==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-DEC-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 14-DEC-10 3PZ9 . COMPND 2 MOLECULE: MANNAN ENDO-1,4-BETA-MANNOSIDASE. GLYCOSYL HYDROL . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOTOGA PETROPHILA; . AUTHOR C.R.SANTOS,A.N.MEZA,J.H.PAIVA,J.C.SILVA,R.RULLER,R.A.PRADE, . 357 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13747.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 257 72.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 45 12.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 2.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 20 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 114 31.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.2 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 1 0 1 1 0 1 0 0 0 1 2 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 2 1 3 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 . 5 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 0 1 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 37 A F 0 0 144 0, 0.0 2,-0.3 0, 0.0 356,-0.0 0.000 360.0 360.0 360.0 104.0 15.1 0.2 17.8 2 38 A R + 0 0 62 308,-0.0 2,-0.3 2,-0.0 308,-0.2 -0.896 360.0 168.6-126.8 154.0 15.1 3.3 15.5 3 39 A F E -a 310 0A 7 306,-1.8 308,-1.8 -2,-0.3 2,-0.5 -0.997 43.0-117.6-159.2 156.0 12.2 4.5 13.6 4 40 A I E +a 311 0A 2 26,-0.4 28,-2.3 -2,-0.3 29,-0.8 -0.886 49.0 169.6 -91.2 130.5 10.2 6.9 11.5 5 41 A G E -ab 312 33A 0 306,-2.4 308,-1.5 -2,-0.5 2,-0.3 -0.767 18.4-161.0-128.5-177.4 7.1 7.9 13.4 6 42 A S E -ab 313 34A 0 27,-2.1 29,-2.6 306,-0.3 2,-0.3 -0.877 16.6-115.5-151.8-171.8 4.3 10.4 13.3 7 43 A N E + b 0 35A 0 306,-0.8 309,-2.5 -2,-0.3 308,-0.4 -0.952 21.3 175.5-127.5 146.2 1.6 12.1 15.5 8 44 A N E - b 0 36A 0 27,-2.4 29,-0.5 -2,-0.3 3,-0.4 -0.885 8.8-171.3-152.9 127.4 -2.2 12.0 15.4 9 45 A Y S S+ 0 0 37 -2,-0.3 3,-0.3 27,-0.2 27,-0.1 0.431 75.8 65.1 -98.7 3.1 -4.4 13.7 18.1 10 46 A Y >> + 0 0 0 1,-0.2 3,-1.9 2,-0.1 4,-1.9 0.392 63.8 103.6-114.3 14.0 -7.8 12.4 17.2 11 47 A M T 34 S+ 0 0 1 -3,-0.4 68,-0.3 1,-0.3 -1,-0.2 0.420 79.4 56.5 -72.4 -4.0 -7.4 8.7 18.0 12 48 A H T 34 S+ 0 0 0 -3,-0.3 63,-0.3 27,-0.1 64,-0.3 0.392 119.6 22.9-111.9 10.2 -9.3 9.1 21.3 13 49 A Y T <4 S+ 0 0 12 -3,-1.9 -2,-0.2 62,-0.2 -3,-0.1 0.489 96.4 