==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METALLOPROTEINASE 29-APR-97 1KBC . COMPND 2 MOLECULE: NEUTROPHIL COLLAGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.BETZ,F.X.GOMIS-RUETH,W.BODE . 332 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15569.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 176 53.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 32 9.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 13 3.9 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 . 17 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 67 20.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 2 2 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 2 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 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 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 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 79 A F 0 0 97 0, 0.0 2,-0.4 0, 0.0 128,-0.1 0.000 360.0 360.0 360.0 161.4 44.4 40.0 57.5 2 80 A M E -A 128 0A 119 126,-0.5 126,-3.1 135,-0.0 2,-0.2 -1.000 360.0-139.4-139.6 135.7 42.0 41.3 54.9 3 81 A L E -A 127 0A 53 -2,-0.4 124,-0.2 124,-0.2 3,-0.1 -0.640 37.8 -94.2 -91.2 151.5 39.0 43.6 55.4 4 82 A T > - 0 0 18 122,-2.5 3,-2.2 -2,-0.2 -1,-0.1 -0.424 55.7 -92.9 -64.0 133.6 35.7 42.9 53.5 5 83 A P T 3 S+ 0 0 113 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 -0.219 116.1 27.2 -51.5 134.7 35.7 45.0 50.3 6 84 A G T 3 S- 0 0 75 1,-0.2 -2,-0.1 -3,-0.1 0, 0.0 0.387 111.8-108.9 91.7 -3.5 34.0 48.3 50.8 7 85 A N < - 0 0 104 -3,-2.2 -1,-0.2 1,-0.1 120,-0.1 0.881 45.9-168.3 44.8 55.5 34.9 48.1 54.5 8 86 A P + 0 0 23 0, 0.0 2,-0.3 0, 0.0 -4,-0.2 -0.376 13.7 166.6 -69.1 150.2 31.4 47.4 55.9 9 87 A K - 0 0 82 79,-0.1 2,-0.2 78,-0.1 117,-0.1 -0.983 39.7 -99.8-162.6 154.4 31.1 47.8 59.7 10 88 A W - 0 0 11 115,-0.3 5,-0.0 -2,-0.3 115,-0.0 -0.578 21.3-154.4 -77.0 140.1 28.6 48.0 62.5 11 89 A E S S+ 0 0 168 -2,-0.2 2,-0.3 2,-0.0 -1,-0.1 0.660 79.4 60.9 -88.4 -16.7 28.0 51.6 63.7 12 90 A R - 0 0 116 1,-0.1 -2,-0.1 2,-0.0 36,-0.0 -0.837 67.5-153.6-112.2 145.2 26.9 50.4 67.1 13 91 A T S S+ 0 0 66 -2,-0.3 36,-2.5 1,-0.1 2,-0.7 0.529 79.8 73.6 -95.2 -10.3 29.1 48.4 69.6 14 92 A N E +b 49 0B 86 34,-0.2 2,-0.3 36,-0.1 36,-0.2 -0.919 68.0 175.4-106.9 108.0 26.3 46.6 71.4 15 93 A L E -b 50 0B 1 34,-2.5 36,-2.7 -2,-0.7 2,-0.3 -0.844 20.3-143.2-115.9 148.9 24.9 44.0 69.2 16 94 A T E -b 51 0B 34 -2,-0.3 44,-2.3 34,-0.2 2,-0.3 -0.736 12.8-168.6-105.6 160.0 22.3 41.3 69.7 17 95 A Y E -bc 52 60B 11 34,-1.9 36,-2.3 -2,-0.3 2,-0.4 -0.976 3.1-161.5-143.2 154.0 22.1 37.7 68.3 18 96 A R E - c 0 61B 29 42,-2.1 44,-2.4 -2,-0.3 2,-0.8 -0.999 17.2-139.4-141.9 135.8 19.5 35.0 68.2 19 97 A I E - c 0 62B 14 -2,-0.4 44,-0.2 34,-0.4 42,-0.1 -0.850 19.9-174.1 -95.2 104.1 19.7 31.3 67.6 20 98 A R - 0 0 109 42,-2.5 2,-0.3 -2,-0.8 43,-0.2 0.752 63.9 -7.5 -72.8 -28.6 16.7 30.5 65.4 21 99 A N - 0 0 61 41,-0.6 2,-0.3 2,-0.0 -1,-0.1 -0.939 67.6-127.9-157.4 175.0 17.0 26.7 65.3 22 100 A Y - 0 0 64 -2,-0.3 6,-0.1 42,-0.1 42,-0.1 -0.890 18.0-113.5-131.7 162.7 19.3 24.0 66.5 23 101 A T > - 0 0 5 -2,-0.3 3,-1.1 4,-0.1 8,-0.1 -0.747 