==== 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 23-FEB-99 1CAQ . COMPND 2 MOLECULE: PROTEIN (STROMELYSIN-1); . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.G.PAVLOVSKY,M.G.WILLIAMS,Q.-Z.YE,D.F.ORTWINE,C.F.PURCHASE . 168 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8788.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 82 48.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 10.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 3.6 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 . 9 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 33 19.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 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 0 0 0 0 0 0 0 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 1 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 0 104 0, 0.0 2,-0.3 0, 0.0 129,-0.1 0.000 360.0 360.0 360.0 162.0 7.0 10.0 7.7 2 84 A R - 0 0 149 126,-0.2 126,-2.8 135,-0.0 2,-0.2 -0.994 360.0-154.7-142.5 142.2 4.4 8.3 9.9 3 85 A T B -A 127 0A 32 -2,-0.3 124,-0.2 124,-0.2 126,-0.2 -0.611 36.3 -87.5-104.3 174.1 1.9 9.6 12.3 4 86 A F > - 0 0 39 122,-1.1 3,-2.1 4,-0.3 -1,-0.1 -0.500 56.2 -87.0 -76.5 152.8 0.3 7.8 15.3 5 87 A P T 3 S+ 0 0 111 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.342 119.6 21.1 -57.1 135.4 -2.8 5.7 14.7 6 88 A G T 3 S- 0 0 80 1,-0.2 -2,-0.1 -3,-0.1 0, 0.0 0.520 113.9-108.0 80.9 3.1 -5.8 7.8 14.9 7 89 A I < - 0 0 84 -3,-2.1 -1,-0.2 1,-0.1 2,-0.1 0.841 40.8-160.9 35.3 63.5 -3.7 10.9 14.3 8 90 A P + 0 0 34 0, 0.0 2,-0.3 0, 0.0 -4,-0.3 -0.455 21.8 159.5 -65.1 140.4 -3.6 12.6 17.7 9 91 A K - 0 0 63 -2,-0.1 2,-0.4 78,-0.1 117,-0.1 -0.961 44.3 -94.0-152.0 163.7 -2.6 16.2 17.5 10 92 A W - 0 0 22 115,-0.3 2,-0.4 -2,-0.3 5,-0.0 -0.690 23.6-152.8 -80.8 135.9 -2.9 19.4 19.5 11 93 A R S S+ 0 0 204 -2,-0.4 2,-0.3 2,-0.0 -1,-0.1 -0.438 75.7 57.1-108.7 60.0 -5.8 21.5 18.6 12 94 A K S S- 0 0 96 -2,-0.4 -2,-0.1 1,-0.0 3,-0.1 -0.881 71.4-138.9-177.0 152.8 -4.2 24.7 19.6 13 95 A T S S+ 0 0 81 -2,-0.3 36,-2.5 1,-0.1 2,-0.8 0.628 81.6 76.3-103.8 -15.7 -1.0 26.4 18.7 14 96 A H E +b 49 0B 97 34,-0.2 2,-0.3 36,-0.0 36,-0.2 -0.873 62.1 179.6-104.6 107.6 0.3 27.7 22.0 15 97 A L E -b 50 0B 0 34,-2.6 36,-2.1 -2,-0.8 2,-0.3 -0.703 14.3-147.1-101.8 149.8 1.8 24.8 24.0 16 98 A T E -b 51 0B 30 -2,-0.3 44,-2.3 34,-0.2 2,-0.3 -0.875 10.5-167.8-117.9 153.7 3.4 24.9 27.4 17 99 A Y E -bc 52 60B 18 34,-1.9 36,-2.7 -2,-0.3 2,-0.4 -0.968 4.4-164.2-135.9 152.6 6.3 22.9 28.9 18 100 A R E - c 0 61B 68 42,-2.2 44,-3.0 -2,-0.3 2,-0.9 -0.992 15.4-147.6-138.0 129.8 7.7 22.3 32.3 19 101 A I E - c 0 62B 12 34,-0.4 44,-0.2 -2,-0.4 3,-0.1 -0.853 20.8-175.9 -91.7 105.6 11.0 20.8 33.3 20 102 A V - 0 0 58 42,-2.9 2,-0.3 -2,-0.9 43,-0.2 0.854 59.4 -5.0 -76.2 -32.4 10.0 19.1 36.5 21 103 A N - 0 0 63 41,-0.7 2,-0.3 -3,-0.1 -1,-0.1 -0.894 67.9-118.6-151.8 179.1 13.4 17.9 37.6 22 104 A Y - 0 0 63 -2,-0.3 6,-0.1 42,-0.1 41,-0.0 -0.953 18.1-116.0-133.3 144.9 17.1 17.6 36.5 23 105 A T - 0 0 7 -2,-0.3 3,-0.5 1,-0.1 8,-0.1 -0.379 19.7-133.8 -68.9 148.1 19.7 15.0 35.7 24 106 A P S S+ 0 0 114 0, 0.0 -1,-0.1 0, 0.0 79,-0.0 0.708 95.7 75.0 -63.4 -19.2 22.9 14.9 37.8 25 107 A D S S+ 0 0 58 2,-0.0 78,-0.0 75,-0.0 75,-0.0 0.715 98.3 26.7 -77.2 -26.0 25.0 14.6 34.7 26 108 A L S S- 0 0 28 -3,-0.5 79,-0.0 79,-0.1 5,-0.0 -0.935 86.0 -96.2-132.3 152.4 24.9 18.2 33.4 27 109 A P > - 0 0 79 0, 0.0 4,-1.8 0, 0.0 3,-0.5 -0.299 42.1-109.9 -62.1 155.2 24.5 21.7 34.8 28 110 A K H > S+ 0 0 131 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.833 117.4 58.4 -59.1 -32.7 21.0 23.1 34.7 29 111 A D H > S+ 0 0 114 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.887 104.8 51.5 -63.7 -37.7 21.9 25.6 32.0 30 112 A A H > S+ 0 0 8 -3,-0.5 4,-1.9 2,-0.2 -1,-0.2 0.878 111.6 46.4 -66.1 -39.6 23.0 22.8 29.7 31 113 A V H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 5,-0.2 0.931 112.5 49.1 -69.4 -39.6 19.8 20.9 30.1 32 114 A D H X S+ 0 0 33 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.924 111.3 50.7 -60.4 -43.8 17.7 24.0 29.6 33 115 A S H X S+ 0 0 71 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.871 109.7 50.3 -60.1 -41.6 19.6 24.9 26.5 34 116 A A H X S+ 0 0 12 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.903 112.6 45.6 -66.3 -42.6 19.2 21.4 25.1 35 117 A V H X S+ 0 0 4 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.905 113.4 49.3 -71.6 -35.7 15.5 21.3 25.6 36 118 A E H X S+ 0 0 84 -4,-2.7 4,-2.1 -5,-0.2 -2,-0.2 0.853 