==== 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 3F15 . 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) . 8404.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 82 51.9 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 . 8 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 32 20.3 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 1 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 0 108 0, 0.0 120,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-165.6 -8.9 13.0 -2.4 2 107 A P + 0 0 76 0, 0.0 2,-0.3 0, 0.0 81,-0.1 -0.207 360.0 179.5 -67.5 142.3 -7.4 14.2 -5.7 3 108 A V - 0 0 50 78,-0.1 2,-0.3 79,-0.0 117,-0.1 -0.942 38.4 -96.5-131.9 161.3 -9.1 13.8 -9.1 4 109 A W - 0 0 24 115,-0.4 5,-0.0 -2,-0.3 115,-0.0 -0.628 28.2-155.7 -73.6 133.3 -8.1 14.9 -12.6 5 110 A R S S+ 0 0 237 -2,-0.3 2,-0.3 2,-0.0 -1,-0.1 -0.142 70.7 63.2-103.2 35.0 -9.8 18.2 -13.4 6 111 A K S S- 0 0 97 1,-0.1 -2,-0.1 0, 0.0 3,-0.0 -0.965 72.3-136.4-153.0 158.3 -9.8 17.7 -17.1 7 112 A H S S+ 0 0 114 -2,-0.3 36,-2.9 35,-0.1 2,-0.7 0.728 84.5 72.5 -95.4 -26.4 -11.3 15.2 -19.6 8 113 A Y E -a 43 0A 179 34,-0.2 2,-0.4 36,-0.1 36,-0.2 -0.855 64.2-178.4 -96.1 115.2 -8.4 14.4 -21.9 9 114 A I E -a 44 0A 2 34,-3.2 36,-1.9 -2,-0.7 2,-0.3 -0.925 11.0-151.8-118.6 134.4 -5.9 12.2 -20.1 10 115 A T E -a 45 0A 38 -2,-0.4 44,-2.2 34,-0.2 43,-0.5 -0.784 10.1-171.9-105.6 149.6 -2.6 11.0 -21.6 11 116 A Y E -ab 46 54A 7 34,-2.7 36,-3.0 -2,-0.3 2,-0.4 -0.966 3.7-165.0-134.3 160.6 -0.6 7.9 -20.8 12 117 A R E - b 0 55A 71 42,-2.1 44,-3.1 -2,-0.3 2,-0.9 -1.000 21.1-133.6-143.9 137.3 2.8 6.6 -21.8 13 118 A I E - b 0 56A 16 34,-0.4 44,-0.2 -2,-0.4 3,-0.1 -0.843 19.5-168.3 -93.1 110.3 4.4 3.2 -21.5 14 119 A N - 0 0 87 42,-2.7 2,-0.3 -2,-0.9 43,-0.2 0.837 66.3 -15.7 -65.0 -40.3 7.9 4.0 -20.1 15 120 A N - 0 0 52 41,-0.7 2,-0.4 -3,-0.1 -1,-0.2 -0.963 68.8-112.6-163.1 165.0 9.2 0.5 -20.8 16 121 A Y - 0 0 62 -2,-0.3 6,-0.1 -3,-0.1 41,-0.0 -0.911 22.2-121.5-118.6 131.4 8.0 -3.0 -21.6 17 122 A T > - 0 0 0 -2,-0.4 3,-0.9 1,-0.1 8,-0.1 -0.424 15.6-140.2 -61.0 137.4 8.2 -6.2 -19.6 18 123 A P T 3 S+ 0 0 101 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.511 93.7 81.1 -74.4 -4.7 10.1 -9.0 -21.4 19 124 A D T 3 S+ 0 0 39 77,-0.1 2,-0.3 2,-0.1 -2,-0.0 0.679 96.4 38.3 -70.2 -23.2 7.4 -11.4 -20.1 20 125 A M S < S- 0 0 15 -3,-0.9 2,-0.2 79,-0.1 79,-0.1 -0.851 90.4 -92.8-128.5 161.8 5.0 -10.4 -22.9 21 126 A N >> - 0 0 98 -2,-0.3 4,-1.8 1,-0.1 3,-0.5 -0.522 40.6-122.7 -65.2 141.8 4.8 -9.5 -26.6 22 127 A R H 3> S+ 0 0 142 1,-0.2 4,-2.3 