==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 08-NOV-11 3UJZ . COMPND 2 MOLECULE: METALLOPROTEASE STCE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR A.C.Y.YU,N.C.J.STRYNADKA . 604 5 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25671.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 363 60.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 35 5.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 147 24.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 3 0.5 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 . 54 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 45 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 2.0 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 1 2 0 0 1 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 2 0 0 1 0 0 1 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 . 7 6 6 3 7 3 0 1 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 . 5 3 2 2 1 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 39 A N 0 0 179 0, 0.0 2,-0.3 0, 0.0 104,-0.0 0.000 360.0 360.0 360.0 126.9 -23.1 68.0 53.0 2 40 A S + 0 0 102 1,-0.2 103,-0.1 103,-0.0 104,-0.0 -0.955 360.0 38.3-150.8 164.6 -23.9 65.1 55.5 3 41 A A - 0 0 42 -2,-0.3 2,-0.5 1,-0.2 -1,-0.2 0.965 40.3-172.4 53.8 104.9 -24.5 61.3 55.8 4 42 A I E -a 106 0A 38 101,-2.8 103,-2.0 99,-0.1 2,-0.4 -0.962 16.4-155.7-121.4 103.0 -22.3 58.8 53.8 5 43 A Y E -a 107 0A 77 -2,-0.5 103,-0.2 101,-0.2 3,-0.2 -0.723 14.7-167.6 -90.2 129.6 -23.8 55.2 54.3 6 44 A F S S+ 0 0 10 101,-2.1 2,-1.2 -2,-0.4 316,-0.3 0.985 79.9 50.6 -74.9 -65.5 -21.6 52.1 53.9 7 45 A N + 0 0 14 101,-3.8 103,-0.4 1,-0.2 -1,-0.2 -0.618 54.7 152.1 -82.8 92.9 -24.3 49.3 53.8 8 46 A T + 0 0 117 -2,-1.2 -1,-0.2 -3,-0.2 101,-0.1 0.188 32.7 133.5-102.5 16.6 -26.9 50.4 51.2 9 47 A S - 0 0 43 1,-0.1 314,-0.1 -3,-0.0 -2,-0.0 -0.316 68.8 -97.4 -70.5 146.8 -27.8 46.7 50.5 10 48 A Q - 0 0 140 1,-0.1 -1,-0.1 -2,-0.0 2,-0.1 -0.520 42.8-120.1 -64.1 116.7 -31.4 45.6 50.3 11 49 A P - 0 0 7 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.418 24.0-154.2 -66.2 132.7 -32.4 44.1 53.8 12 50 A I - 0 0 114 -2,-0.1 11,-0.2 11,-0.1 2,-0.1 -0.892 25.3-107.6-106.0 134.8 -33.6 40.5 53.6 13 51 A N + 0 0 63 -2,-0.4 9,-0.2 1,-0.1 7,-0.1 -0.387 33.4 177.2 -65.0 141.2 -36.0 39.2 56.3 14 52 A D + 0 0 22 7,-2.1 2,-0.1 -2,-0.1 -1,-0.1 0.325 54.9 87.0-121.8 -6.6 -34.5 36.8 58.9 15 53 A L - 0 0 2 6,-0.5 2,-0.5 4,-0.1 124,-0.2 -0.435 65.4-140.3 -99.9 166.7 -37.6 36.5 61.0 16 54 A Q E S+B 138 0B 127 122,-1.2 122,-2.2 -2,-0.1 2,-0.3 -0.996 71.3 43.0-122.6 116.7 -40.7 34.2 61.1 17 55 A G E S-B 137 0B 59 -2,-0.5 120,-0.2 120,-0.2 -2,-0.1 -0.897 106.8 -42.0 142.8-170.6 -43.7 36.4 62.0 18 56 A S S S+ 0 0 63 118,-1.1 2,-0.4 -2,-0.3 119,-0.2 0.868 111.2 74.6 -60.9 -44.9 -45.5 39.7 61.5 19 57 A L - 0 0 3 117,-2.6 2,-0.6 111,-0.2 