==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 27-OCT-08 3F16 . COMPND 2 MOLECULE: MACROPHAGE METALLOELASTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR V.CALDERONE . 158 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8401.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 84 53.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 10.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 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 . 9 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 31 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 1 0 0 0 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 . 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 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 1 106 A G 0 0 101 0, 0.0 2,-0.0 0, 0.0 120,-0.0 0.000 360.0 360.0 360.0-144.0 -9.6 12.8 -2.4 2 107 A P + 0 0 79 0, 0.0 2,-0.3 0, 0.0 81,-0.1 -0.318 360.0 179.1 -68.8 143.8 -7.9 14.2 -5.6 3 108 A V - 0 0 52 78,-0.1 2,-0.3 -2,-0.0 117,-0.1 -0.950 38.3 -93.5-134.9 158.1 -9.4 13.8 -9.1 4 109 A W - 0 0 25 115,-0.4 5,-0.0 -2,-0.3 115,-0.0 -0.581 29.1-156.1 -68.2 135.1 -8.5 14.8 -12.6 5 110 A R S S+ 0 0 245 -2,-0.3 2,-0.3 2,-0.0 -1,-0.1 -0.044 70.7 60.0-104.6 27.9 -10.2 18.2 -13.3 6 111 A K S S- 0 0 97 1,-0.1 -2,-0.1 0, 0.0 3,-0.0 -0.955 72.8-134.7-150.9 159.5 -10.1 17.7 -17.1 7 112 A H S S+ 0 0 112 -2,-0.3 36,-2.8 35,-0.1 2,-0.7 0.758 84.8 73.3 -95.4 -27.9 -11.5 15.2 -19.6 8 113 A Y E -a 43 0A 154 34,-0.2 2,-0.4 36,-0.1 36,-0.2 -0.829 63.9-179.6 -93.8 114.1 -8.6 14.5 -21.9 9 114 A I E -a 44 0A 2 34,-3.1 36,-2.0 -2,-0.7 2,-0.3 -0.913 11.7-151.7-116.8 137.0 -6.0 12.3 -20.1 10 115 A T E -a 45 0A 38 -2,-0.4 44,-2.2 34,-0.2 43,-0.6 -0.821 9.8-172.9-108.1 149.5 -2.7 11.1 -21.5 11 116 A Y E -ab 46 54A 7 34,-2.4 36,-2.9 -2,-0.3 2,-0.4 -0.959 4.3-163.9-133.0 156.9 -0.7 8.0 -20.7 12 117 A R E - b 0 55A 65 42,-2.0 44,-3.0 -2,-0.3 2,-0.8 -0.998 20.9-132.4-138.8 138.6 2.8 6.8 -21.7 13 118 A I E - b 0 56A 17 34,-0.4 44,-0.2 -2,-0.4 3,-0.1 -0.840 19.1-166.6 -91.9 107.8 4.3 3.4 -21.4 14 119 A N - 0 0 76 42,-2.8 2,-0.3 -2,-0.8 43,-0.2 0.869 