109.4 50.6 -74.3 -26.8 15.0 24.7 24.3 37 119 A K H X S+ 0 0 103 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.864 110.4 51.9 -67.0 -35.4 17.0 24.1 21.2 38 120 A A H X S+ 0 0 0 -4,-1.8 4,-0.7 2,-0.2 -2,-0.2 0.881 110.5 47.2 -66.7 -37.3 14.9 20.9 20.6 39 121 A L H >X S+ 0 0 5 -4,-2.1 4,-1.9 1,-0.2 3,-0.7 0.910 108.3 56.6 -63.6 -46.7 11.7 22.9 21.0 40 122 A K H 3X S+ 0 0 134 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.817 94.8 65.8 -58.6 -33.4 13.0 25.5 18.6 41 123 A V H 3< S+ 0 0 16 -4,-1.6 4,-0.5 1,-0.2 -1,-0.2 0.896 110.7 36.0 -53.8 -40.9 13.6 22.9 15.8 42 124 A W H << S+ 0 0 0 -4,-0.7 3,-0.4 -3,-0.7 4,-0.3 0.788 110.4 62.0 -86.4 -29.2 9.9 22.3 15.5 43 125 A E H >< S+ 0 0 59 -4,-1.9 3,-1.0 1,-0.2 -2,-0.2 0.856 98.2 58.5 -60.1 -38.1 8.8 25.9 16.1 44 126 A E T 3< S+ 0 0 138 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.803 109.6 40.8 -67.5 -26.4 10.6 27.0 13.1 45 127 A V T 3 S+ 0 0 25 -4,-0.5 -1,-0.2 -3,-0.4 -2,-0.2 0.322 117.8 41.3-103.3 11.0 8.8 24.8 10.7 46 128 A T S < S- 0 0 5 -3,-1.0 119,-0.1 -4,-0.3 115,-0.1 -0.809 84.6-104.2-140.5 174.6 5.2 25.2 12.2 47 129 A P S S+ 0 0 34 0, 0.0 2,-0.1 0, 0.0 -4,-0.1 0.385 80.6 119.9 -81.1 2.3 2.7 27.7 13.7 48 130 A L - 0 0 3 -6,-0.3 2,-0.4 -34,-0.1 -2,-0.2 -0.435 41.9-171.3 -76.5 143.5 3.5 26.3 17.2 49 131 A T E -b 14 0B 63 -36,-2.5 -34,-2.6 -2,-0.1 2,-0.4 -0.976 6.7-154.5-127.6 146.8 4.9 28.3 20.1 50 132 A F E -b 15 0B 22 -2,-0.4 2,-0.4 -36,-0.2 -34,-0.2 -0.941 8.9-174.8-119.5 140.2 6.1 27.1 23.4 51 133 A S E -b 16 0B 45 -36,-2.1 -34,-1.9 -2,-0.4 2,-0.3 -0.981 23.7-116.6-133.7 155.4 6.3 28.7 26.7 52 134 A R E -b 17 0B 53 -2,-0.4 2,-0.4 -36,-0.2 -34,-0.2 -0.624 19.0-165.4 -92.5 138.1 7.7 27.6 30.0 53 135 A L - 0 0 55 -36,-2.7 -34,-0.4 -2,-0.3 5,-0.1 -0.940 9.1-166.0-114.1 143.9 5.9 27.1 33.2 54 136 A Y S S+ 0 0 173 -2,-0.4 2,-0.3 1,-0.1 -1,-0.1 0.394 76.6 23.7-107.3 -1.3 7.7 26.7 36.5 55 137 A E S S+ 0 0 155 2,-0.0 -1,-0.1 0, 0.0 -35,-0.0 -0.977 99.8 28.8-154.2 162.1 4.7 25.3 38.4 56 138 A G S S- 0 0 44 -2,-0.3 2,-0.8 -3,-0.1 -3,-0.1 -0.203 97.3 -38.6 80.5-176.9 1.5 23.6 37.7 57 139 A E - 0 0 134 4,-0.0 2,-0.1 -2,-0.0 -1,-0.1 -0.806 56.7-171.8 -95.5 109.8 0.6 21.2 34.9 58 140 A A - 0 0 5 -2,-0.8 3,-0.2 -5,-0.1 -41,-0.1 -0.472 35.7-111.7 -87.2 169.0 2.1 22.0 31.5 59 141 A D S S+ 0 0 30 1,-0.2 2,-0.7 -43,-0.2 -42,-0.2 0.933 111.3 38.9 -61.7 -45.7 1.1 20.3 28.3 60 142 A I E S-c 17 0B 0 -44,-2.3 -42,-2.2 35,-0.1 2,-0.5 -0.889 76.9-167.0-111.9 104.6 4.5 18.7 28.0 61 143 A M E -c 18 0B 27 -2,-0.7 35,-2.2 -44,-0.2 2,-0.5 -0.825 7.5-160.2 -94.6 126.6 5.9 17.6 31.3 62 144 A I E +cd 19 96B 3 -44,-3.0 -42,-2.9 -2,-0.5 -41,-0.7 -0.921 19.7 159.0-113.7 125.0 9.6 16.8 31.1 63 145 A S E - d 0 97B 20 33,-2.0 35,-2.5 -2,-0.5 2,-0.4 -0.971 35.4-132.7-146.1 160.6 11.3 14.6 33.7 64 146 A F E + d 0 98B 12 -2,-0.3 2,-0.3 33,-0.2 35,-0.2 -0.933 40.0 148.9-111.2 133.5 14.2 12.4 34.5 65 147 A A E - d 0 99B 21 33,-2.5 35,-2.1 -2,-0.4 36,-0.4 -0.965 33.1-131.6-158.1 164.9 13.6 9.1 36.2 66 148 A V - 0 0 66 -2,-0.3 33,-0.0 2,-0.2 -2,-0.0 -0.948 61.9 -31.3-126.1 152.4 14.8 5.5 36.6 67 149 A R S S+ 0 0 131 -2,-0.3 8,-2.4 7,-0.1 2,-0.4 -0.124 123.1 18.8 52.5-132.3 13.2 2.1 36.4 68 150 A E + 0 0 122 6,-0.3 -2,-0.2 1,-0.1 4,-0.1 -0.594 69.3 159.6 -74.8 128.2 9.5 2.2 37.6 69 151 A H - 0 0 46 -2,-0.4 -1,-0.1 2,-0.2 3,-0.1 0.170 66.8 -70.9-141.7 21.5 8.4 5.8 37.5 70 152 A G S S+ 0 0 68 1,-0.4 2,-0.2 0, 0.0 -2,-0.1 0.612 101.4 81.8 100.6 14.3 4.6 5.9 37.4 71 153 A D S S- 0 0 20 21,-0.0 -1,-0.4 0, 0.0 -2,-0.2 -0.784 88.5 -93.7-134.9-171.4 3.7 4.7 33.9 72 154 A F S S+ 0 0 183 -2,-0.2 -4,-0.0 1,-0.2 0, 0.0 0.573 108.8 59.0 -77.1 -7.3 3.2 1.5 32.0 73 155 A Y S S- 0 0 140 -6,-0.1 -1,-0.2 11,-0.0 11,-0.0 -0.749 71.2-163.6-128.3 83.6 6.8 1.5 30.6 74 156 A P - 0 0 69 0, 0.0 -6,-0.3 0, 0.0 -7,-0.1 -0.268 27.2-107.8 -64.7 151.4 9.5 1.3 33.2 75 157 A F - 0 0 8 -8,-2.4 -9,-0.1 1,-0.1 7,-0.1 -0.229 20.9-137.9 -72.7 171.8 13.0 2.2 32.2 76 158 A D - 0 0 58 1,-0.5 -1,-0.1 5,-0.4 -10,-0.0 0.012 36.4-103.8-130.9 23.7 15.6 -0.5 32.0 77 159 A G S S- 0 0 1 3,-0.0 -1,-0.5 4,-0.0 24,-0.2 -0.236 79.3 -3.7 78.1-171.8 18.9 0.6 33.4 78 160 A P S S+ 0 0 95 0, 0.0 24,-0.1 0, 0.0 3,-0.1 -0.215 116.1 2.1 -58.1 138.2 21.9 1.7 31.3 79 161 A G S S+ 0 0 28 1,-0.2 -3,-0.2 22,-0.1 2,-0.1 -0.226 96.8 64.4 83.4-174.9 21.6 1.4 27.6 80 162 A N S S+ 0 0 142 -5,-0.1 2,-0.3 2,-0.0 -1,-0.2 -0.405 103.4 29.7 62.7-129.3 18.6 0.2 25.5 81 163 A V + 0 0 67 1,-0.2 -5,-0.4 -2,-0.1 