==== 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 HYDROLASE 11-AUG-99 1CQR . COMPND 2 MOLECULE: STROMELYSIN-1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.CHEN,T.J.RYDEL,F.GU,C.M.DUNAWAY,S.PIKUL,K.M.DUNHAM,B.L.BAR . 342 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16664.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 187 54.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 9.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 4.7 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 . 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 . 24 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 69 20.2 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+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 0 0 1 1 0 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 2 4 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 . 1 2 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 ANTIPARALLEL BRIDGES PER LADDER . 4 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 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 83 A F 0 0 94 0, 0.0 2,-0.4 0, 0.0 128,-0.1 0.000 360.0 360.0 360.0 164.4 1.3 14.4 18.5 2 84 A R E -A 128 0A 137 126,-0.5 126,-3.0 135,-0.1 2,-0.4 -0.990 360.0-154.0-130.2 139.3 1.3 18.1 17.4 3 85 A T E -A 127 0A 43 -2,-0.4 124,-0.2 124,-0.2 3,-0.1 -0.947 30.4-101.1-115.7 139.0 4.1 20.5 18.0 4 86 A F > - 0 0 42 122,-1.0 3,-1.4 -2,-0.4 2,-0.1 0.140 52.4 -70.7 -48.9 164.4 3.5 24.2 18.2 5 87 A P T 3 S+ 0 0 119 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.343 117.2 2.4 -68.9 131.7 4.2 26.8 15.3 6 88 A G T 3 S- 0 0 84 1,-0.2 -2,-0.1 -3,-0.1 0, 0.0 0.679 116.9 -92.3 68.3 15.5 7.9 27.5 14.5 7 89 A I < - 0 0 83 -3,-1.4 2,-0.3 1,-0.2 -1,-0.2 0.911 42.6-152.9 42.9 68.0 8.7 24.9 17.2 8 90 A P + 0 0 39 0, 0.0 2,-0.3 0, 0.0 -4,-0.2 -0.507 30.3 169.6 -57.3 121.1 9.2 27.0 20.4 9 91 A K - 0 0 99 -2,-0.3 2,-0.2 78,-0.1 117,-0.1 -0.984 43.1-102.0-139.7 146.5 11.6 24.8 22.2 10 92 A W - 0 0 15 -2,-0.3 5,-0.0 115,-0.3 115,-0.0 -0.570 26.8-147.4 -65.8 135.4 13.6 25.3 25.4 11 93 A R S S+ 0 0 254 -2,-0.2 2,-0.3 2,-0.0 -1,-0.1 0.089 77.3 53.3 -95.1 24.1 17.2 26.0 24.2 12 94 A K S S- 0 0 94 1,-0.1 -2,-0.1 0, 0.0 3,-0.0 -0.972 71.8-136.5-154.0 159.4 18.7 24.3 27.3 13 95 A T S S+ 0 0 83 -2,-0.3 36,-2.7 1,-0.1 2,-0.7 0.663 87.1 68.0 -94.5 -24.5 18.3 20.9 29.2 14 96 A H E +b 49 0B 83 34,-0.2 2,-0.3 36,-0.0 36,-0.2 -0.907 64.4 179.4-107.3 115.0 18.1 22.0 32.8 15 97 A L E -b 50 0B 0 34,-2.4 36,-1.6 -2,-0.7 2,-0.3 -0.850 16.6-142.9-112.6 143.7 14.9 23.9 33.6 16 98 A T E -b 51 0B 24 -2,-0.3 44,-2.1 34,-0.2 43,-0.4 -0.815 12.9-165.2-105.7 151.0 13.9 25.4 37.0 17 99 A Y E -bc 52 60B 21 34,-2.4 36,-2.7 -2,-0.3 2,-0.4 -0.915 2.5-164.7-128.3 162.6 10.4 25.4 38.4 18 100 A R E - c 0 61B 16 42,-1.9 44,-2.9 -2,-0.3 2,-0.8 -0.956 16.7-142.6-148.5 125.0 8.9 27.4 41.3 19 