89.1-151.1 -1.7 -12.6 10.5 19.8 14 50 A K S < S- 0 0 36 -4,-1.9 35,-0.0 1,-0.2 2,-0.0 -0.299 78.8 -81.7 -95.2 178.0 -13.1 9.7 16.1 15 51 A S > - 0 0 29 1,-0.1 4,-2.8 -2,-0.1 5,-0.2 -0.234 36.2-106.1 -76.4 168.0 -14.9 6.7 14.6 16 52 A N H > S+ 0 0 66 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.914 120.8 54.6 -55.9 -40.8 -13.6 3.2 13.9 17 53 A R H > S+ 0 0 118 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.898 111.2 43.4 -62.1 -41.8 -13.4 4.0 10.2 18 54 A M H > S+ 0 0 2 -3,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.894 115.5 48.1 -73.2 -38.0 -11.2 7.1 10.8 19 55 A I H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 5,-0.2 0.946 111.8 50.2 -66.1 -42.8 -9.0 5.3 13.4 20 56 A D H X S+ 0 0 33 -4,-3.2 4,-3.3 1,-0.2 5,-0.3 0.889 108.1 54.9 -62.3 -40.5 -8.5 2.3 11.1 21 57 A S H X S+ 0 0 21 -4,-1.8 4,-2.2 -5,-0.3 -1,-0.2 0.935 109.7 44.8 -62.8 -41.9 -7.6 4.7 8.3 22 58 A V H X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 -1,-0.2 0.946 117.2 44.3 -65.8 -44.6 -4.8 6.4 10.3 23 59 A L H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.908 114.3 48.9 -72.4 -37.4 -3.3 3.1 11.6 24 60 A E H X S+ 0 0 83 -4,-3.3 4,-2.9 -5,-0.2 -1,-0.2 0.870 111.4 50.9 -62.3 -38.3 -3.6 1.3 8.2 25 61 A S H X S+ 0 0 13 -4,-2.2 4,-2.3 -5,-0.3 6,-0.2 0.936 109.0 51.0 -63.4 -45.9 -1.9 4.3 6.6 26 62 A A H X>S+ 0 0 0 -4,-2.6 5,-2.4 2,-0.2 4,-1.0 0.936 113.2 45.1 -54.6 -49.1 0.9 4.2 9.2 27 63 A R H ><5S+ 0 0 145 -4,-2.4 3,-0.9 1,-0.2 -2,-0.2 0.937 113.7 49.7 -61.6 -46.1 1.4 0.4 8.5 28 64 A D H 3<5S+ 0 0 112 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.852 113.9 45.4 -64.3 -31.3 1.3 1.0 4.7 29 65 A M H 3<5S- 0 0 3 -4,-2.3 -1,-0.2 -5,-0.2 325,-0.2 0.555 114.2-113.0 -90.6 -5.1 3.9 3.8 4.9 30 66 A G T <<5 + 0 0 30 -4,-1.0 2,-0.5 -3,-0.9 -26,-0.4 0.640 61.7 153.8 84.8 12.7 6.3 2.0 7.2 31 67 A I < - 0 0 1 -5,-2.4 -1,-0.3 -6,-0.2 -26,-0.2 -0.680 21.5-174.1 -82.2 120.7 5.6 4.4 10.1 32 68 A K + 0 0 90 -28,-2.3 57,-2.6 -2,-0.5 2,-0.4 0.647 61.1 40.0 -92.1 -23.9 6.4 2.3 13.2 33 69 A V E -bc 5 89A 0 -29,-0.8 -27,-2.1 55,-0.2 2,-0.4 -0.999 58.7-166.3-133.9 133.6 5.4 4.6 16.1 34 70 A L E -bc 6 90A 0 55,-2.6 57,-2.3 -2,-0.4 2,-0.5 -0.990 12.7-147.9-123.3 129.4 2.4 7.0 16.4 35 71 A R E +bc 7 91A 1 -29,-2.6 -27,-2.4 -2,-0.4 2,-0.3 -0.879 29.7 173.4 -96.0 123.8 