==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 27-JAN-10 3LK8 . COMPND 2 MOLECULE: MACROPHAGE METALLOELASTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR CALDERONE V. . 158 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8425.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 86 54.4 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 . 12 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 8.9 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 0 107 0, 0.0 120,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-144.9 8.9 13.0 2.3 2 107 A P + 0 0 78 0, 0.0 2,-0.3 0, 0.0 81,-0.1 -0.183 360.0 177.2 -70.9 145.1 7.3 14.2 5.6 3 108 A V - 0 0 47 78,-0.1 2,-0.3 79,-0.0 117,-0.1 -0.949 40.1 -95.6-135.9 159.5 9.0 13.7 9.0 4 109 A W - 0 0 24 115,-0.4 5,-0.0 -2,-0.3 115,-0.0 -0.620 29.0-156.4 -71.5 135.3 8.0 14.8 12.5 5 110 A R + 0 0 230 -2,-0.3 2,-0.3 2,-0.0 -1,-0.1 -0.128 69.9 64.3-107.1 34.7 9.7 18.1 13.3 6 111 A K S S- 0 0 98 1,-0.1 -2,-0.1 0, 0.0 3,-0.0 -0.959 72.7-136.1-151.4 158.9 9.6 17.7 17.1 7 112 A H S S+ 0 0 112 -2,-0.3 36,-2.6 1,-0.1 2,-0.7 0.726 85.2 71.0 -96.4 -27.3 11.1 15.2 19.5 8 113 A Y E -a 43 0A 182 34,-0.2 2,-0.4 36,-0.1 36,-0.2 -0.854 64.5-179.2 -97.9 114.5 8.2 14.4 21.8 9 114 A I E -a 44 0A 2 34,-3.0 36,-2.1 -2,-0.7 2,-0.3 -0.886 11.7-151.2-115.4 139.2 5.6 12.3 20.0 10 115 A T E -a 45 0A 38 -2,-0.4 44,-2.4 34,-0.2 43,-0.6 -0.809 9.7-172.0-108.2 150.0 2.3 11.0 21.4 11 116 A Y E -ab 46 54A 6 34,-2.6 36,-2.9 -2,-0.3 2,-0.4 -0.961 3.6-163.7-134.3 158.3 0.3 7.9 20.6 12 117 A R E - b 0 55A 57 42,-2.2 44,-3.2 -2,-0.3 2,-0.8 -0.998 20.0-133.6-141.1 138.2 -3.1 6.8 21.6 13 118 A I E - b 0 56A 13 34,-0.4 44,-0.2 -2,-0.4 3,-0.1 -0.851 18.5-167.6 -94.6 111.5 -4.7 3.4 21.4 14 119 A N - 0 0 70 42,-2.9 2,-0.3 -2,-0.8 43,-0.2 0.849 66.3 -15.4 -67.8 -39.1 -8.1 4.0 19.9 15 120 A N - 0 0 52 41,-0.6 2,-0.4 -3,-0.1 -1,-0.2 -0.965 68.8-112.3-163.4 164.6 -9.5 0.5 20.7 16 121 A Y - 0 0 61 -2,-0.3 6,-0.1 -3,-0.1 41,-0.0 -0.901 23.5-119.9-117.4 132.3 -8.3 -2.9 21.6 17 122 A T > - 0 0 0 -2,-0.4 3,-1.0 1,-0.1 8,-0.1 -0.424 15.3-139.5 -61.1 137.3 -8.4 -6.1 19.6 18 123 A P T 3 S+ 0 0 101 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.535 93.7 80.6 -73.3 -5.0 -10.4 -8.9 21.3 19 124 A D T 3 S+ 0 0 36 77,-0.1 2,-0.3 2,-0.1 -2,-0.0 0.651 96.2 36.4 -71.0 -22.2 -7.6 -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 -0.862 90.4 -90.6-132.0 160.0 -5.2 -10.3 23.1 21 126 A N > - 0 0 101 -2,-0.3 4,-1.8 1,-0.1 3,-0.4 -0.495 42.1-121.9 -63.3 141.7 -5.1 -9.4 