==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER UNKNOWN FUNCTION 23-JAN-05 1YN5 . COMPND 2 MOLECULE: EAPH2; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS; . AUTHOR B.V.GEISBRECHT,B.Y.HAMAOKA,B.PERMAN,A.ZEMLA,D.J.LEAHY . 203 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12462.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 151 74.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 5.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 59 29.1 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 . 2 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 . 24 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 36 17.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 0 2 0 0 0 0 0 0 0 0 0 2 0 0 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 . 0 2 2 0 3 1 0 2 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 . 2 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 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 42 A A 0 0 85 0, 0.0 29,-0.0 0, 0.0 27,-0.0 0.000 360.0 360.0 360.0 -46.3 17.0 13.4 -9.5 2 43 A K + 0 0 186 25,-0.1 27,-0.1 2,-0.1 28,-0.0 0.845 360.0 97.5 -76.8 -47.3 17.5 10.4 -11.6 3 44 A E - 0 0 113 24,-0.1 25,-2.7 1,-0.1 2,-0.1 -0.214 67.6-133.8 -51.7 131.4 20.7 8.4 -10.5 4 45 A M E -A 27 0A 92 23,-0.2 2,-0.3 21,-0.0 -1,-0.1 -0.450 15.0-155.5 -88.3 161.8 19.8 5.5 -8.2 5 46 A Q E -A 26 0A 97 21,-1.0 21,-1.5 -2,-0.1 2,-0.6 -0.981 21.0-116.7-136.9 145.9 21.5 4.6 -4.9 6 47 A N E -A 25 0A 102 -2,-0.3 19,-0.2 19,-0.2 17,-0.0 -0.771 27.8-172.0 -88.0 119.7 21.6 1.2 -3.1 7 48 A V E -A 24 0A 9 17,-3.2 17,-1.5 -2,-0.6 88,-0.1 -0.949 17.7-140.0-111.4 114.1 19.9 1.3 0.3 8 49 A P E +A 23 0A 23 0, 0.0 88,-1.9 0, 0.0 2,-0.3 -0.406 24.2 179.6 -73.5 152.2 20.5 -1.9 2.2 9 50 A Y E -Ab 22 96A 11 13,-1.7 13,-0.9 86,-0.2 2,-0.3 -0.964 16.0-149.4-147.4 159.0 17.6 -3.4 4.2 10 51 A T E - b 0 97A 29 86,-1.8 88,-3.2 -2,-0.3 2,-0.5 -0.962 7.4-150.0-130.6 150.1 17.1 -6.5 6.4 11 52 A I E + b 0 98A 0 -2,-0.3 7,-1.0 86,-0.2 2,-0.5 -0.981 14.0 178.8-125.9 124.3 13.9 -8.5 7.0 12 53 A A E -Cb 17 99A 8 86,-2.3 88,-3.0 -2,-0.5 2,-0.6 -0.980 3.1-179.0-125.3 118.7 13.2 -10.2 10.3 13 54 A V E > S-Cb 16 100A 22 3,-2.5 3,-2.2 -2,-0.5 88,-0.2 -0.962 81.2 -22.8-119.1 113.4 10.0 -12.2 10.7 14 55 A D T 3 S- 0 0 