66.4 -16.5 -61.2 -42.4 7.7 4.0 -19.9 15 120 A N - 0 0 52 41,-0.6 2,-0.4 -3,-0.1 -1,-0.2 -0.961 69.0-112.5-162.1 163.0 9.1 0.6 -20.7 16 121 A Y - 0 0 64 -2,-0.3 6,-0.1 -3,-0.1 41,-0.0 -0.900 23.3-120.4-115.4 133.6 7.9 -2.9 -21.7 17 122 A T > - 0 0 0 -2,-0.4 3,-1.0 1,-0.1 8,-0.1 -0.423 14.6-140.8 -62.1 136.2 8.0 -6.1 -19.7 18 123 A P T 3 S+ 0 0 103 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.511 93.0 81.8 -74.3 -2.6 10.0 -8.9 -21.5 19 124 A D T 3 S+ 0 0 38 77,-0.1 2,-0.3 2,-0.1 -2,-0.0 0.659 96.2 36.6 -70.7 -20.9 7.2 -11.3 -20.2 20 125 A M S < S- 0 0 16 -3,-1.0 2,-0.2 79,-0.1 79,-0.1 -0.874 91.5 -90.9-133.2 159.3 4.9 -10.3 -23.1 21 126 A N >> - 0 0 106 -2,-0.3 4,-1.7 1,-0.1 3,-0.7 -0.516 42.2-122.0 -64.1 139.8 4.7 -9.4 -26.8 22 127 A R H 3> S+ 0 0 142 1,-0.3 4,-2.3 2,-0.2 3,-0.3 0.901 111.8 51.8 -52.7 -47.1 5.0 -5.6 -27.2 23 128 A E H 3> S+ 0 0 143 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.818 107.0 54.5 -62.9 -29.7 1.6 -5.4 -29.0 24 129 A D H <> S+ 0 0 42 -3,-0.7 4,-2.4 2,-0.2 -1,-0.2 0.834 106.3 50.8 -74.0 -34.2 -0.0 -7.4 -26.2 25 130 A V H X S+ 0 0 0 -4,-1.7 4,-2.4 -3,-0.3 5,-0.3 0.953 111.3 48.8 -64.0 -49.6 1.2 -4.9 -23.6 26 131 A D H X S+ 0 0 50 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.927 114.7 45.0 -54.1 -47.9 -0.2 -2.0 -25.6 27 132 A Y H X S+ 0 0 128 -4,-2.1 4,-2.8 2,-0.2 5,-0.2 0.901 110.7 52.1 -69.4 -40.3 -3.5 -3.7 -26.1 28 133 A A H X S+ 0 0 7 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.928 114.2 44.0 -59.9 -45.4 -3.9 -4.9 -22.4 29 134 A I H X S+ 0 0 1 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.929 113.1 51.0 -67.3 -45.1 -3.3 -1.3 -21.2 30 135 A R H X S+ 0 0 139 -4,-2.6 4,-2.1 -5,-0.3 -2,-0.2 0.928 111.4 48.1 -55.7 -48.0 -5.5 0.2 -23.9 31 136 A K H X S+ 0 0 46 -4,-2.8 4,-1.6 1,-0.2 -1,-0.2 0.868 108.3 54.9 -63.1 -37.8 -8.4 -2.1 -22.9 32 137 A A H X S+ 0 0 0 -4,-2.0 4,-0.9 -5,-0.2 -1,-0.2 0.909 108.6 47.7 -63.8 -42.0 -7.9 -1.4 -19.2 33 138 A F H >X S+ 0 0 3 -4,-2.2 4,-2.3 1,-0.2 3,-0.7 0.898 106.8 58.7 -61.0 -40.9 -8.3 2.4 -19.9 34 139 A Q H 3X S+ 0 0 72 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.846 