101 A I E - c 0 62B 7 34,-0.4 44,-0.2 -2,-0.4 3,-0.1 -0.828 19.6-171.1 -88.6 113.4 5.6 26.8 43.1 20 102 A V - 0 0 11 42,-3.1 2,-0.3 -2,-0.8 43,-0.2 0.841 59.2 -6.8 -80.8 -36.5 4.5 30.3 43.8 21 103 A N - 0 0 12 41,-0.6 2,-0.4 172,-0.1 172,-0.2 -0.925 66.4-114.3-153.9 172.7 1.5 29.6 46.0 22 104 A Y B -F 192 0C 5 170,-2.1 170,-2.3 -2,-0.3 6,-0.1 -0.958 20.7-125.5-126.3 133.9 -0.7 26.8 47.4 23 105 A T > - 0 0 0 -2,-0.4 3,-0.7 168,-0.2 168,-0.2 -0.464 16.7-134.0 -63.5 143.4 -4.3 25.9 46.9 24 106 A P T 3 S+ 0 0 39 0, 0.0 -1,-0.1 0, 0.0 167,-0.1 0.674 97.5 77.1 -71.5 -11.3 -6.4 25.6 50.1 25 107 A D T 3 S+ 0 0 40 77,-0.1 78,-0.0 2,-0.0 166,-0.0 0.801 98.8 30.7 -66.7 -31.0 -7.7 22.4 48.6 26 108 A L S < S- 0 0 13 -3,-0.7 2,-0.1 79,-0.1 79,-0.1 -0.833 86.9 -96.4-129.1 152.7 -4.7 20.2 49.4 27 109 A P >> - 0 0 62 0, 0.0 4,-1.8 0, 0.0 3,-1.0 -0.482 43.0-115.0 -60.0 151.0 -1.8 19.8 52.0 28 110 A K H 3> S+ 0 0 45 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.885 115.3 57.5 -61.1 -34.6 1.3 21.5 50.7 29 111 A D H 3> S+ 0 0 108 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.811 104.3 52.1 -69.2 -22.6 3.1 18.2 50.5 30 112 A A H <> S+ 0 0 13 -3,-1.0 4,-2.0 2,-0.2 -1,-0.2 0.849 108.7 49.2 -82.0 -37.0 0.4 16.8 48.2 31 113 A V H X S+ 0 0 1 -4,-1.8 4,-2.0 2,-0.2 5,-0.2 0.964 112.7 50.5 -63.4 -47.8 0.8 19.8 45.9 32 114 A D H X S+ 0 0 32 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.888 111.0 46.6 -55.6 -42.8 4.6 19.3 46.0 33 115 A S H X S+ 0 0 55 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.888 109.8 52.9 -70.1 -40.9 4.4 15.6 45.2 34 116 A A H X S+ 0 0 11 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.896 111.9 44.9 -62.9 -41.6 1.9 16.0 42.3 35 117 A V H X S+ 0 0 4 -4,-2.0 4,-2.6 2,-0.2 5,-0.2 0.915 113.0 52.0 -68.8 -42.0 4.1 18.6 40.5 36 118 A E H X S+ 0 0 80 -4,-1.9 4,-2.2 -5,-0.2 -2,-0.2 0.891 112.9 44.7 -57.7 -44.7 7.3 16.5 41.1 37 119 A K H X S+ 0 0 86 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.902 111.5 52.8 -68.2 -40.0 5.5 13.4 39.6 38 120 A A H X S+ 0 0 0 -4,-2.0 4,-0.8 1,-0.2 -2,-0.2 0.912 112.3 46.0 -61.2 -42.6 4.2 15.4 36.7 39 121 A L H X S+ 0 0 3 -4,-2.6 4,-2.0 1,-0.2 3,-0.4 0.904 109.0 56.0 -69.5 -40.9 7.7 16.7 36.0 40 122 A K H X S+ 0 0 116 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.786 94.5 64.1 -67.0 -25.8 9.2 13.2 36.3 41 123 A V H < S+ 0 0 10 -4,-1.8 4,-0.4 -3,-0.2 -1,-0.2 0.932 111.1 39.8 -62.7 -35.8 7.0 11.6 33.6 42 124 A W H >X S+ 0 0 0 -4,-0.8 3,-1.2 -3,-0.4 4,-0.5 0.895 111.0 57.8 -77.9 -39.3 8.6 13.9 31.1 43 125 A E H >< S+ 0 0 60 -4,-2.0 3,-0.8 1,-0.2 -1,-0.2 0.843 97.7 63.4 -54.0 -37.1 12.1 13.6 32.6 44 126 A E T 3< S+ 0 0 131 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.721 110.0 35.8 -61.7 -27.3 12.1 9.9 32.1 45 127 A V T <4 S+ 0 0 18 -3,-1.2 -1,-0.2 -4,-0.4 -2,-0.2 0.338 116.6 44.2-115.9 9.9 11.9 10.1 28.3 46 128 A T S << S- 0 