26.7 22 127 A R H > S+ 0 0 143 1,-0.2 4,-2.3 2,-0.2 3,-0.2 0.905 112.1 51.1 -55.0 -47.3 -5.3 -5.6 27.1 23 128 A E H > S+ 0 0 143 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.812 107.5 54.4 -63.5 -30.0 -2.0 -5.3 28.9 24 129 A D H > S+ 0 0 44 -3,-0.4 4,-2.5 2,-0.2 -1,-0.2 0.831 106.8 50.9 -72.8 -35.5 -0.3 -7.4 26.2 25 130 A V H X S+ 0 0 0 -4,-1.8 4,-2.3 -3,-0.2 5,-0.3 0.953 111.5 48.4 -63.1 -50.5 -1.6 -4.9 23.5 26 131 A D H X S+ 0 0 49 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.920 114.2 46.0 -52.3 -47.2 -0.2 -2.1 25.6 27 132 A Y H X S+ 0 0 132 -4,-2.2 4,-3.0 2,-0.2 5,-0.2 0.913 110.0 51.7 -70.5 -43.8 3.2 -3.8 25.9 28 133 A A H X S+ 0 0 10 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.939 114.5 43.7 -54.3 -51.4 3.5 -4.9 22.3 29 134 A I H X S+ 0 0 1 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.908 113.9 50.8 -63.2 -42.7 2.9 -1.3 21.1 30 135 A R H X S+ 0 0 137 -4,-2.4 4,-2.1 -5,-0.3 -2,-0.2 0.936 111.9 47.1 -58.8 -49.7 5.2 0.2 23.8 31 136 A K H X S+ 0 0 84 -4,-3.0 4,-1.6 2,-0.2 -1,-0.2 0.849 109.5 54.5 -61.2 -36.9 8.0 -2.2 22.8 32 137 A A H X S+ 0 0 0 -4,-2.1 4,-0.9 -5,-0.2 -1,-0.2 0.906 108.5 47.8 -67.9 -42.7 7.5 -1.4 19.1 33 138 A F H >X S+ 0 0 3 -4,-2.3 4,-2.5 1,-0.2 3,-0.7 0.915 107.4 58.0 -58.8 -42.6 7.9 2.4 19.7 34 139 A Q H 3X S+ 0 0 52 -4,-2.1 4,-2.0 1,-0.3 -2,-0.2 0.849 95.0 64.3 -58.3 -37.4 11.0 1.6 21.8 35 140 A V H 3< S+ 0 0 17 -4,-1.6 4,-0.3 1,-0.2 -1,-0.3 0.917 111.9 36.5 -49.3 -44.6 12.6 -0.1 18.8 36 141 A W H X< S+ 0 0 0 -4,-0.9 3,-1.2 -3,-0.7 4,-0.3 0.866 112.7 54.5 -82.4 -38.6 12.6 3.3 17.0 37 142 A S H >< S+ 0 0 34 -4,-2.5 3,-0.6 1,-0.2 -1,-0.2 0.771 99.3 67.2 -66.1 -20.9 13.3 5.6 20.0 38 143 A N T 3< S+ 0 0 129 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.760 111.5 31.7 -63.8 -28.6 16.4 3.4 20.6 39 144 A V T < S+ 0 0 30 -3,-1.2 -1,-0.2 -4,-0.3 -2,-0.2 0.189 120.7 44.5-123.9 12.5 17.9 4.7 17.3 40 145 A T S < S- 0 0 19 -3,-0.6 114,-0.1 -4,-0.3 118,-0.0 -0.885 86.2-105.3-142.3 173.9 16.6 8.2 17.0 41 146 A P S S+ 0 0 58 0, 0.0 -4,-0.1 0, 0.0 2,-0.1 0.387 79.0 122.9 -82.7 6.6 16.1 11.3 19.3 42 147 A L - 0 0 2 -6,-0.2 2,-0.4 -34,-0.1 -2,-0.2 -0.342 45.5-161.4 -72.3 147.7 12.4 10.6 19.5 43 148 A K E -a 8 0A 133 -36,-2.6 -34,-3.0 -2,-0.1 2,-0.4 -0.997 9.0-154.5-125.8 133.5 10.5 10.0 22.7 44 149 A F E -a 9 0A 30 -2,-0.4 2,-0.4 -36,-0.2 -34,-0.2 -0.921 10.0-174.2-115.8 135.1 7.0 8.4 22.7 45 150 A S E -a 10 0A 63 -36,-2.1 -34,-2.6 -2,-0.4 2,-0.5 -0.993 21.2-133.7-128.9 132.3 4.3 8.8 25.2 46 151 A K E -a 11 0A 71 -2,-0.4 2,-0.3 -36,-0.2 -34,-0.2 -0.718 24.8-168.3 -79.9 123.5 0.9 7.0 25.5 47 152 A I - 0 0 43 -36,-2.9 -34,-0.4 -2,-0.5 3,-0.1 -0.858 15.8-155.4-111.3 153.4 -2.0 9.4 26.1 48 153 A N S S+ 0 0 120 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.591 74.2 26.7-103.7 -12.5 -5.5 8.2 27.1 49 154 A T S S+ 0 0 122 2,-0.1 -1,-0.1 -37,-0.0 2,-0.0 -0.967 96.1 25.2-147.6 153.1 -7.6 11.1 25.9 50 155 A G S S- 0 0 47 -2,-0.3 2,-0.7 -3,-0.1 -3,-0.1 -0.236 96.9 -26.9 89.3-173.4 -7.4 13.8 23.2 51 156 A M - 0 0 183 -2,-0.0 2,-0.2 4,-0.0 -2,-0.1 -0.692 59.4-168.5 -85.6 113.4 -5.6 14.2 19.9 52 157 A A - 0 0 14 -2,-0.7 3,-0.2 1,-0.1 -41,-0.2 -0.577 29.5-127.4 -88.6 163.7 -2.4 12.0 19.6 53 158 A D S S+ 0 0 26 -43,-0.6 2,-0.6 1,-0.3 -42,-0.2 0.922 104.2 36.4 -67.3 -47.9 0.2 12.3 16.9 54 159 A I E S-b 11 0A 0 -44,-2.4 -42,-2.2 35,-0.1 2,-0.6 -0.916 74.2-164.7-116.3 107.8 -0.1 8.6 16.2 55 160 A L E -b 12 0A 34 -2,-0.6 35,-2.1 -44,-0.2 2,-0.6 -0.849 9.3-151.8 -91.5 124.2 -3.6 6.9 16.6 56 161 A V E +bc 13 90A 2 -44,-3.2 -42,-2.9 -2,-0.6 -41,-0.6 -0.840 22.8 179.8 -95.6 120.2 -3.4 3.1 16.8 57 162 A V E - c 0 91A 18 33,-2.7 35,-3.3 -2,-0.6 2,-0.5 -0.956 26.0-156.3-128.1 137.7 -6.6 1.5 15.5 58 163 A F E + c 0 92A 7 -2,-0.4 2,-0.3 33,-0.2 35,-0.2 -0.975 36.7 146.9-107.0 129.5 -8.0 -2.0 15.0 59 164 A A E - c 0 93A 19 33,-2.3 35,-2.8 -2,-0.5 36,-0.4 -0.969 34.3-137.5-153.6 160.6 -10.6 -2.1 12.3 60 165 A R - 0 0 137 -2,-0.3 33,-0.0 33,-0.2 -2,-0.0 -0.932 60.5 -24.2-126.7 155.4 -11.9 -4.5 9.6 61 166 A G S S+ 0 0 21 -2,-0.3 8,-2.1 7,-0.1 2,-0.3 -0.119 122.8 11.8 49.4-138.0 -13.0 -4.0 6.0 62 167 A A + 0 0 91 6,-0.2 -2,-0.2 1,-0.1 4,-0.1 -0.552 68.9 163.4 -71.5 126.0 -14.1 -0.5 5.1 63 168 A H - 0 0 44 -2,-0.3 -1,-0.1 2,-0.2 3,-0.1 0.067 63.5 -77.6-142.4 28.6 -13.1 1.8 8.0 64 169 A G S S+ 0 0 83 1,-0.4 2,-0.2 2,-0.0 -2,-0.1 0.528 103.0 78.6 96.0 8.2 -13.2 5.4 6.8 65 170 A D S S- 0 0 27 21,-0.0 -1,-0.4 0, 0.0 -2,-0.2 -0.571 91.8 -97.0-122.8-164.7 -10.0 5.8 4.8 66 171 A D S S+ 0 0 152 -2,-0.2 2,-0.1 1,-0.2 -4,-0.0 0.208 104.8 81.1-101.1 17.6 -9.1 4.7 1.2 67 172 A H - 0 0 92 -6,-0.1 -1,-0.2 11,-0.0 -6,-0.0 -0.431 65.9-172.1-125.2 57.1 -7.4 1.6 2.4 68 173 A A - 0 0 62 -3,-0.2 -6,-0.2 -2,-0.1 2,-0.1 -0.127 24.4-119.2 -48.0 138.0 -10.2 -0.9 3.0 69 174 A F - 0 0 13 -8,-2.1 3,-0.1 1,-0.1 -1,-0.1 -0.427 13.0-141.2 -82.0 165.9 -9.0 -4.1 4.7 70 175 A D - 0 0 82 1,-0.5 -1,-0.1 5,-0.4 2,-0.1 0.020 39.5-100.4-123.4 22.2 -9.5 -7.5 2.9 71 176 A G S S- 0 0 20 4,-0.1 -1,-0.5 3,-0.0 24,-0.1 -0.291 79.4 -11.3 80.5-173.3 -10.5 -10.1 5.5 72 