53.2 -67.9 -39.5 38.6 21.2 54.9 97 96 A E H 3<5S+ 0 0 103 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.759 107.7 51.3 -68.0 -25.0 39.4 22.7 58.4 98 97 A L T 3<5S- 0 0 54 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.532 123.0-104.9 -88.5 -4.7 39.2 19.3 60.0 99 98 A G T < 5 + 0 0 33 -3,-1.0 -3,-0.2 -4,-0.5 2,-0.2 0.608 63.7 154.9 94.0 13.0 41.6 17.8 57.5 100 99 A F < - 0 0 11 -5,-2.4 2,-0.3 -6,-0.2 -1,-0.3 -0.501 38.1-129.3 -70.2 143.5 39.4 15.8 55.2 101 100 A A E -G 123 0A 42 22,-2.9 22,-2.8 -2,-0.2 2,-0.7 -0.672 14.4-123.6 -85.5 142.5 40.5 15.2 51.6 102 101 A F E +G 122 0A 98 -2,-0.3 20,-0.3 20,-0.2 3,-0.1 -0.817 34.1 176.2 -77.9 113.1 38.2 15.9 48.6 103 102 A E E - 0 0 18 18,-3.3 132,-1.8 -2,-0.7 2,-0.3 0.679 53.7 -42.9-100.9 -17.2 38.3 12.5 47.0 104 103 A G E -GH 121 234A 12 17,-1.6 17,-2.8 130,-0.2 2,-0.4 -0.986 46.3-103.7 174.4-178.4 35.8 13.2 44.2 105 104 A I E -G 120 0A 68 128,-1.8 2,-1.1 -2,-0.3 15,-0.2 -0.995 20.5-152.5-131.9 119.6 32.6 14.8 42.9 106 105 A I E > -G 119 0A 1 13,-3.5 13,-2.5 -2,-0.4 3,-0.7 -0.838 25.3-147.6 -92.8 99.2 29.7 12.5 42.2 107 106 A N E 3 - 0 0 61 -2,-1.1 11,-0.2 11,-0.2 10,-0.1 -0.414 66.1 -3.5 -72.1 139.0 27.9 14.5 39.5 108 107 A K E 3 S+ 0 0 64 -2,-0.1 10,-0.2 1,-0.1 -1,-0.2 0.790 82.1 131.7 57.3 38.3 24.1 14.5 39.2 109 108 A S E < + 0 0 1 8,-0.9 2,-0.4 -3,-0.7 9,-0.2 0.414 59.9 67.3 -95.9 -3.8 23.4 11.9 41.9 110 109 A I E -G 117 0A 10 7,-1.8 7,-2.9 63,-0.1 2,-0.5 -0.985 57.4-170.0-120.3 132.3 20.6 14.1 43.5 111 110 A I E +G 116 0A 43 -2,-0.4 2,-0.4 5,-0.2 5,-0.2 -0.983 16.9 167.9-115.6 120.6 17.3 15.0 42.1 112 111 A E E > S-G 115 0A 62 3,-2.2 3,-1.8 -2,-0.5 -2,-0.0 -0.990 71.5 -19.7-137.8 121.7 15.5 17.7 44.1 113 112 A K T 3 S- 0 0 177 -2,-0.4 -1,-0.1 1,-0.2 3,-0.1 0.887 128.0 -53.8 35.2 48.6 12.4 19.5 42.9 114 113 A N T 3 S+ 0 0 161 1,-0.2 2,-0.4 0, 0.0 -1,-0.2 0.471 113.5 106.0 76.3 12.2 13.4 18.4 39.4 115 114 A V E < - 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