2.3 9.7 19.2 36 72 A I E -bc 8 92A 0 55,-2.9 57,-2.5 -2,-0.5 2,-0.3 -0.825 34.0-101.4-132.3 163.3 -1.3 10.3 20.4 37 73 A W E - c 0 93A 11 -29,-0.5 57,-0.1 -2,-0.3 55,-0.0 -0.692 21.7-174.0 -87.2 139.6 -3.2 12.2 23.0 38 74 A G + 0 0 0 55,-2.6 2,-0.3 -2,-0.3 -1,-0.1 -0.164 60.6 79.3-119.6 36.5 -4.4 10.3 26.1 39 75 A F + 0 0 0 2,-0.0 2,-0.2 56,-0.0 56,-0.1 -0.984 36.9 170.3-142.3 152.4 -6.4 13.2 27.6 40 76 A L - 0 0 0 -2,-0.3 14,-2.5 63,-0.0 13,-0.8 -0.658 27.9-173.9-160.9 92.0 -9.6 15.1 27.2 41 77 A D B +h 54 0B 0 60,-2.5 4,-0.2 -2,-0.2 65,-0.1 -0.831 39.5 29.4-101.9 134.2 -10.0 17.5 30.2 42 78 A G S > S- 0 0 0 12,-2.7 4,-2.6 -2,-0.5 5,-0.3 0.325 75.7-102.7 100.6 141.1 -12.9 19.6 31.1 43 79 A E H > S+ 0 0 67 12,-1.2 4,-2.9 1,-0.2 5,-0.2 0.889 117.6 51.7 -64.9 -37.7 -16.6 19.3 30.6 44 80 A S H > S+ 0 0 68 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.888 111.7 45.9 -66.1 -38.3 -16.8 21.8 27.7 45 81 A Y H > S+ 0 0 63 -3,-0.2 4,-1.3 -4,-0.2 -1,-0.2 0.901 114.5 48.7 -70.7 -41.2 -14.0 20.1 25.7 46 82 A C H X>S+ 0 0 0 -4,-2.6 5,-2.2 1,-0.2 4,-0.7 0.935 112.9 47.9 -61.4 -43.9 -15.6 16.6 26.4 47 83 A R H ><5S+ 0 0 139 -4,-2.9 3,-1.1 -5,-0.3 -2,-0.2 0.917 105.1 58.5 -64.9 -37.0 -19.0 17.9 25.3 48 84 A D H 3<5S+ 0 0 115 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.853 118.0 32.1 -61.2 -36.8 -17.6 19.5 22.2 49 85 A K H 3<5S- 0 0 68 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.390 104.0-128.2 -94.9 4.2 -16.3 16.1 21.0 50 86 A N T <<5S+ 0 0 67 -3,-1.1 20,-2.8 -4,-0.7 2,-0.3 0.844 77.5 113.6 44.5 39.9 -19.2 14.2 22.7 51 87 A T E < -i 70 0C 0 -5,-2.2 2,-0.4 18,-0.2 -2,-0.3 -0.989 53.7-154.8-142.9 130.8 -16.4 12.1 24.2 52 88 A Y E +i 71 0C 3 18,-2.2 20,-2.5 -2,-0.3 21,-0.6 -0.904 34.8 138.1-118.4 131.5 -15.5 12.0 27.9 53 89 A M S S- 0 0 0 -13,-0.8 8,-1.8 -2,-0.4 -12,-0.2 0.540 88.8 -1.4-126.3 -46.6 -12.2 11.2 29.7 54 90 A H B +h 41 0B 0 -14,-2.5 -12,-2.7 6,-0.2 6,-0.2 -0.539 66.2 157.5-148.7 70.4 -11.8 13.7 32.5 55 91 A P S S+ 0 0 1 0, 0.0 -12,-1.2 0, 0.0 -11,-0.2 0.805 73.7 1.0 -71.4 -31.1 -14.7 16.2 32.6 56 92 A E B > S-J 59 0D 90 3,-0.6 3,-2.3 -14,-0.2 51,-0.0 -0.970 99.1 -65.8-147.9 164.2 -14.3 17.1 36.3 57 93 A P T 3 S+ 0 0 45 0, 0.0 3,-0.1 0, 0.0 71,-0.0 -0.287 121.6 7.2 -56.3 131.4 -12.1 16.3 39.2 58 94 A G T 3 S+ 0 0 35 1,-0.2 2,-0.6 