177 A K S S+ 0 0 163 -3,-0.1 24,-0.2 23,-0.1 3,-0.1 -0.334 121.2 8.5 -60.7 137.7 -8.1 -12.6 7.1 73 178 A G S S+ 0 0 27 1,-0.2 -3,-0.3 2,-0.1 2,-0.1 -0.312 98.1 65.1 86.8-171.3 -4.7 -12.7 5.3 74 179 A G S S+ 0 0 67 -2,-0.1 2,-0.3 -5,-0.1 -1,-0.2 -0.378 104.2 28.7 61.6-125.7 -3.5 -10.4 2.6 75 180 A I + 0 0 87 1,-0.2 -5,-0.4 -2,-0.1 3,-0.1 -0.526 63.2 179.3 -69.9 123.2 -3.1 -6.9 4.1 76 181 A L - 0 0 35 1,-0.4 17,-2.5 -2,-0.3 2,-0.3 0.780 62.5 -24.1 -92.1 -35.1 -2.3 -7.1 7.8 77 182 A A E -D 92 0A 12 15,-0.2 -1,-0.4 -19,-0.0 2,-0.3 -0.962 53.5-159.7-167.0 161.8 -2.0 -3.4 8.6 78 183 A H E -D 91 0A 24 13,-2.1 13,-3.2 -2,-0.3 2,-0.3 -0.962 7.5-164.8-150.0 164.5 -1.2 0.0 7.1 79 184 A A E -D 90 0A 22 -2,-0.3 2,-0.4 11,-0.3 11,-0.2 -0.964 18.0-121.3-149.7 158.2 -0.1 3.4 8.4 80 185 A F - 0 0 38 9,-2.2 8,-0.8 6,-0.3 3,-0.1 -0.856 30.8-114.4-107.6 140.3 0.2 7.0 7.2 81 186 A G - 0 0 32 -2,-0.4 7,-1.2 6,-0.2 8,-0.2 -0.147 57.5 -58.7 -65.4 167.0 3.4 9.0 7.1 82 187 A P S S+ 0 0 10 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.084 86.1 101.0 -49.4 140.5 3.9 12.1 9.4 83 188 A G S S- 0 0 35 4,-0.2 -3,-0.1 -3,-0.1 -79,-0.0 -0.908 70.0 -60.0 162.4 174.3 1.4 14.8 9.1 84 189 A S S > S+ 0 0 114 -2,-0.3 3,-2.2 2,-0.1 2,-0.2 -0.236 99.8 1.3 -71.6 165.7 -1.7 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 -0.374 141.8 7.1 65.6-121.4 -5.0 14.5 11.1 86 191 A I T > S+ 0 0 77 -2,-0.2 3,-2.4 2,-0.1 -6,-0.3 0.637 102.8 119.6 -69.1 -18.4 -4.7 10.9 9.9 87 192 A G T < S+ 0 0 7 -3,-2.2 -4,-0.2 1,-0.3 -32,-0.2 -0.246 79.2 14.8 -50.3 135.1 -1.0 11.5 9.4 88 193 A G T 3 S+ 0 0 0 -7,-1.2 -1,-0.3 -8,-0.8 30,-0.1 0.159 93.3 137.0 86.4 -17.1 1.0 9.1 11.6 89 194 A D < - 0 0 17 -3,-2.4 -9,-2.2 -8,-0.2 2,-0.5 -0.335 39.8-154.0 -75.6 146.8 -1.9 6.8 12.3 90 195 A A E -cD 56 79A 1 -35,-2.1 -33,-2.7 -11,-0.2 2,-0.4 -0.979 6.8-163.5-123.8 125.8 -1.5 3.0 12.2 91 196 A H E -cD 57 78A 15 -13,-3.2 -13,-2.1 -2,-0.5 2,-0.5 -0.913 2.0-159.4-115.6 134.1 -4.4 0.7 11.5 92 197 A F E -cD 58 77A 1 -35,-3.3 -33,-2.3 -2,-0.4 2,-0.5 -0.942 25.7-117.0-117.2 129.7 -4.4 -3.1 12.1 93 198 A D E > -c 59 0A 0 -17,-2.5 3,-1.9 -2,-0.5 -33,-0.2 -0.497 16.3-156.6 -65.8 112.0 -6.8 -5.4 10.4 94 199 A E T 3 S+ 0 0 14 -35,-2.8 -34,-0.2 -2,-0.5 -1,-0.2 0.709 88.1 74.6 -63.9 -18.4 -9.1 -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 0.609 85.8 78.5 -71.6 -8.5 -9.7 -9.9 10.6 96 201 A E S < S- 0 0 7 -3,-1.9 2,-0.7 -20,-0.2 -77,-0.1 -0.528 90.0-119.3 -84.1 165.9 -6.2 -11.1 11.5 97 202 A F - 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