89 86,-3.3 -1,-0.2 -2,-0.6 87,-0.1 0.897 130.0 -50.1 54.1 41.2 9.7 -13.7 14.2 15 56 A G T 3 S+ 0 0 62 85,-0.4 -1,-0.3 1,-0.3 2,-0.2 0.083 109.6 127.8 87.7 -25.5 13.4 -13.5 14.4 16 57 A I E < -C 13 0A 59 -3,-2.2 -3,-2.5 -4,-0.1 2,-0.3 -0.498 39.8-168.6 -70.1 130.1 14.0 -15.2 11.0 17 58 A M E -C 12 0A 99 -2,-0.2 -5,-0.2 -5,-0.2 -7,-0.0 -0.883 26.3 -92.4-121.6 152.9 16.4 -13.1 8.8 18 59 A A - 0 0 31 -7,-1.0 -1,-0.1 -2,-0.3 4,-0.0 -0.194 41.5-107.6 -56.7 150.8 17.4 -13.2 5.2 19 60 A F S S- 0 0 205 2,-0.0 -1,-0.1 1,-0.0 -2,-0.0 0.917 89.3 -27.8 -52.8 -55.6 20.4 -15.2 4.2 20 61 A N S S- 0 0 139 0, 0.0 2,-0.4 0, 0.0 -2,-0.1 0.440 95.5 -59.9-133.5 -78.6 22.8 -12.0 3.4 21 62 A Q - 0 0 91 -11,-0.1 2,-0.3 -13,-0.0 -11,-0.1 -0.867 35.0-161.2-176.7 141.1 21.7 -8.9 2.4 22 63 A S E -A 9 0A 33 -13,-0.9 -13,-1.7 -2,-0.4 2,-0.3 -0.773 13.2-135.5-122.9 171.6 19.9 -7.2 -0.2 23 64 A Y E -A 8 0A 126 -2,-0.3 2,-0.3 -15,-0.2 -17,-0.1 -0.782 4.3-151.7-123.8 167.2 19.5 -3.7 -1.5 24 65 A L E -A 7 0A 14 -17,-1.5 -17,-3.2 -2,-0.3 2,-0.4 -0.988 21.1-121.7-138.1 143.6 16.8 -1.4 -2.6 25 66 A N E +A 6 0A 73 -2,-0.3 -19,-0.2 -19,-0.2 -21,-0.0 -0.760 29.6 169.8 -98.4 132.7 16.9 1.5 -5.1 26 67 A L E -A 5 0A 6 -21,-1.5 -21,-1.0 -2,-0.4 2,-0.1 -1.000 38.0-109.5-137.4 133.8 16.0 5.1 -4.4 27 68 A P E -A 4 0A 37 0, 0.0 3,-0.5 0, 0.0 -23,-0.2 -0.374 36.0-130.3 -61.1 132.5 16.6 8.2 -6.5 28 69 A K S S+ 0 0 66 -25,-2.7 3,-0.1 1,-0.2 62,-0.0 -0.368 86.2 28.3 -79.0 165.9 19.3 10.4 -5.0 29 70 A D S S+ 0 0 85 1,-0.2 2,-0.3 -2,-0.1 -1,-0.2 0.854 98.1 122.3 50.9 45.6 18.6 14.2 -4.6 30 71 A S - 0 0 17 -3,-0.5 60,-2.8 -28,-0.0 2,-0.8 -0.932 64.0-132.7-137.1 157.4 14.8 13.6 -4.1 31 72 A Q E -F 89 0B 119 -2,-0.3 58,-0.2 58,-0.2 2,-0.2 -0.895 39.7-172.2-108.6 98.9 12.0 14.3 -1.7 32 73 A L E -F 88 0B 38 56,-1.8 56,-2.5 -2,-0.8 2,-0.3 -0.469 21.6-108.0 -93.4 165.9 10.2 11.0 -1.5 33 74 A S E > -F 87 0B 20 54,-0.3 4,-2.1 -2,-0.2 54,-0.2 -0.700 7.9-142.5 -95.2 138.1 6.9 10.0 0.2 34 75 A Y H > S+ 0 0 33 52,-1.8 4,-2.7 -2,-0.3 5,-0.2 0.805 104.6 61.3 -67.3 -26.1 6.7 7.8 3.3 35 76 A L H > S+ 0 0 54 51,-0.3 4,-1.3 49,-0.2 -1,-0.2 0.942 106.2 44.1 -63.4 -47.3 3.6 6.3 1.6 36 77 A D H > S+ 0 0 106 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.890 114.7 48.8 -63.9 -42.4 5.6 5.0 -1.3 37 78 A