94.6 64.2 -59.6 -36.0 -11.4 1.6 -21.9 35 140 A V H 3< S+ 0 0 18 -4,-1.6 4,-0.3 1,-0.2 -1,-0.2 0.907 111.3 37.1 -51.9 -43.9 -13.1 -0.0 -18.9 36 141 A W H X< S+ 0 0 0 -4,-0.9 3,-1.2 -3,-0.7 4,-0.3 0.848 111.5 55.7 -83.1 -36.3 -13.0 3.3 -17.2 37 142 A S H >< S+ 0 0 36 -4,-2.3 3,-0.7 1,-0.2 -1,-0.2 0.790 99.8 66.5 -65.0 -23.8 -13.8 5.6 -20.2 38 143 A N T 3< S+ 0 0 129 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.736 111.5 31.2 -60.6 -28.6 -16.9 3.4 -20.6 39 144 A V T < S+ 0 0 33 -3,-1.2 -1,-0.2 -4,-0.3 -2,-0.2 0.182 121.1 44.8-123.3 12.8 -18.4 4.7 -17.3 40 145 A T S < S- 0 0 20 -3,-0.7 114,-0.1 -4,-0.3 118,-0.0 -0.891 84.9-106.6-143.2 171.2 -17.0 8.2 -17.1 41 146 A P S S+ 0 0 59 0, 0.0 2,-0.1 0, 0.0 -4,-0.1 0.343 78.7 123.4 -80.7 7.8 -16.5 11.3 -19.4 42 147 A L - 0 0 4 -6,-0.3 2,-0.4 -34,-0.1 -2,-0.2 -0.405 45.7-161.0 -75.2 144.8 -12.8 10.6 -19.5 43 148 A K E -a 8 0A 107 -36,-2.8 -34,-3.1 -2,-0.1 2,-0.4 -0.994 8.2-155.2-122.5 132.4 -10.9 10.1 -22.8 44 149 A F E -a 9 0A 33 -2,-0.4 2,-0.4 -36,-0.2 -34,-0.2 -0.906 10.6-176.7-113.5 134.0 -7.4 8.4 -22.7 45 150 A S E -a 10 0A 64 -36,-2.0 -34,-2.4 -2,-0.4 2,-0.5 -0.995 22.1-132.6-129.9 135.1 -4.7 8.8 -25.3 46 151 A K E -a 11 0A 73 -2,-0.4 2,-0.3 -36,-0.2 -34,-0.2 -0.708 23.7-166.0 -83.0 127.7 -1.3 7.1 -25.5 47 152 A I - 0 0 43 -36,-2.9 -34,-0.4 -2,-0.5 3,-0.1 -0.858 15.9-156.9-114.0 153.2 1.6 9.4 -26.1 48 153 A N S S+ 0 0 124 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.556 75.7 24.6-107.5 -11.2 5.1 8.3 -27.2 49 154 A T S S+ 0 0 123 2,-0.1 -1,-0.1 -37,-0.0 2,-0.0 -0.951 96.1 28.3-145.9 159.4 7.1 11.3 -25.9 50 155 A G S S- 0 0 46 -2,-0.3 2,-0.7 -3,-0.1 -3,-0.1 -0.207 95.8 -28.4 88.3-173.5 6.8 14.0 -23.3 51 156 A M - 0 0 184 -2,-0.0 2,-0.2 4,-0.0 -41,-0.1 -0.735 60.3-169.4 -87.8 112.7 5.1 14.4 -19.9 52 157 A A - 0 0 15 -2,-0.7 3,-0.2 1,-0.1 -41,-0.2 -0.600 29.8-127.1 -93.3 160.6 2.0 12.2 -19.6 53 158 A D S S+ 0 0 28 -43,-0.6 2,-0.5 1,-0.3 -42,-0.2 0.922 102.7 34.2 -66.4 -45.5 -0.6 12.4 -16.9 54 159 A I E S-b 11 0A 0 -44,-2.2 -42,-2.0 35,-0.1 2,-0.5 -0.950 73.0-164.3-119.4 111.9 -0.2 8.6 -16.2 55 