119,-0.1 -0.655 65.4-158.4 -83.8 126.6 -42.2 41.7 61.6 20 58 A A + 0 0 12 -2,-0.4 37,-1.6 38,-0.1 38,-0.6 -0.911 32.7 147.0-102.4 114.1 -39.8 41.7 58.6 21 59 A A E -F 56 0C 0 -2,-0.6 -7,-2.1 35,-0.3 -6,-0.5 -0.992 46.1-126.6-150.4 148.8 -36.3 42.6 59.7 22 60 A E E -F 55 0C 20 33,-2.8 33,-2.3 -2,-0.3 2,-0.4 -0.708 30.3-153.9 -90.5 141.9 -32.7 41.9 58.9 23 61 A V E +F 54 0C 0 -2,-0.3 10,-2.0 -11,-0.2 11,-0.4 -0.987 15.8 175.8-125.0 134.8 -30.6 40.8 61.9 24 62 A K E -FG 53 32C 29 29,-2.3 29,-3.2 -2,-0.4 2,-0.2 -0.979 12.1-157.4-133.5 147.4 -26.9 41.2 62.4 25 63 A F E -FG 52 31C 2 6,-2.8 6,-3.0 -2,-0.3 2,-0.3 -0.708 7.8-153.4-113.8 167.9 -24.7 40.4 65.4 26 64 A A E +FG 51 30C 0 25,-1.0 25,-1.7 4,-0.3 4,-0.2 -0.828 35.6 130.7-153.3 108.6 -21.2 41.9 66.1 27 65 A Q S S- 0 0 3 2,-1.8 304,-0.2 -2,-0.3 306,-0.2 0.553 95.1 -7.6-114.5 -90.8 -18.4 40.4 68.1 28 66 A S S S- 0 0 8 1,-0.3 303,-0.4 302,-0.1 2,-0.3 0.550 145.0 -5.6 -84.1 -9.9 -15.0 40.5 66.4 29 67 A Q S S- 0 0 2 301,-0.2 -2,-1.8 154,-0.0 -1,-0.3 -0.948 91.9 -76.8-168.1 165.0 -16.8 41.7 63.3 30 68 A I E -G 26 0C 6 299,-2.6 -4,-0.3 -2,-0.3 299,-0.0 -0.546 55.4-177.9 -69.1 128.8 -20.4 42.4 62.0 31 69 A L E -G 25 0C 5 -6,-3.0 -6,-2.8 -2,-0.2 2,-0.1 -0.982 23.3-114.4-132.0 144.9 -21.8 38.9 61.2 32 70 A P E -G 24 0C 27 0, 0.0 -8,-0.2 0, 0.0 9,-0.0 -0.434 9.2-134.4 -80.2 158.7 -25.2 38.0 59.7 33 71 A A S S+ 0 0 19 -10,-2.0 110,-0.3 1,-0.3 -9,-0.1 0.862 106.7 24.9 -69.5 -39.2 -28.0 36.1 61.4 34 72 A H S S- 0 0 64 -11,-0.4 -1,-0.3 108,-0.1 2,-0.1 -0.946 90.5-136.3-130.0 103.0 -28.3 34.1 58.1 35 73 A P - 0 0 82 0, 0.0 3,-0.1 0, 0.0 8,-0.0 -0.404 25.4-112.6 -65.5 136.8 -25.2 34.0 55.9 36 74 A K > - 0 0 94 1,-0.2 3,-1.9 -2,-0.1 2,-0.2 -0.150 47.8 -76.6 -58.6 160.2 -25.7 34.5 52.1 37 75 A E T 3 S+ 0 0 199 1,-0.3 -1,-0.2 3,-0.0 3,-0.1 -0.429 119.1 6.0 -64.8 127.3 -25.1 31.6 49.7 38 76 A G T 3 S+ 0 0 76 1,-0.3 2,-0.4 -2,-0.2 -1,-0.3 0.543 97.8 128.5 76.4 9.3 -21.4 31.1 49.2 39 77 A D < - 0 0 25 -3,-1.9 2,-0.7 286,-0.1 -1,-0.3 -0.796 49.6-147.7 -95.7 139.2 -20.4 33.7 51.8 40 78 A S + 0 0 33 -2,-0.4 352,-0.2 -3,-0.1 351,-0.1 -0.928 33.1 154.9-109.5 108.4 -17.9 32.6 54.5 41 79 A Q - 0 0 26 -2,-0.7 348,-0.1 350,-0.1 -10,-0.1 -0.987 44.1-109.4-132.0 148.0 -18.6 34.4 57.7 42 80 A P - 0 0 3 0, 0.0 2,-0.2 0, 0.0 350,-0.1 -0.374 33.5-138.4 -69.9 155.7 -17.9 33.6 61.4 43 81 A H - 0 0 42 1,-0.2 101,-0.1 349,-0.1 -10,-0.1 -0.468 42.4 -60.3-102.2 178.5 -21.0 32.7 63.5 44 82 A L E -j 144 0D 2 99,-1.2 101,-3.1 -2,-0.2 2,-0.4 -0.383 49.4-141.2 -63.7 136.5 -21.7 33.9 67.1 45 83 A T E -j 145 0D 0 99,-0.2 3,-0.5 3,-0.1 101,-0.2 -0.868 26.5-109.0 -98.4 132.5 -19.0 32.8 69.7 46 84 A S S S+ 0 0 4 99,-1.6 77,-0.2 -2,-0.4 102,-0.1 -0.277 92.3 16.3 -60.1 148.6 -20.4 31.7 73.1 47 85 A L S S+ 0 0 44 75,-2.9 2,-0.3 72,-0.7 461,-0.2 0.873 92.8 113.9 