==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 11-JUN-99 1QIC . COMPND 2 MOLECULE: PROTEIN (STROMELYSIN-1); . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.G.WILLIAMS,Q.-Z.YE,F.MOLINA,L.L.JOHNSON,D.F.ORTWINE, . 644 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33211.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 336 52.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 68 10.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 2.5 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 . 40 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 136 21.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 4 4 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 4 8 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 . 0 0 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 0 ANTIPARALLEL BRIDGES PER LADDER . 4 0 0 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 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 89 A I 0 0 186 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 76.2 15.2 13.9 13.5 2 90 A P + 0 0 76 0, 0.0 2,-0.3 0, 0.0 81,-0.1 -0.328 360.0 155.1 -63.7 140.1 14.1 12.8 10.0 3 91 A K - 0 0 72 79,-0.1 2,-0.1 78,-0.1 117,-0.1 -0.980 44.7 -87.1-162.8 156.4 12.2 9.5 9.7 4 92 A W - 0 0 19 115,-0.5 5,-0.0 -2,-0.3 115,-0.0 -0.428 21.4-148.9 -68.6 141.2 9.7 7.6 7.5 5 93 A R S S+ 0 0 213 -2,-0.1 2,-0.3 1,-0.0 -1,-0.1 -0.220 82.2 51.7-101.9 39.4 6.0 8.3 8.1 6 94 A K - 0 0 104 1,-0.0 -2,-0.1 0, 0.0 36,-0.0 -0.868 68.1-144.8-172.2 137.0 5.2 4.7 7.0 7 95 A T S S+ 0 0 63 -2,-0.3 36,-2.6 1,-0.1 2,-0.7 0.602 85.2 74.0 -86.4 -9.8 6.4 1.3 8.0 8 96 A H E +a 43 0A 92 34,-0.2 2,-0.3 36,-0.0 36,-0.2 -0.883 63.8 177.5-110.2 105.0 6.2 -0.3 4.5 9 97 A L E -a 44 0A 0 34,-2.0 36,-1.3 -2,-0.7 2,-0.4 -0.742 18.0-143.5-104.8 153.5 8.9 0.9 2.1 10 98 A T E -a 45 0A 26 -2,-0.3 44,-2.0 34,-0.2 43,-0.9 -0.915 15.8-167.6-117.7 143.1 9.7 -0.1 -1.4 11 99 A Y E -ab 46 54A 19 34,-1.8 36,-2.4 -2,-0.4 2,-0.4 -0.918 6.9-163.7-129.9 157.1 13.1 -0.5 -3.0 12 100 A R E - b 0 55A 57 42,-1.9 44,-1.5 -2,-0.3 2,-1.4 -0.959 19.0-141.0-145.6 121.8 14.5 -0.9 -6.5 13 101 A I E - b 0 56A 12 -2,-0.4 44,-0.2 34,-0.3 42,-0.1 -0.672 20.6-171.3 -80.8 93.6 17.9 -2.1 -7.6 14 102 A V - 0 0 61 42,-2.4 2,-0.3 -2,-1.4 -1,-0.2 0.898 62.5 -19.3 -54.3 -47.7 18.4 0.3 -10.5 15 103 A N - 0 0 66 41,-0.5 2,-0.3 -3,-0.1 -1,-0.1 -0.892 66.5-112.2-151.2-177.6 