2,-0.2 3,-0.4 0.919 112.0 51.6 -53.6 -49.9 5.0 -5.7 -27.1 23 128 A E H 3> S+ 0 0 140 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.819 108.0 53.6 -58.7 -32.3 1.6 -5.6 -28.9 24 129 A D H <> S+ 0 0 43 -3,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.802 106.9 50.5 -76.2 -32.6 0.0 -7.5 -26.0 25 130 A V H X S+ 0 0 0 -4,-1.8 4,-2.5 -3,-0.4 5,-0.3 0.954 111.8 48.2 -63.5 -51.6 1.3 -5.0 -23.4 26 131 A D H X S+ 0 0 50 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.925 114.5 46.2 -51.5 -48.4 -0.1 -2.1 -25.5 27 132 A Y H X S+ 0 0 127 -4,-2.3 4,-3.0 2,-0.2 5,-0.2 0.915 110.7 51.1 -67.7 -43.5 -3.5 -3.9 -25.9 28 133 A A H X S+ 0 0 7 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.932 114.5 43.7 -56.7 -49.1 -3.8 -4.9 -22.2 29 134 A I H X S+ 0 0 1 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.929 114.3 50.6 -65.1 -42.8 -3.1 -1.3 -21.0 30 135 A R H X S+ 0 0 136 -4,-2.5 4,-2.2 -5,-0.3 -2,-0.2 0.938 111.6 47.1 -58.5 -51.1 -5.4 0.1 -23.7 31 136 A K H X S+ 0 0 46 -4,-3.0 4,-1.5 1,-0.2 -1,-0.2 0.847 109.7 54.4 -59.0 -38.4 -8.3 -2.3 -22.7 32 137 A A H X S+ 0 0 0 -4,-2.1 4,-0.9 -5,-0.2 -1,-0.2 0.902 108.4 48.1 -67.3 -40.4 -7.8 -1.4 -19.0 33 138 A F H >X S+ 0 0 2 -4,-2.4 4,-2.3 1,-0.2 3,-0.8 0.922 107.1 58.0 -61.2 -42.1 -8.1 2.3 -19.7 34 139 A Q H 3X S+ 0 0 71 -4,-2.2 4,-2.0 1,-0.3 -2,-0.2 0.833 95.1 64.2 -58.2 -36.6 -11.3 1.6 -21.8 35 140 A V H 3< S+ 0 0 18 -4,-1.5 -1,-0.3 1,-0.2 4,-0.2 0.895 111.4 37.2 -50.5 -43.5 -12.9 -0.1 -18.7 36 141 A W H X< S+ 0 0 0 -4,-0.9 3,-1.4 -3,-0.8 4,-0.3 0.865 112.2 54.6 -82.6 -39.0 -12.8 3.3 -17.0 37 142 A S H >< S+ 0 0 34 -4,-2.3 3,-0.8 1,-0.3 -2,-0.2 0.806 99.4 67.9 -63.9 -24.2 -13.6 5.5 -20.0 38 143 A N T 3< S+ 0 0 127 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.714 111.1 30.2 -61.5 -25.9 -16.7 3.3 -20.4 39 144 A V T < S+ 0 0 31 -3,-1.4 -1,-0.2 -4,-0.2 -2,-0.2 0.175 120.6 47.4-127.1 14.7 -18.2 4.7 -17.2 40 145 A T S < S- 0 0 19 -3,-0.8 114,-0.1 -4,-0.3 118,-0.0 -0.898 84.5-107.6-143.7 172.8 -16.8 8.2 -17.1 41 146 A P S S+ 0 0 57 0, 0.0 -4,-0.1 0, 0.0 2,-0.1 0.390 78.4 122.7 -82.9 4.5 -16.4 11.3 -19.3 42 147 A L - 0 0 2 -6,-0.2 2,-0.4 -34,-0.1 -2,-0.2 -0.354 46.4-160.4 -71.1 144.2 -12.6 10.6 -19.5 43 148 A K E -a 8 0A 133 -36,-2.9 -34,-3.2 -2,-0.1 2,-0.4 -0.996 8.7-156.3-121.4 134.3 -10.8 10.1 -22.8 44 149 A F E -a 9 0A 31 -2,-0.4 2,-0.4 -36,-0.2 -34,-0.2 -0.927 10.7-177.6-117.1 133.8 -7.4 8.4 -22.7 45 150 A S E -a 10 0A 65 -36,-1.9 -34,-2.7 -2,-0.4 2,-0.5 -0.996 22.9-132.1-132.0 135.7 -4.6 8.7 -25.4 46 151 A K E -a 11 0A 74 -2,-0.4 