0 3 -3,-0.8 119,-0.1 -4,-0.5 115,-0.1 -0.790 85.5-107.5-135.5 175.4 14.1 13.1 27.4 47 129 A P S S+ 0 0 38 0, 0.0 2,-0.2 0, 0.0 -4,-0.1 0.228 80.2 122.1 -82.5 10.8 17.5 14.5 28.5 48 130 A L - 0 0 3 -6,-0.2 2,-0.3 -5,-0.1 -2,-0.2 -0.536 40.9-173.1 -75.7 142.8 15.7 17.3 30.4 49 131 A T E -b 14 0B 61 -36,-2.7 -34,-2.4 -2,-0.2 2,-0.3 -0.926 5.1-157.4-131.9 156.5 16.3 17.7 34.1 50 132 A F E -b 15 0B 22 -2,-0.3 2,-0.3 -36,-0.2 -34,-0.2 -0.956 8.5-174.4-133.9 147.2 14.5 20.1 36.5 51 133 A S E -b 16 0B 48 -36,-1.6 -34,-2.4 -2,-0.3 2,-0.4 -0.968 26.9-110.2-139.6 162.5 15.3 21.6 39.9 52 134 A R E -b 17 0B 45 -2,-0.3 2,-0.3 -36,-0.2 -34,-0.2 -0.743 20.3-162.8 -96.5 131.8 13.2 23.8 42.3 53 135 A L - 0 0 61 -36,-2.7 -34,-0.4 -2,-0.4 3,-0.1 -0.845 6.3-167.1-110.2 146.6 13.8 27.4 43.1 54 136 A Y S S+ 0 0 160 -2,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.623 76.1 18.9-105.1 -18.7 12.2 29.0 46.2 55 137 A E S S+ 0 0 160 2,-0.1 -1,-0.3 -37,-0.0 2,-0.1 -0.961 102.4 36.5-146.5 157.1 12.8 32.6 45.3 56 138 A G S S- 0 0 43 -2,-0.3 2,-0.6 -3,-0.1 -3,-0.1 -0.363 98.5 -44.5 91.4-177.5 13.6 34.4 42.0 57 139 A E - 0 0 121 -2,-0.1 2,-0.2 4,-0.0 -41,-0.1 -0.827 54.7-169.1 -98.3 120.6 12.2 33.7 38.6 58 140 A A - 0 0 1 -2,-0.6 3,-0.2 1,-0.1 -41,-0.1 -0.605 34.0-112.4 -96.0 166.7 12.2 30.1 37.5 59 141 A D S S+ 0 0 30 -43,-0.4 2,-0.7 1,-0.3 -42,-0.2 0.953 111.0 37.9 -63.6 -46.7 11.5 29.0 33.9 60 142 A I E S-c 17 0B 0 -44,-2.1 -42,-1.9 35,-0.1 2,-0.5 -0.906 76.1-168.6-113.2 104.2 8.2 27.4 34.8 61 143 A M E -c 18 0B 18 -2,-0.7 35,-2.1 -44,-0.2 2,-0.5 -0.854 9.0-159.2 -90.8 126.7 6.4 29.4 37.4 62 144 A I E +cd 19 96B 4 -44,-2.9 -42,-3.1 -2,-0.5 -41,-0.6 -0.942 19.2 163.0-110.5 129.2 3.5 27.4 38.8 63 145 A S E - d 0 97B 21 33,-1.8 35,-2.5 -2,-0.5 2,-0.4 -0.962 34.7-130.7-144.7 158.1 0.5 29.2 40.5 64 146 A F E + d 0 98B 6 -2,-0.3 2,-0.3 33,-0.2 35,-0.2 -0.924 39.7 163.6-108.0 137.0 -3.1 28.7 41.6 65 147 A A E - d 0 99B 16 33,-2.7 35,-3.1 -2,-0.4 36,-0.4 -0.929 28.4-143.9-149.0 163.2 -5.4 31.4 40.5 66 148 A V - 0 0 46 -2,-0.3 33,-0.1 2,-0.2 10,-0.0 -0.995 62.6 -34.9-133.5 145.2 -9.1 32.3 40.1 67 149 A R S S+ 0 0 132 -2,-0.4 8,-2.7 7,-0.1 2,-0.4 -0.172 124.9 11.9 49.6-125.9 -10.8 34.4 37.4 68 150 A E S S+ 0 0 89 6,-0.3 -2,-0.2 1,-0.1 4,-0.1 -0.665 70.6 160.2 -86.1 132.0 -8.6 37.4 36.3 69 151 A H - 0 0 24 -2,-0.4 171,-0.2 2,-0.3 -1,-0.1 0.222 67.0 -64.7-142.5 11.1 -5.2 36.8 37.7 70 152 A G S S+ 0 0 25 1,-0.5 2,-0.3 169,-0.3 170,-0.1 0.498 105.3 74.7 120.8 -0.5 -2.8 38.9 35.7 71 153 A D S S- 0 0 14 168,-0.1 -1,-0.5 169,-0.0 -2,-0.3 -0.788 91.7 -94.6-128.7-176.7 -2.6 37.8 32.1 72 154 A F S S+ 0 0 190 -2,-0.3 -4,-0.0 1,-0.2 0, 0.0 0.337 106.3 73.0 -84.7 14.5 -5.2 38.3 29.3 73 155 A Y - 0 0 149 -6,-0.1 -1,-0.2 11,-0.0 -2,-0.0 -0.720 68.6-164.8-131.5 72.9 -6.9 34.9 29.8 74 156 A P - 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