21.6 -1.4 -11.8 16 104 A Y - 0 0 63 -2,-0.3 6,-0.1 41,-0.1 42,-0.1 -0.881 21.3-114.2-128.3 158.2 24.4 -3.8 -10.9 17 105 A T > - 0 0 5 -2,-0.3 3,-0.6 4,-0.1 8,-0.1 -0.581 18.7-133.0 -87.4 146.6 28.1 -3.8 -10.3 18 106 A P T 3 S+ 0 0 118 0, 0.0 -1,-0.1 0, 0.0 4,-0.0 0.647 98.3 73.6 -71.2 -15.9 30.5 -5.7 -12.6 19 107 A D T 3 S+ 0 0 67 77,-0.1 78,-0.0 2,-0.0 75,-0.0 0.827 101.4 31.4 -67.8 -38.4 32.3 -7.1 -9.5 20 108 A L S < S- 0 0 27 -3,-0.6 2,-0.1 79,-0.1 79,-0.1 -0.821 89.1 -96.5-123.1 160.3 29.6 -9.6 -8.4 21 109 A P > - 0 0 75 0, 0.0 4,-1.6 0, 0.0 3,-0.4 -0.418 44.8-104.2 -69.7 155.4 26.9 -11.7 -10.2 22 110 A K H > S+ 0 0 128 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.830 122.7 51.1 -47.3 -36.8 23.4 -10.3 -10.4 23 111 A D H > S+ 0 0 111 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.895 101.5 55.8 -72.4 -43.0 22.4 -12.7 -7.6 24 112 A A H > S+ 0 0 5 -3,-0.4 4,-1.5 1,-0.2 -1,-0.2 0.818 110.0 50.9 -59.0 -30.0 25.2 -11.9 -5.1 25 113 A V H X S+ 0 0 1 -4,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.938 109.1 47.3 -73.0 -49.4 24.1 -8.3 -5.3 26 114 A D H X S+ 0 0 27 -4,-1.7 4,-2.8 1,-0.2 -2,-0.2 0.868 112.3 51.4 -60.1 -38.8 20.4 -9.0 -4.6 27 115 A S H X S+ 0 0 52 -4,-2.4 4,-2.9 2,-0.2 5,-0.3 0.886 107.4 51.3 -66.4 -42.9 21.3 -11.3 -1.7 28 116 A A H X S+ 0 0 6 -4,-1.5 4,-1.6 -5,-0.2 -1,-0.2 0.921 114.7 44.7 -60.7 -41.6 23.5 -8.6 -0.1 29 117 A V H X S+ 0 0 5 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.932 115.1 45.7 -68.1 -48.8 20.6 -6.2 -0.4 30 118 A E H X S+ 0 0 91 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.914 114.6 47.9 -63.4 -43.9 17.9 -8.5 0.9 31 119 A K H X S+ 0 0 99 -4,-2.9 4,-1.0 1,-0.2 -1,-0.2 0.840 112.7 51.0 -66.4 -31.3 20.1 -9.7 3.8 32 120 A A H X S+ 0 0 0 -4,-1.6 4,-0.6 -5,-0.3 -2,-0.2 0.862 113.3 43.3 -72.8 -38.7 20.8 -6.1 4.6 33 121 A L H >X S+ 0 0 5 -4,-2.3 4,-2.4 1,-0.2 3,-0.7 0.862 108.3 59.9 -73.8 -36.9 17.2 -5.0 4.6 34 122 A K H 3X S+ 0 0 108 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.802 94.4 63.8 -63.5 -29.3 16.2 -8.1 6.5 35 123 A V H 3X S+ 0 0 14 -4,-1.0 4,-0.6 1,-0.2 -1,-0.2 0.869 112.6 35.3 -64.4 -34.5 18.4 -7.2 9.5 36 124 A W H << S+ 0 0 0 -3,-0.7 3,-0.5 -4,-0.6 4,-0.5 0.848 112.4 59.4 -85.5 -35.4 16.3 -4.0 10.0 37 125 A E H >< S+ 0 0 55 -4,-2.4 3,-0.5 1,-0.2 -2,-0.2 0.809 103.0 55.6 -61.7 -31.3 13.0 -5.7 9.0 38 126 A E H 3< S+ 0 0 128 