3,-0.1 -0.492 63.4 179.1 -65.3 123.9 15.7 2.6 25.8 82 164 A L - 0 0 26 1,-0.4 17,-2.6 -2,-0.3 2,-0.3 0.742 62.4 -24.1 -92.0 -30.4 17.1 6.1 26.5 83 165 A A E -E 98 0B 10 15,-0.2 -1,-0.4 17,-0.0 2,-0.3 -0.950 56.1-155.5-171.9 161.5 13.9 8.0 26.7 84 166 A H E -E 97 0B 31 13,-2.1 13,-3.1 -2,-0.3 2,-0.3 -0.978 4.0-163.6-150.1 164.5 10.2 7.9 25.6 85 167 A A E -E 96 0B 18 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.973 16.6-123.0-149.1 157.4 7.4 10.3 25.0 86 168 A Y - 0 0 38 9,-2.2 8,-0.3 6,-0.3 3,-0.1 -0.772 29.2-105.3-108.9 149.5 3.6 10.2 24.6 87 169 A A - 0 0 16 -2,-0.3 7,-0.9 1,-0.2 8,-0.2 -0.136 59.1 -65.3 -65.9 160.2 1.4 11.4 21.7 88 170 A P S S+ 0 0 10 0, 0.0 -1,-0.2 0, 0.0 6,-0.1 -0.107 86.5 86.2 -53.0 145.0 -0.7 14.6 22.0 89 171 A G S S- 0 0 23 4,-0.3 2,-0.1 35,-0.1 -3,-0.1 -0.922 73.6 -45.6 153.6-173.7 -3.5 14.6 24.6 90 172 A P S > S- 0 0 111 0, 0.0 3,-1.8 0, 0.0 2,-0.1 -0.362 97.6 -4.8 -83.1 162.1 -4.3 15.3 28.3 91 173 A G T 3 S+ 0 0 50 1,-0.3 4,-0.1 -2,-0.1 -2,-0.1 -0.339 137.3 7.0 66.1-129.2 -2.4 14.1 31.4 92 174 A I T > S+ 0 0 67 2,-0.1 3,-2.0 -2,-0.1 -6,-0.3 0.748 108.0 101.9 -63.2 -21.4 0.5 11.8 30.5 93 175 A N T < S+ 0 0 56 -3,-1.8 -4,-0.3 1,-0.2 -6,-0.2 -0.374 85.0 22.9 -64.0 142.5 -0.0 12.4 26.9 94 176 A G T 3 S+ 0 0 0 -7,-0.9 -1,-0.2 -8,-0.3 30,-0.1 0.164 96.0 128.7 87.5 -21.8 2.5 14.8 25.5 95 177 A D < - 0 0 13 -3,-2.0 -9,-2.2 -8,-0.2 2,-0.4 -0.346 44.8-152.7 -76.4 153.7 5.0 14.1 28.3 96 178 A A E -dE 62 85B 1 -35,-2.2 -33,-2.0 -11,-0.2 2,-0.4 -0.993 8.2-167.3-128.4 127.8 8.6 13.1 27.8 97 179 A H E -dE 63 84B 15 -13,-3.1 -13,-2.1 -2,-0.4 2,-0.4 -0.949 5.2-155.1-118.0 137.8 10.7 11.0 30.2 98 180 A F E -dE 64 83B 5 -35,-2.5 -33,-2.5 -2,-0.4 2,-0.7 -0.916 20.6-122.8-114.7 136.6 14.4 10.5 30.2 99 181 A D E > -d 65 0B 0 -17,-2.6 3,-1.5 -2,-0.4 -33,-0.2 -0.660 17.5-164.1 -78.8 110.8 16.3 7.6 31.6 100 182 A D T 3 S+ 0 0 32 -35,-2.1 -34,-0.2 -2,-0.7 -1,-0.1 0.306 81.5 78.5 -84.2 9.5 18.7 8.8 34.2 101 183 A D T 3 S+ 0 0 57 -36,-0.4 -1,-0.3 -24,-0.2 2,-0.2 0.536 84.4 81.2 -85.4 -5.0 20.6 5.6 34.2 102 184 A E S < S- 0 0 13 -3,-1.5 2,-0.8 -20,-0.2 -25,-0.0 -0.599 90.3-118.7 -82.2 160.0 22.1 6.9 31.0 103 185 A Q - 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