L H X S+ 0 0 4 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.911 109.6 51.9 -65.3 -41.1 8.4 3.8 1.0 38 79 A G H X S+ 0 0 8 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.795 108.0 54.0 -64.3 -27.2 6.0 2.1 3.2 39 80 A N H X S+ 0 0 99 -4,-1.3 4,-2.6 2,-0.2 -1,-0.2 0.903 105.8 50.3 -73.1 -43.4 4.6 0.4 0.1 40 81 A K H X S+ 0 0 93 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.928 110.0 52.4 -59.8 -44.3 8.0 -0.9 -0.9 41 82 A V H X S+ 0 0 1 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.923 110.6 46.1 -57.6 -47.1 8.4 -2.3 2.5 42 83 A K H X S+ 0 0 57 -4,-1.9 4,-2.5 1,-0.2 5,-0.2 0.877 110.6 55.2 -65.7 -33.9 5.1 -4.1 2.3 43 84 A A H X S+ 0 0 39 -4,-2.6 4,-3.3 1,-0.2 5,-0.3 0.947 108.2 47.3 -61.2 -50.6 6.1 -5.3 -1.2 44 85 A L H X>S+ 0 0 30 -4,-2.7 4,-3.1 1,-0.2 5,-0.7 0.899 110.7 53.0 -58.2 -43.2 9.3 -6.8 0.1 45 86 A L H X>S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.2 6,-1.5 0.952 116.6 37.0 -59.7 -50.6 7.4 -8.5 3.0 46 87 A Y H X5S+ 0 0 148 -4,-2.5 4,-2.3 4,-0.3 -2,-0.2 0.981 121.2 46.6 -64.6 -56.9 4.9 -10.1 0.7 47 88 A D H <5S+ 0 0 126 -4,-3.3 -2,-0.2 -5,-0.2 -3,-0.2 0.923 126.6 25.5 -50.5 -56.1 7.4 -10.8 -2.1 48 89 A E H <5S+ 0 0 79 -4,-3.1 -3,-0.2 -5,-0.3 -1,-0.2 0.827 138.3 22.5 -84.0 -33.2 10.1 -12.3 0.1 49 90 A R H <> - 0 0 30 -2,-0.5 4,-1.9 -3,-0.1 3,-1.5 -0.442 31.1-108.8 -94.0 166.5 -0.0 -10.5 3.9 53 94 A P H 3> S+ 0 0 87 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.833 123.3 57.7 -61.6 -26.9 -1.8 -7.3 5.0 54 95 A E H 3> S+ 0 0 122 2,-0.2 4,-1.1 1,-0.2 -3,-0.0 0.605 104.1 48.3 -77.2 -18.2 -3.8 -9.6 7.2 55 96 A K H <> S+ 0 0 90 -3,-1.5 4,-0.8 2,-0.2 -1,-0.2 0.832 112.0 50.7 -83.6 -40.7 -0.7 -11.0 8.9 56 97 A I H < S+ 0 0 12 -4,-1.9 -2,-0.2 2,-0.2 3,-0.1 0.868 110.4 50.4 -63.4 -45.3 0.5 -7.4 9.5 57 98 A R H < S+ 0 0 153 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.951 117.5 37.1 -61.9 -50.1 -2.9 -6.6 11.0 58 99 A N H < S+ 0 0 117 -4,-1.1 -1,-0.2 -5,-0.1 -2,-0.2 0.548 95.1 121.6 -78.8 -8.3 -3.0 -9.5 13.4 59 100 A A S < S- 0 0 2 -4,-0.8 43,-0.2 1,-0.1 3,-0.2 -0.099 72.1-129.0 -55.8 152.5 0.8 -9.2 14.0 60 101 A K S S- 0 0 123 41,-2.3 2,-0.3 1,-0.4 42,-0.2 0.927 94.4 -16.9 -65.8 -43.7 2.0 -8.6 17.5 61 102 A S E -D 101 0A 47 40,-1.6 40,-2.7 2,-0.0 2,-0.4 -0.951 61.1-168.2-162.4 