160 A L E -b 12 0A 30 -2,-0.5 35,-2.3 -44,-0.2 2,-0.5 -0.872 9.8-150.9 -95.9 125.3 3.2 7.0 -16.6 56 161 A V E -bc 13 90A 2 -44,-3.0 -42,-2.8 -2,-0.5 -41,-0.6 -0.867 22.0-178.5 -96.7 122.8 3.1 3.1 -16.8 57 162 A V E - c 0 91A 19 33,-2.5 35,-2.9 -2,-0.5 2,-0.5 -0.966 24.5-156.7-128.9 136.2 6.2 1.6 -15.5 58 163 A F E + c 0 92A 7 -2,-0.4 2,-0.3 33,-0.2 35,-0.2 -0.972 37.4 146.0-105.1 125.8 7.5 -2.0 -15.1 59 164 A A E - c 0 93A 17 33,-2.3 35,-2.5 -2,-0.5 36,-0.4 -0.983 34.9-140.0-154.1 158.9 10.2 -2.2 -12.4 60 165 A R - 0 0 135 -2,-0.3 33,-0.0 33,-0.2 -2,-0.0 -0.895 62.3 -18.3-122.3 156.8 11.6 -4.5 -9.7 61 166 A G S S+ 0 0 25 -2,-0.3 8,-2.3 7,-0.1 2,-0.3 -0.168 122.6 8.3 53.9-140.1 12.8 -3.9 -6.1 62 167 A A + 0 0 90 6,-0.3 -2,-0.2 1,-0.1 4,-0.1 -0.575 67.2 165.5 -72.8 130.0 13.6 -0.3 -5.3 63 168 A H - 0 0 44 -2,-0.3 -1,-0.1 2,-0.3 3,-0.1 0.020 64.0 -74.4-143.6 29.8 12.6 1.9 -8.2 64 169 A G S S+ 0 0 84 1,-0.4 2,-0.2 2,-0.0 -2,-0.1 0.543 102.9 81.5 94.2 8.3 12.7 5.5 -7.0 65 170 A D S S- 0 0 28 21,-0.0 -1,-0.4 0, 0.0 -2,-0.3 -0.700 91.6 -96.7-124.8-174.8 9.6 5.8 -4.7 66 171 A D S S+ 0 0 159 -2,-0.2 2,-0.3 1,-0.2 -4,-0.0 0.287 106.4 78.8 -84.5 14.2 8.9 4.9 -1.1 67 172 A H - 0 0 91 -6,-0.1 -1,-0.2 11,-0.0 -6,-0.0 -0.509 64.6-172.8-130.6 62.7 7.3 1.7 -2.2 68 173 A A - 0 0 56 -2,-0.3 -6,-0.3 -3,-0.2 2,-0.1 -0.225 27.1-116.0 -55.5 141.3 9.9 -0.9 -3.1 69 174 A F - 0 0 14 -8,-2.3 -1,-0.1 1,-0.1 3,-0.1 -0.357 14.5-139.3 -78.2 166.5 8.7 -4.1 -4.7 70 175 A D - 0 0 80 1,-0.5 -1,-0.1 5,-0.4 2,-0.1 0.004 39.3-103.5-124.1 21.8 9.1 -7.5 -2.9 71 176 A G S S- 0 0 20 3,-0.0 -1,-0.5 4,-0.0 24,-0.1 -0.295 78.7 -6.0 78.6-170.7 10.0 -10.1 -5.6 72 177 A K S S+ 0 0 173 23,-0.1 24,-0.2 -3,-0.1 3,-0.1 -0.311 119.8 3.1 -61.8 135.9 7.7 -12.7 -7.0 73 178 A G S S+ 0 0 28 1,-0.2 -3,-0.3 2,-0.1 2,-0.2 -0.308 98.4 65.9 84.2-170.1 4.2 -12.7 -5.4 74 179 A G S S+ 0 0 68 -2,-0.1 2,-0.4 -5,-0.1 -1,-0.2 -0.378 104.5 29.6 59.7-123.0 2.9 -10.4 -2.6 75 180 A I + 0 0 79 -2,-0.2 -5,-0.4 1,-0.2 3,-0.1 -0.549 64.3 176.6 -68.7 123.0 2.6 -6.9 -4.0 76 181 A L - 0 0 34 1,-0.4 17,-2.6 -2,-0.4 2,-0.3 0.744 61.4 -23.3 -96.6 -31.3 1.9 -7.1 -7.7 77 182 A A E -D 92 0A 13 15,-0.2 -1,-0.4 2,-0.0 2,-0.3 -0.964 54.2-163.5-170.2 163.8 1.5 -3.4 -8.6 78 183 A H E -D 91 0A 30 13,-2.2 13,-3.3 -2,-0.3 2,-0.3 -0.969 5.9-165.4-157.3 167.2 0.7 -0.0 -7.1 79 184 A A E -D 90 0A 19 -2,-0.3 2,-0.4 11,-0.2 11,-0.2 -0.952 17.0-121.8-152.7 166.9 -0.3 3.4 -8.2 80 185 A F - 0 0 40 9,-2.1 8,-1.0 -2,-0.3 3,-0.1 -0.918 30.3-113.4-120.1 140.3 -0.7 7.0 -7.2 81 186 A G - 0 0 33 -2,-0.4 7,-1.0 6,-0.2 8,-0.2 -0.106 56.3 -58.4 -66.3 168.0 -3.8 9.1 -7.2 82 187 A P S S+ 0 0 11 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.103 85.6 98.1 -51.3 138.9 -4.3 12.2 -9.4 83 188 A G S S- 0 0 38 4,-0.2 -3,-0.1 -30,-0.1 2,-0.0 -0.916 71.6 -56.5 162.8 177.4 -1.8 15.0 -9.1 84 189 A S S > S- 0 0 115 -2,-0.3 3,-2.2 2,-0.1 2,-0.2 -0.280 99.8 -2.0 -74.8 165.5 1.4 16.4 -10.6 85 190 A G T 3 S+ 0 0 64 1,-0.3 -2,-0.1 3,-0.1 4,-0.1 -0.348 141.6 10.7 61.8-118.8 4.6 14.4 -11.1 86 191 A I T > S+ 0 0 76 -2,-0.2 3,-2.4 2,-0.1 -6,-0.3 0.690 102.6 117.2 -64.7 -21.0 4.3 10.9 -9.7 87 192 A G T < S+ 0 0 7 -3,-2.2 -4,-0.2 1,-0.3 -6,-0.2 -0.228 80.6 14.8 -51.5 134.4 0.5 11.5 -9.4 88 193 A G T 3 S+ 0 0 0 -7,-1.0 -1,-0.3 -8,-1.0 30,-0.1 0.140 93.5 137.9 86.7 -19.2 -1.5 9.2 -11.6 89 194 A D < - 0 0 17 -3,-2.4 -9,-2.1 -8,-0.2 2,-0.4 -0.270 39.2-154.3 -71.7 148.9 1.5 6.8 -12.3 90 195 A A E -cD 56 79A 0 -35,-2.3 -33,-2.5 -11,-0.2 2,-0.4 -0.988 6.9-164.2-126.6 125.2 1.0 3.0 -12.2 91 196 A H E -cD 57 78A 14 -13,-3.3 -13,-2.2 -2,-0.4 2,-0.4 -0.937 2.1-161.7-117.0 133.4 3.9 0.7 -11.4 92 197 A F E -cD 58 77A 1 -35,-2.9 -33,-2.3 -2,-0.4 2,-0.5 -0.943 26.5-117.3-118.0 129.0 3.9 -3.1 -12.1 93 198 A D E > -c 59 0A 0 -17,-2.6 3,-1.9 -2,-0.4 -33,-0.2 -0.524 15.9-156.1 -71.1 115.2 6.4 -5.4 -10.4 94 199 A E T 3 S+ 0 0 15 -35,-2.5 -34,-0.2 -2,-0.5 -1,-0.2 0.679 88.2 74.9 -67.0 -16.4 8.7 -7.0 -13.0 95 200 A D T 3 S+ 0 0 50 -36,-0.4 -1,-0.3 -24,-0.1 2,-0.2 0.597 85.5 79.2 -73.9 -8.5 9.3 -9.9 -10.6 96 201 A E S < S- 0 0 8 -3,-1.9 2,-0.7 -20,-0.2 -77,-0.1 -0.522 89.7-119.7 -81.7 164.6 5.8 -11.1 -11.6 97 202 A F - 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