2,-0.3 -36,-0.2 -34,-0.2 -0.713 24.1-166.1 -85.6 127.2 -1.3 7.0 -25.5 47 152 A I - 0 0 45 -36,-3.0 -34,-0.4 -2,-0.5 3,-0.1 -0.857 15.1-152.8-114.0 152.9 1.6 9.3 -26.3 48 153 A N S S+ 0 0 120 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.564 73.6 22.9-102.5 -9.1 5.0 8.2 -27.3 49 154 A T S S+ 0 0 110 2,-0.1 -1,-0.2 -37,-0.0 2,-0.0 -0.981 95.5 24.7-156.6 154.9 7.2 11.0 -26.0 50 155 A G S S- 0 0 42 -2,-0.3 2,-0.4 -3,-0.1 -3,-0.1 -0.207 97.9 -22.8 80.9-170.9 7.2 13.8 -23.5 51 156 A M - 0 0 180 4,-0.0 2,-0.3 2,-0.0 -2,-0.1 -0.596 59.8-169.4 -83.5 123.2 5.3 14.1 -20.2 52 157 A A - 0 0 14 -2,-0.4 3,-0.2 1,-0.1 -41,-0.2 -0.717 30.8-126.0-101.8 160.9 2.1 12.0 -19.8 53 158 A D S S+ 0 0 26 -43,-0.5 2,-0.6 -2,-0.3 -42,-0.2 0.933 104.7 33.1 -63.5 -46.9 -0.5 12.3 -17.0 54 159 A I E S-b 11 0A 0 -44,-2.2 -42,-2.1 35,-0.1 2,-0.5 -0.939 73.4-164.6-120.0 111.9 -0.1 8.6 -16.3 55 160 A L E -b 12 0A 41 -2,-0.6 35,-2.3 -44,-0.2 2,-0.5 -0.875 10.1-150.6 -96.1 126.3 3.3 6.9 -16.8 56 161 A V E -bc 13 90A 1 -44,-3.1 -42,-2.7 -2,-0.5 -41,-0.7 -0.865 22.9-179.3 -97.3 120.7 3.2 3.1 -16.9 57 162 A V E - c 0 91A 20 33,-2.5 35,-3.2 -2,-0.5 2,-0.5 -0.947 24.5-155.8-126.9 136.8 6.5 1.5 -15.6 58 163 A F E + c 0 92A 7 -2,-0.4 2,-0.3 33,-0.2 35,-0.2 -0.976 36.7 145.1-106.0 131.1 7.8 -2.0 -15.1 59 164 A A E - c 0 93A 18 33,-2.3 35,-2.7 -2,-0.5 36,-0.4 -0.983 35.2-136.0-158.3 159.5 10.5 -2.2 -12.4 60 165 A R - 0 0 135 -2,-0.3 33,-0.0 33,-0.2 10,-0.0 -0.899 61.4 -22.6-123.2 155.2 11.8 -4.5 -9.7 61 166 A G S S+ 0 0 24 -2,-0.3 8,-2.4 7,-0.1 2,-0.4 -0.162 122.7 10.0 51.7-135.3 12.9 -3.9 -6.1 62 167 A A + 0 0 91 6,-0.3 -2,-0.2 1,-0.1 6,-0.1 -0.610 68.4 166.4 -74.5 128.9 13.9 -0.3 -5.3 63 168 A H - 0 0 45 -2,-0.4 -1,-0.1 -4,-0.1 -2,-0.1 0.060 60.3 -81.1-143.4 28.2 13.0 1.9 -8.3 64 169 A G S S+ 0 0 84 1,-0.0 -2,-0.1 0, 0.0 4,-0.0 0.532 106.7 81.3 97.2 11.9 13.2 5.5 -7.2 65 170 A D S S- 0 0 31 21,-0.0 -3,-0.0 0, 0.0 21,-0.0 0.476 94.2-109.5-129.2 -0.2 10.0 6.2 -5.3 66 171 A D S S+ 0 0 167 1,-0.1 2,-0.2 0, 0.0 -4,-0.0 0.544 97.1 98.2 74.9 10.9 10.2 4.9 -1.7 67 172 A H - 0 0 100 -6,-0.1 -1,-0.1 11,-0.0 11,-0.0 -0.540 63.1-168.8-120.1 66.1 7.7 2.2 -2.5 68 173 A A - 0 0 61 -2,-0.2 -6,-0.3 1,-0.1 2,-0.1 -0.186 17.4-122.9 -58.0 142.5 10.2 -0.7 -3.1 69 174 A F - 0 0 13 -8,-2.4 3,-0.1 1,-0.1 -1,-0.1 -0.445 10.8-139.7 -85.1 166.6 8.9 -4.0 -4.7 70 175 A D - 0 0 81 1,-0.5 -1,-0.1 5,-0.4 -10,-0.0 -0.010 39.6-103.2-123.1 22.9 9.3 -7.3 -2.9 71 176 A G S S- 0 0 21 4,-0.1 -1,-0.5 3,-0.0 24,-0.1 -0.283 79.0 -6.7 77.9-172.7 10.3 -9.9 -5.6 72 177 A K S S+ 