142.3 3.9 -5.7 15.9 62 103 A A E +D 100 0A 1 -2,-0.3 16,-2.2 38,-0.2 17,-0.9 -0.995 29.8 139.1-135.7 125.4 4.9 -4.8 12.4 63 104 A V E -DE 99 77A 18 36,-1.5 36,-3.0 -2,-0.4 2,-0.4 -0.990 38.0-145.8-162.7 163.1 7.4 -2.0 11.8 64 105 A Y E -DE 98 76A 2 12,-1.9 12,-2.8 -2,-0.3 2,-0.5 -0.994 19.9-145.1-138.8 132.8 10.4 -0.9 9.8 65 106 A T E -DE 97 75A 29 32,-3.2 32,-2.6 -2,-0.4 2,-0.5 -0.904 7.6-150.6-107.0 126.4 13.1 1.2 11.3 66 107 A I E -DE 96 74A 0 8,-3.2 8,-2.1 -2,-0.5 2,-0.6 -0.788 4.3-161.7 -95.5 129.8 14.9 3.9 9.3 67 108 A T E -DE 95 73A 12 28,-2.7 27,-2.2 -2,-0.5 28,-1.8 -0.954 12.7-150.4-112.7 118.6 18.5 4.8 10.0 68 109 A W E > -D 93 0A 39 4,-2.1 3,-1.7 -2,-0.6 25,-0.2 -0.300 31.4-101.4 -77.1 169.6 19.6 8.2 8.6 69 110 A K T 3 S+ 0 0 126 23,-2.0 24,-0.1 1,-0.3 -1,-0.1 0.852 120.8 61.5 -63.7 -32.1 23.1 8.8 7.6 70 111 A D T 3 S- 0 0 79 22,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.464 119.5-109.0 -74.4 2.8 23.8 10.7 10.8 71 112 A G S < S+ 0 0 33 -3,-1.7 -2,-0.1 1,-0.3 -1,-0.1 0.231 77.7 128.4 92.4 -16.8 23.1 7.5 12.7 72 113 A S - 0 0 25 -5,-0.1 -4,-2.1 1,-0.1 2,-0.3 -0.202 46.6-137.2 -68.8 165.0 19.7 8.7 14.2 73 114 A K E -E 67 0A 140 -6,-0.2 2,-0.4 97,-0.2 -6,-0.2 -0.923 18.6-167.3-132.9 155.3 16.6 6.5 13.9 74 115 A K E -E 66 0A 84 -8,-2.1 -8,-3.2 -2,-0.3 2,-0.5 -0.992 15.1-150.0-137.7 126.6 12.9 6.7 13.1 75 116 A E E -E 65 0A 139 -2,-0.4 2,-0.6 -10,-0.2 -10,-0.2 -0.865 8.1-160.2-101.6 127.7 10.5 3.8 13.7 76 117 A V E -E 64 0A 30 -12,-2.8 -12,-1.9 -2,-0.5 2,-0.5 -0.932 10.9-142.0-113.7 118.3 7.5 3.5 11.4 77 118 A D E > -E 63 0A 68 -2,-0.6 3,-0.8 -14,-0.2 -14,-0.3 -0.631 11.4-170.2 -78.0 117.6 4.5 1.4 12.6 78 119 A L G > S+ 0 0 7 -16,-2.2 3,-0.6 -2,-0.5 -15,-0.2 0.631 81.5 72.7 -84.4 -13.2 3.0 -0.6 9.7 79 120 A K G 3 S+ 0 0 89 -17,-0.9 -1,-0.2 1,-0.3 2,-0.1 0.559 95.5 56.8 -76.5 -6.1 0.0 -1.6 11.8 80 121 A K G < S+ 0 0 156 -3,-0.8 -1,-0.3 2,-0.1 2,-0.2 -0.520 73.0 168.4-121.0 58.7 -1.1 2.0 11.4 81 122 A D < + 0 0 83 -3,-0.6 2,-0.2 -2,-0.1 -3,-0.1 -0.509 18.8 137.0 -67.6 142.4 -1.2 2.3 7.7 82 123 A S - 0 0 79 -2,-0.2 -2,-0.1 2,-0.0 0, 0.0 -0.802 57.4 -74.4 173.9 142.2 -2.9 5.5 7.0 83 124 A Y + 0 0 194 -2,-0.2 2,-0.3 2,-0.0 0, 0.0 -0.136 48.3 171.1 -56.8 143.1 -2.4 8.4 4.5 84 125 A T - 0 0 38 2,-0.1 -49,-0.2 1,-0.1 -2,-0.0 -0.983 29.6-157.6-149.1 151.2 0.4 10.9 5.1 85 126 A A + 0 0 62 -2,-0.3 -1,-0.1 -51,-0.1 -2,-0.0 0.505 53.7 124.9-108.1 -7.9 1.8 13.7 2.9 86 127 A N - 0 0 99 -53,-0.1 -52,-1.8 1,-0.0 -51,-0.3 -0.232 41.5-163.8 -58.1 135.4 5.2 13.8 4.6 87 128 A L E -F 33 0B 103 -54,-0.2 2,-0.3 -53,-0.1 -54,-0.3 -0.798 1.8-152.1-116.9 159.9 8.2 13.5 2.4 88 129 A F E -F 32 0B 12 -56,-2.5 -56,-1.8 -2,-0.3 2,-0.7 -0.881 27.3 -96.0-130.7 164.5 11.8 12.7 3.4 89 130 A D E > -F 31 0B 66 -2,-0.3 3,-2.0 -58,-0.2 4,-0.5 -0.710 22.5-153.0 -85.4 114.8 15.3 13.4 1.9 90 131 A S G > S+ 0 0 10 -60,-2.8 3,-1.2 -2,-0.7 -1,-0.2 0.838 96.3 58.3 -52.9 -38.2 16.6 10.6 -0.2 91 132 A N G 3 S+ 0 0 64 -61,-0.3 -1,-0.3 1,-0.2 -22,-0.1 0.682 98.6 61.9 -67.9 -15.9 20.2 11.6 0.5 92 133 A S G < S+ 0 0 45 -3,-2.0 -23,-2.0 -24,-0.1 2,-0.3 0.595 79.4 106.6 -85.5 -13.0 19.5 11.1 4.3 93 134 A I E < + D 0 68A 4 -3,-1.2 -25,-0.2 -4,-0.5 3,-0.1 -0.502 30.0 158.3 -74.1 130.9 18.7 7.4 4.0 94 135 A K E - 0 0 110 -27,-2.2 2,-0.3 1,-0.4 -26,-0.2 0.746 62.0 -12.7-113.9 -53.3 21.3 4.9 5.3 95 136 A Q E - 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h 0 198C 26 86,-1.8 88,-2.7 -2,-0.3 2,-0.4 -0.983 5.5-151.2-136.9 147.6 25.6 26.9 22.9 112 52 B I E + h 0 199C 0 -2,-0.3 7,-0.6 86,-0.2 2,-0.4 -0.973 12.9 176.6-127.5 132.4 26.8 29.0 25.8 113 53 B A E +Ih 118 200C 13 86,-1.5 88,-2.6 -2,-0.4 2,-0.4 -0.997 4.2 177.8-133.0 127.6 24.8 30.8 28.4 114 54 B V E > S-Ih 117 201C 22 3,-1.0 3,-1.1 -2,-0.4 88,-0.2 -0.910 85.8 -21.7-130.8 103.9 26.3 32.8 31.4 115 55 B D T 3 S- 0 0 93 86,-1.8 87,-0.1 -2,-0.4 3,-0.1 0.922 132.5 -48.8 60.8 41.2 23.6 34.5 33.5 116 56 B G T 3 S+ 0 0 65 85,-0.3 2,-1.0 1,-0.2 -1,-0.3 0.411 103.2 136.0 80.9 -1.5 21.4 34.2 30.4 117 57 B I E < -I 114 0C 48 -3,-1.1 -3,-1.0 3,-0.0 -1,-0.2 -0.715 37.4-165.2 -85.8 105.7 23.9 35.6 27.9 118 58 B M E -I 113 0C 107 -2,-1.0 -5,-0.2 -5,-0.2 2,-0.1 -0.442 30.9 -87.6 -85.0 160.2 23.7 33.3 24.9 119 59 B A - 0 0 31 -7,-0.6 -1,-0.1 1,-0.1 3,-0.0 -0.475 29.6-146.0 -68.8 138.6 26.3 33.2 22.1 120 60 B F S S+ 0 0 192 -2,-0.1 2,-0.4 1,-0.1 -1,-0.1 0.889 84.3 38.6 -73.3 -41.6 25.5 35.7 19.4 121 61 B N S S- 0 0 117 -3,-0.0 2,-0.5 0, 0.0 -1,-0.1 -0.907 93.0-111.5-112.6 140.2 26.8 33.6 16.5 122 62 B Q - 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