70,-0.1 -4,-0.0 0.449 102.3 112.5 77.7 1.9 -12.5 12.6 40.2 59 95 A V B < +J 56 0D 52 -3,-2.3 -3,-0.6 4,-0.0 2,-0.6 -0.942 41.8 179.4-110.9 113.9 -14.8 11.9 37.2 60 96 A F - 0 0 44 -2,-0.6 2,-0.2 -6,-0.2 -6,-0.2 -0.964 57.9 -3.2-120.4 113.0 -13.1 9.5 34.7 61 97 A G S S- 0 0 0 -8,-1.8 -8,-0.2 -2,-0.6 10,-0.1 -0.653 116.7 -6.9 100.7-160.4 -15.2 8.6 31.7 62 98 A V S S- 0 0 45 -2,-0.2 -2,-0.1 -10,-0.2 3,-0.1 -0.555 76.1-112.5 -73.6 132.4 -18.8 9.7 31.0 63 99 A P > - 0 0 34 0, 0.0 3,-2.1 0, 0.0 -1,-0.1 -0.289 42.1 -92.9 -60.2 140.3 -20.6 11.6 33.8 64 100 A E T 3 S+ 0 0 204 1,-0.2 3,-0.1 3,-0.0 0, 0.0 -0.288 113.3 25.5 -47.5 135.5 -23.5 9.7 35.4 65 101 A G T 3 S+ 0 0 76 1,-0.2 2,-0.7 -3,-0.1 -1,-0.2 0.379 89.9 115.0 85.4 -7.9 -26.8 10.6 33.7 66 102 A I < - 0 0 58 -3,-2.1 3,-0.3 -4,-0.0 -1,-0.2 -0.883 44.6-177.0 -92.0 123.5 -25.2 11.6 30.4 67 103 A S + 0 0 108 -2,-0.7 3,-0.1 1,-0.2 -3,-0.0 -0.616 57.5 37.5-109.0 168.9 -26.4 9.2 27.6 68 104 A N S S+ 0 0 157 1,-0.2 2,-0.3 -2,-0.2 -1,-0.2 0.736 88.5 125.1 66.5 23.1 -25.4 9.0 23.9 69 105 A A - 0 0 29 -3,-0.3 2,-0.2 -17,-0.0 -1,-0.2 -0.840 59.3-120.5-113.0 158.5 -21.8 10.0 24.6 70 106 A Q E -i 51 0C 62 -20,-2.8 -18,-2.2 -2,-0.3 2,-0.6 -0.594 17.7-135.2 -89.2 149.4 -18.5 8.3 23.7 71 107 A N E >> -i 52 0C 53 -20,-0.2 4,-1.6 -2,-0.2 3,-0.8 -0.946 8.9-149.4-101.7 117.4 -16.1 7.2 26.4 72 108 A G H 3> S+ 0 0 0 -20,-2.5 4,-2.7 -2,-0.6 -19,-0.2 0.782 97.4 59.9 -62.8 -25.8 -12.5 8.3 25.4 73 109 A F H 3> S+ 0 0 2 -21,-0.6 4,-2.4 2,-0.2 -1,-0.3 0.848 105.4 49.0 -66.5 -33.3 -11.0 5.3 27.2 74 110 A E H <> S+ 0 0 52 -3,-0.8 4,-2.1 2,-0.2 -2,-0.2 0.858 111.7 48.5 -69.7 -36.9 -13.1 3.0 24.9 75 111 A R H X S+ 0 0 11 -4,-1.6 4,-2.6 -63,-0.3 -2,-0.2 0.926 113.3 46.7 -69.0 -44.2 -11.9 5.0 21.9 76 112 A L H X S+ 0 0 0 -4,-2.7 4,-3.0 -64,-0.3 5,-0.2 0.881 109.7 55.4 -60.2 -39.1 -8.2 4.7 23.1 77 113 A D H X S+ 0 0 1 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.916 109.5 46.4 -59.6 -42.6 -8.9 1.0 23.8 78 114 A Y H X S+ 0 0 24 -4,-2.1 4,-2.8 1,-0.2 5,-0.2 0.938 113.0 48.8 -64.6 -48.1 -10.0 0.5 20.1 79 115 A T H X S+ 0 0 0 -4,-2.6 4,-3.0 -68,-0.3 -1,-0.2 0.903 113.9 46.7 -58.0 -45.2 -7.0 2.5 18.8 80 116 A I H X S+ 0 0 0 -4,-3.0 4,-2.4 2,-0.2 -1,-0.2 0.923 112.5 48.4 -66.0 -39.2 -4.6 0.4 21.0 81 117 A A H X S+ 0 0 19 