0 0 153 23,-0.1 24,-0.2 -3,-0.1 3,-0.1 -0.303 119.5 6.4 -59.0 134.9 7.9 -12.5 -7.0 73 178 A G S S+ 0 0 30 1,-0.2 -3,-0.3 2,-0.1 2,-0.2 -0.268 99.0 62.2 87.1-173.6 4.5 -12.6 -5.2 74 179 A G S S+ 0 0 66 -2,-0.1 2,-0.4 -5,-0.1 -1,-0.2 -0.379 105.4 29.5 60.2-125.0 3.1 -10.2 -2.6 75 180 A I + 0 0 84 1,-0.2 -5,-0.4 -2,-0.2 3,-0.1 -0.548 64.9 175.3 -69.9 120.5 2.9 -6.6 -3.9 76 181 A L - 0 0 30 -2,-0.4 17,-2.8 1,-0.4 2,-0.3 0.731 61.8 -16.7 -95.4 -29.2 2.3 -6.9 -7.7 77 182 A A E -D 92 0A 12 15,-0.2 -1,-0.4 -19,-0.0 2,-0.3 -0.972 54.4-161.6-168.0 159.7 1.8 -3.3 -8.6 78 183 A H E -D 91 0A 27 13,-2.3 13,-3.4 -2,-0.3 2,-0.3 -0.975 7.4-165.6-150.3 160.8 1.2 0.1 -7.1 79 184 A A E -D 90 0A 21 -2,-0.3 2,-0.4 11,-0.2 11,-0.2 -0.976 17.8-121.8-147.6 159.3 -0.0 3.5 -8.4 80 185 A F - 0 0 31 9,-2.4 8,-0.8 -2,-0.3 3,-0.1 -0.855 30.1-115.5-106.7 137.9 -0.3 7.2 -7.4 81 186 A G - 0 0 33 -2,-0.4 7,-1.1 6,-0.2 8,-0.2 -0.129 56.8 -61.1 -61.2 164.1 -3.5 9.2 -7.2 82 187 A P S S+ 0 0 10 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.104 84.9 99.5 -52.0 141.4 -4.0 12.1 -9.5 83 188 A G - 0 0 35 4,-0.2 -3,-0.1 -30,-0.1 -79,-0.0 -0.919 69.6 -58.9 162.5 176.7 -1.5 15.0 -9.3 84 189 A S S > S+ 0 0 120 -2,-0.3 3,-2.1 2,-0.1 2,-0.2 -0.224 100.3 8.1 -74.4 168.0 1.5 16.5 -10.9 85 190 A G T 3 S+ 0 0 61 1,-0.3 -2,-0.1 3,-0.1 4,-0.0 -0.419 141.4 0.4 67.6-125.5 4.9 14.8 -11.3 86 191 A I T > S+ 0 0 93 -2,-0.2 3,-2.4 2,-0.1 -6,-0.3 0.532 100.8 123.1 -74.5 -9.3 4.5 11.1 -10.4 87 192 A G T < S+ 0 0 6 -3,-2.1 -4,-0.2 1,-0.3 -6,-0.2 -0.303 77.7 19.5 -51.1 136.3 0.9 11.6 -9.6 88 193 A G T 3 S+ 0 0 0 -7,-1.1 -1,-0.3 -8,-0.8 30,-0.1 0.159 91.7 139.5 88.4 -18.5 -1.2 9.1 -11.7 89 194 A D < - 0 0 12 -3,-2.4 -9,-2.4 -8,-0.2 2,-0.5 -0.315 39.2-153.8 -73.1 144.8 1.8 6.9 -12.4 90 195 A A E -cD 56 79A 1 -35,-2.3 -33,-2.5 -11,-0.2 2,-0.4 -0.978 7.9-164.9-121.3 123.4 1.3 3.1 -12.3 91 196 A H E -cD 57 78A 14 -13,-3.4 -13,-2.3 -2,-0.5 2,-0.4 -0.909 2.2-159.9-115.3 133.3 4.2 0.8 -11.5 92 197 A F E -cD 58 77A 1 -35,-3.2 -33,-2.3 -2,-0.4 2,-0.5 -0.945 25.7-116.3-118.8 130.3 4.2 -3.0 -12.1 93 198 A D E > -c 59 0A 0 -17,-2.8 3,-2.0 -2,-0.4 -33,-0.2 -0.507 16.7-157.2 -68.5 112.3 6.6 -5.4 -10.3 94 199 A E T 3 S+ 0 0 15 -35,-2.7 -34,-0.2 -2,-0.5 -1,-0.2 0.699 87.7 74.7 -63.7 -18.0 8.9 -6.9 -13.0 95 200 A D T 3 S+ 0 0 49 -36,-0.4 -1,-0.3 -24,-0.1 2,-0.1 0.609 85.2 78.2 -73.5 -7.7 9.5 -9.8 -10.5 96 201 A E S < S- 0 0 8 -3,-2.0 2,-0.7 -20,-0.2 -77,-0.1 -0.472 89.9-118.3 -83.8 168.8 6.0 -11.0 -11.4 97 202 A F - 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