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.814 110.3 42.0 -71.5 -36.1 13.5 -8.2 11.9 39 127 A V T 3< S+ 0 0 24 -4,-0.6 -1,-0.2 -3,-0.5 -2,-0.2 0.303 120.0 33.7 -97.8 10.5 13.9 -5.6 14.6 40 128 A T S < S- 0 0 3 -3,-0.5 119,-0.1 -4,-0.5 115,-0.1 -0.949 86.8 -99.9-154.9 168.4 11.1 -3.3 13.6 41 129 A P S S+ 0 0 45 0, 0.0 2,-0.1 0, 0.0 -4,-0.1 0.398 79.3 129.0 -73.6 2.8 7.6 -3.1 11.9 42 130 A L - 0 0 1 -6,-0.3 2,-0.4 -34,-0.1 -34,-0.2 -0.386 38.6-172.1 -63.0 135.0 9.4 -2.1 8.7 43 131 A T E -a 8 0A 61 -36,-2.6 -34,-2.0 -2,-0.1 2,-0.3 -0.999 6.0-156.6-134.0 128.7 8.5 -4.1 5.7 44 132 A F E -a 9 0A 22 -2,-0.4 2,-0.4 -36,-0.2 -34,-0.2 -0.788 5.4-168.3-107.5 148.9 10.3 -3.9 2.3 45 133 A S E -a 10 0A 50 -36,-1.3 -34,-1.8 -2,-0.3 2,-0.2 -0.990 22.6-121.9-139.6 127.0 8.9 -4.7 -1.1 46 134 A R E -a 11 0A 44 -2,-0.4 2,-0.4 -36,-0.2 -34,-0.2 -0.443 23.5-167.8 -70.9 136.5 10.9 -5.1 -4.3 47 135 A L - 0 0 48 -36,-2.4 -34,-0.3 -2,-0.2 5,-0.1 -0.987 14.0-174.3-125.2 132.4 10.0 -2.9 -7.3 48 136 A Y S S+ 0 0 158 -2,-0.4 2,-0.3 -36,-0.1 -1,-0.1 0.529 72.5 39.5-102.1 -9.4 11.3 -3.5 -10.8 49 137 A E S S- 0 0 156 2,-0.1 -1,-0.0 0, 0.0 -35,-0.0 -0.907 99.6 -0.6-136.5 162.7 9.8 -0.4 -12.4 50 138 A G S S- 0 0 45 -2,-0.3 2,-0.4 -3,-0.1 -3,-0.1 -0.013 98.4 -16.7 62.0-160.8 9.2 3.2 -11.6 51 139 A E - 0 0 126 4,-0.0 2,-0.3 2,-0.0 -2,-0.1 -0.677 58.5-175.5 -86.7 130.5 10.0 5.2 -8.5 52 140 A A - 0 0 2 -2,-0.4 3,-0.2 -40,-0.1 -41,-0.2 -0.803 36.9-115.4-120.5 162.1 10.8 3.4 -5.2 53 141 A D S S+ 0 0 33 -43,-0.9 2,-0.6 -2,-0.3 -42,-0.2 0.869 110.6 37.0 -64.4 -37.4 11.4 4.8 -1.7 54 142 A I E S-b 11 0A 0 -44,-2.0 -42,-1.9 35,-0.1 2,-1.1 -0.909 74.9-164.3-122.2 100.4 15.0 3.5 -1.7 55 143 A M E -b 12 0A 25 -2,-0.6 35,-0.9 -3,-0.2 2,-0.4 -0.746 12.5-164.8 -88.3 97.4 16.6 3.8 -5.1 56 144 A I E +bc 13 90A 4 -44,-1.5 -42,-2.4 -2,-1.1 -41,-0.5 -0.668 20.6 147.7 -86.2 133.9 19.7 1.6 -4.9 57 145 A S E - c 0 91A 18 33,-1.9 35,-2.5 -2,-0.4 2,-0.3 -0.992 40.0-121.6-160.8 162.5 22.4 1.9 -7.5 58 146 A F E + c 0 92A 13 -2,-0.3 2,-0.3 33,-0.2 35,-0.2 -0.853 38.0 155.2-108.0 146.9 26.1 1.7 -8.3 59 147 A A E - c 0 93A 20 33,-2.4 35,-1.9 -2,-0.3 2,-0.3 -0.991 31.8-132.1-167.3 157.7 28.2 4.6 -9.7 60 148 A V - 0 0 65 -2,-0.3 10,-0.0 2,-0.2 33,-0.0 -0.868 66.2 -35.1-116.6 150.7 31.7 6.2 -10.1 61 149 A R S S+ 0 0 130 -2,-0.3 8,-1.1 7,-0.1 2,-0.1 0.008 122.6 16.6 39.3-132.1 32.7 9.8 -9.5 62 150 A E + 0 0 169 6,-0.2 -2,-0.2 1,-0.1 4,-0.1 -0.437 69.4 155.3 -67.3 137.7 30.0 12.3 -10.5 63 151 A H - 0 0 49 2,-0.2 2,-0.3 -2,-0.1 -1,-0.1 0.116 63.2 -68.1-157.9 32.5 26.6 10.7 -10.8 64 152 A G S S+ 0 0 80 1,-0.3 -2,-0.1 2,-0.0 0, 0.0 -0.439 99.8 69.9 118.7 -65.5 23.6 12.9 -10.3 65 153 A D S S- 0 0 30 -2,-0.3 -1,-0.3 2,-0.2 -2,-0.2 0.167 94.1 -82.7 -77.8-160.1 23.2 14.1 -6.8 66 154 A F S S+ 0 0 133 1,-0.2 -1,-0.1 -3,-0.1 -4,-0.0 0.324 107.4 66.4 -88.7 1.7 25.2 16.5 -4.6 67 155 A Y - 0 0 144 -6,-0.1 -2,-0.2 11,-0.0 -1,-0.2 -0.841 66.8-162.4-131.9 99.9 28.0 14.1 -3.5 68 156 A P - 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0 0 20 9,-1.7 8,-0.3 -2,-0.3 3,-0.1 -0.758 32.9-105.5-101.2 147.1 20.3 10.0 2.3 81 169 A A - 0 0 40 -2,-0.3 7,-0.6 1,-0.2 8,-0.2 -0.114 59.7 -63.3 -62.4 163.9 18.0 10.3 5.4 82 170 A P S S+ 0 0 10 0, 0.0 -1,-0.2 0, 0.0 6,-0.1 -0.146 87.8 88.9 -51.6 142.3 14.2 9.5 5.1 83 171 A G S S- 0 0 25 4,-0.3 2,-0.1 35,-0.2 -3,-0.0 -0.981 70.4 -46.1 159.4-168.2 12.3 11.7 2.7 84 172 A P S > S- 0 0 109 0, 0.0 3,-2.2 0, 0.0 -31,-0.0 -0.303 93.2 -9.5 -87.9 175.8 11.1 12.3 -0.9 85 173 A G T 3 S+ 0 0 49 1,-0.3 4,-0.1 -2,-0.1 -2,-0.1 -0.041 136.3 10.8 42.1-120.6 12.9 12.1 -4.2 86 174 A I T > S+ 0 0 49 2,-0.1 3,-1.6 -32,-0.1 -6,-0.3 0.779 109.4 99.3 -58.6 -28.2 16.7 11.8 -3.7 87 175 A N T < S+ 0 0 52 -3,-2.2 -4,-0.3 1,-0.2 -32,-0.1 -0.294 82.6 24.8 -63.7 142.2 16.2 11.1 0.0 88 176 A G T 3 S+ 0 0 0 -7,-0.6 -1,-0.2 1,-0.3 30,-0.1 0.231 91.7 132.2 88.3 -13.8 16.3 7.5 1.1 89 177 A D < - 0 0 14 -3,-1.6 -9,-1.7 -35,-0.2 2,-0.5 -0.371 44.6-151.1 -72.5 150.0 18.4 6.5 -1.9 90 178 A A E -cD 56 79A 1 -35,-0.9 -33,-1.9 -11,-0.2 2,-0.4 -0.984 12.3-173.7-127.7 119.9 21.5 4.4 -1.4 91 179 A H E -cD 57 78A 13 -13,-2.2 -13,-1.6 -2,-0.5 2,-0.5 -0.945 8.5-155.0-118.1 136.1 24.5 4.7 -3.9 92 180 A F E -cD 58 77A 5 -35,-2.5 -33,-2.4 -2,-0.4 2,-0.7 -0.927 22.6-121.2-111.8 130.4 27.6 2.5 -3.9 93 181 A D E > -c 59 0A 0 -17,-2.3 3,-1.5 -2,-0.5 -33,-0.2 -0.532 17.8-159.9 -71.5 111.3 30.9 3.6 -5.3 94 182 A D T 3 S+ 0 0 33 -35,-1.9 -34,-0.2 -2,-0.7 -1,-0.2 0.079 79.6 83.6 -80.0 24.5 31.7 1.1 -8.1 95 183 A D T 3 S+ 0 0 54 -36,-0.3 -1,-0.3 -24,-0.2 2,-0.2 0.485 83.2 72.1 -99.0 -7.2 35.4 2.1 -7.9 96 184 A E S < S- 0 0 21 -3,-1.5 2,-0.8 -20,-0.2 -77,-0.1 -0.468 94.5-107.9 -97.1 171.8 35.7 -0.3 -5.0 97 185 A Q - 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