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.913 115.8 45.3 -66.7 -40.6 -6.2 -3.0 20.0 82 118 A K H X S+ 0 0 34 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.904 111.9 50.8 -70.0 -41.4 -6.0 -1.9 16.3 83 119 A A H X>S+ 0 0 0 -4,-3.0 5,-2.4 -5,-0.2 4,-1.0 0.875 108.8 53.1 -57.0 -41.6 -2.4 -0.7 16.7 84 120 A K H ><5S+ 0 0 84 -4,-2.4 3,-0.9 1,-0.2 -2,-0.2 0.948 111.9 44.9 -63.0 -45.1 -1.6 -4.1 18.4 85 121 A E H 3<5S+ 0 0 130 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.912 117.5 43.8 -59.7 -44.0 -3.1 -6.0 15.3 86 122 A L H 3<5S- 0 0 19 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.506 112.3-115.9 -90.2 -1.3 -1.4 -3.8 12.8 87 123 A G T <<5 + 0 0 46 -4,-1.0 2,-0.4 -3,-0.9 -3,-0.2 0.743 64.0 142.6 75.9 28.5 2.1 -3.7 14.6 88 124 A I < - 0 0 5 -5,-2.4 2,-0.3 -6,-0.1 -1,-0.3 -0.856 41.4-143.2 -99.0 132.6 2.2 0.1 15.4 89 125 A K E -c 33 0A 79 -57,-2.6 -55,-2.6 -2,-0.4 2,-0.4 -0.691 17.3-145.3 -90.6 153.2 3.7 1.2 18.7 90 126 A L E -cd 34 154A 0 63,-2.5 65,-3.0 -2,-0.3 66,-1.3 -0.932 15.5-158.6-125.8 140.0 2.1 4.1 20.5 91 127 A I E -cd 35 156A 0 -57,-2.3 -55,-2.9 -2,-0.4 2,-0.5 -0.974 22.2-157.7-106.2 128.2 3.5 7.0 22.7 92 128 A I E -cd 36 157A 0 64,-2.3 66,-2.3 -2,-0.5 2,-0.3 -0.922 2.0-151.6-116.5 120.4 0.6 8.3 24.8 93 129 A V E -cd 37 158A 0 -57,-2.5 -55,-2.6 -2,-0.5 66,-0.2 -0.737 1.5-155.7 -93.2 140.8 0.8 11.8 26.2 94 130 A L + 0 0 0 64,-2.4 2,-0.3 -2,-0.3 66,-0.2 0.659 66.6 6.0-102.2 -15.5 -1.1 12.5 29.5 95 131 A V - 0 0 0 63,-0.2 66,-2.5 -56,-0.1 2,-0.4 -0.964 68.5-120.4-156.2 158.9 -1.9 16.2 29.6 96 132 A N B -k 161 0E 2 -2,-0.3 8,-2.1 64,-0.2 66,-0.1 -0.842 2.0-151.4-101.2 134.7 -1.5 19.2 27.2 97 133 A N S S+ 0 0 3 64,-2.1 8,-0.3 -2,-0.4 -1,-0.1 0.897 86.7 61.5 -58.1 -37.2 0.5 22.3 28.0 98 134 A W S S- 0 0 84 63,-0.3 6,-0.2 5,-0.1 -2,-0.2 -0.283 97.4-106.7 -94.7 172.8 -1.9 24.2 25.7 99 135 A D S > S+ 0 0 72 4,-0.1 3,-2.2 5,-0.1 2,-0.1 0.635 80.4 113.1 -79.4 -14.8 -5.7 24.7 26.0 100 136 A D T 3 S+ 0 0 105 1,-0.3 3,-0.2 2,-0.1 -4,-0.1 -0.436 93.1 9.5 -62.5 130.8 -6.7 22.3 23.2 101 137 A F T 3 S- 0 0 20 1,-0.2 -60,-2.5 -2,-0.1 2,-1.3 0.761 133.6 -71.4 63.8 28.7 -8.6 19.3 24.9 102 138 A G S <> S- 0 0 0 -3,-2.2 4,-1.1 -62,-0.2 3,-0.3 -0.470 75.6-176.4 95.7 -66.3 -8.5 21.4 28.2 103 139 A G H >> - 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