55.7 49.1 -19.9 33.9 76.2 48 86 A R S S- 0 0 19 -3,-0.5 -1,-0.1 71,-0.5 -3,-0.1 -0.946 73.6-103.7-148.3 124.8 -18.9 37.2 74.5 49 87 A K - 0 0 61 -2,-0.3 2,-0.4 137,-0.1 284,-0.1 -0.140 42.6-158.0 -45.0 129.6 -20.9 40.5 74.6 50 88 A S E - H 0 117C 0 67,-2.5 67,-3.9 -25,-0.0 -23,-0.2 -0.977 15.1-135.5-126.5 135.1 -22.7 41.0 71.3 51 89 A L E -FH 26 116C 7 -25,-1.7 -25,-1.0 -2,-0.4 2,-0.5 -0.489 22.2-146.8 -75.0 146.9 -24.1 44.0 69.5 52 90 A L E -FH 25 115C 0 63,-2.8 63,-1.4 -27,-0.2 2,-0.5 -0.984 11.6-167.7-121.8 118.7 -27.5 43.4 68.0 53 91 A L E -FH 24 114C 2 -29,-3.2 -29,-2.3 -2,-0.5 2,-0.5 -0.944 3.1-172.6-109.1 124.0 -28.4 45.3 64.8 54 92 A V E -FH 23 113C 2 59,-2.5 59,-3.4 -2,-0.5 -31,-0.2 -0.978 5.3-178.8-119.7 118.5 -32.1 45.2 63.7 55 93 A R E -F 22 0C 42 -33,-2.3 -33,-2.8 -2,-0.5 2,-0.2 -0.902 22.4-141.2-117.6 95.4 -33.0 46.7 60.3 56 94 A P E -F 21 0C 3 0, 0.0 -35,-0.3 0, 0.0 4,-0.1 -0.424 10.0-138.1 -62.1 122.5 -36.8 46.5 59.6 57 95 A V S S+ 0 0 49 -37,-1.6 2,-0.8 1,-0.2 -36,-0.1 0.902 104.5 47.9 -43.9 -47.2 -37.3 45.6 55.9 58 96 A K S S- 0 0 106 -38,-0.6 -1,-0.2 2,-0.0 -38,-0.1 -0.875 109.9-121.7 -97.0 101.8 -40.1 48.2 55.9 59 97 A A + 0 0 57 -2,-0.8 2,-0.2 -4,-0.1 -2,-0.1 -0.237 43.2 160.6 -59.6 134.7 -38.4 51.2 57.6 60 98 A D + 0 0 54 51,-0.2 -2,-0.0 -4,-0.1 -1,-0.0 -0.789 6.8 170.5-154.3 98.6 -39.7 52.8 60.9 61 99 A D S S+ 0 0 59 -2,-0.2 25,-0.2 1,-0.1 -2,-0.0 0.409 79.6 51.8 -90.9 -2.2 -37.1 54.8 62.8 62 100 A K S S+ 0 0 188 22,-0.1 -1,-0.1 2,-0.1 3,-0.1 0.850 84.2 84.3-102.3 -49.5 -39.8 56.2 65.2 63 101 A T S S- 0 0 47 1,-0.1 -3,-0.1 69,-0.1 -1,-0.0 -0.433 89.4-108.4 -62.7 120.5 -41.7 53.1 66.6 64 102 A P - 0 0 75 0, 0.0 69,-0.7 0, 0.0 2,-0.4 -0.220 29.9-147.3 -54.7 134.8 -39.8 51.6 69.6 65 103 A V E -C 132 0B 2 17,-0.2 17,-1.9 67,-0.2 2,-0.3 -0.887 16.1-172.0-105.5 133.7 -38.2 48.3 68.9 66 104 A Q E -CD 131 81B 77 65,-2.2 65,-2.5 -2,-0.4 2,-0.4 -0.939 10.0-155.2-127.1 151.0 -37.9 45.7 71.7 67 105 A V E -CD 130 80B 0 13,-2.1 13,-2.6 -2,-0.3 2,-0.5 -0.997 1.7-165.1-129.4 130.5 -36.1 42.4 72.0 68 106 A E E -CD 129 79B 58 61,-2.6 61,-2.0 -2,-0.4 2,-0.4 -0.985 12.9-158.1-115.8 117.9 -37.0 39.5 74.3 69 107 A A E -CD 128 78B 0 9,-1.9 8,-3.2 -2,-0.5 9,-1.0 -0.838 10.3-176.6 -99.5 136.3 -34.3 36.9 74.7 70 108 A R E -CD 127 76B 76 57,-2.5 57,-2.5 -2,-0.4 6,-0.2 -0.964 16.4-134.8-130.6 144.7 -35.0 33.3 75.8 71 109 A D > - 0 0 39 4,-1.6 3,-1.6 -2,-0.3 54,-0.1 -0.141 44.2 -79.1 -85.8-173.1 -32.6 30.4 76.5 72 110 A D T 3 S+ 0 0 113 52,-0.4 53,-0.1 1,-0.3 -1,-0.0 0.814 132.9 52.2 -57.0 -37.1 -32.8 26.7 75.4 73 111 A N T 3 S- 0 0 116 2,-0.1 -1,-0.3 1,-0.0 52,-0.0 0.386 119.2-113.4 -80.0 -1.7 -35.4 26.0 78.2 74 112 A N < + 0 0 87 -3,-1.6 2,-0.4 1,-0.3 -2,-0.1 0.770 64.9 150.9 67.1 35.4 -37.5 29.0 77.0 75 113 A K - 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