21.5-136.1 -93.1 140.1 21.1 20.9 65.2 24 102 A P T 3 S+ 0 0 115 0, 0.0 -1,-0.1 0, 0.0 4,-0.0 0.685 94.1 80.6 -68.8 -12.8 20.0 17.6 66.7 25 103 A Q T 3 S+ 0 0 93 2,-0.0 2,-0.3 80,-0.0 78,-0.0 0.699 99.4 28.2 -64.2 -27.6 23.7 16.5 67.1 26 104 A L S < S- 0 0 25 -3,-1.1 2,-0.1 79,-0.1 79,-0.0 -0.863 91.0 -95.4-130.9 167.1 24.1 18.5 70.3 27 105 A S > - 0 0 53 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.449 39.0-112.1 -77.3 158.0 22.0 19.6 73.3 28 106 A E H > S+ 0 0 119 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.884 120.6 53.8 -59.1 -35.8 20.6 23.1 73.1 29 107 A A H > S+ 0 0 66 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.890 106.5 51.2 -67.1 -38.3 22.8 24.0 76.0 30 108 A E H > S+ 0 0 74 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.905 111.6 46.9 -65.7 -38.8 25.8 22.8 74.1 31 109 A V H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 5,-0.2 0.957 112.5 50.3 -67.1 -47.0 24.9 24.8 71.1 32 110 A E H X S+ 0 0 53 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.911 110.5 49.5 -58.3 -41.2 24.3 27.9 73.2 33 111 A R H X S+ 0 0 136 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.898 109.9 50.4 -65.2 -43.2 27.6 27.5 75.0 34 112 A A H X S+ 0 0 9 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.924 112.6 47.0 -61.0 -43.5 29.6 27.1 71.7 35 113 A I H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.904 111.8 50.2 -64.9 -45.6 28.0 30.3 70.2 36 114 A K H X S+ 0 0 86 -4,-2.3 4,-2.5 -5,-0.2 -2,-0.2 0.925 111.4 47.9 -59.6 -49.1 28.6 32.4 73.4 37 115 A D H X S+ 0 0 63 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.876 109.0 54.8 -60.3 -39.2 32.3 31.4 73.6 38 116 A A H X S+ 0 0 0 -4,-1.9 4,-0.9 2,-0.2 3,-0.2 0.932 110.7 44.9 -60.0 -48.4 32.7 32.2 69.9 39 117 A F H >X S+ 0 0 5 -4,-2.2 4,-1.7 1,-0.2 3,-0.9 0.932 108.3 58.1 -62.3 -43.6 31.4 35.7 70.4 40 118 A E H 3X S+ 0 0 95 -4,-2.5 4,-2.4 1,-0.3 -1,-0.2 0.819 95.5 63.7 -57.7 -34.0 33.5 36.2 73.5 41 119 A L H 3X S+ 0 0 13 -4,-1.6 4,-0.7 -3,-0.2 110,-0.3 0.908 108.1 42.2 -53.5 -44.5 36.7 35.5 71.6 42 120 A W H << S+ 0 0 0 -4,-0.9 4,-0.4 -3,-0.9 3,-0.3 0.830 109.0 59.6 -73.2 -34.3 35.9 38.7 69.6 43 121 A S H >< S+ 0 0 35 -4,-1.7 3,-1.0 1,-0.2 -2,-0.2 0.893 99.6 55.9 -63.5 -40.1 34.9 40.6 72.6 44 122 A V H 3< S+ 0 0 120 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.841 114.0 40.9 -65.1 -23.4 38.3 40.2 74.3 45 123 A A T 3< S+ 0 0 10 -4,-0.7 -1,-0.2 -3,-0.3 -2,-0.2 0.349 120.9 30.2-106.4 10.4 40.0 41.8 71.2 46 124 A S S < S- 0 0 16 -3,-1.0 114,-0.1 -4,-0.4 118,-0.1 -0.932 84.1-101.9-154.3 172.7 37.5 44.6 70.4 47 125 A P S S+ 0 0 70 0, 0.0 2,-0.2 0, 0.0 -4,-0.1 0.426 80.1 120.4 -85.4 8.5 35.1 47.0 72.1 48 126 A L - 0 0 1 -6,-0.3 2,-0.4 -34,-0.1 -2,-0.2 -0.444 43.0-167.4 -75.7 142.9 32.1 44.9 70.9 49 127 A I E -b 14 0B 90 -36,-2.5 -34,-2.5 -2,-0.2 2,-0.4 -0.995 6.7-155.5-130.1 131.1 29.6 43.3 73.3 50 128 A F E -b 15 0B 26 -2,-0.4 2,-0.4 -36,-0.2 -34,-0.2 -0.912 6.4-167.6-114.0 135.2 27.1 40.7 72.2 51 129 A T E -b 16 0B 37 -36,-2.7 -34,-1.9 -2,-0.4 2,-0.2 -0.962 18.2-130.7-126.1 131.9 23.8 39.9 73.8 52 130 A R E -b 17 0B 83 -2,-0.4 2,-0.4 -36,-0.2 -34,-0.2 -0.537 23.3-167.4 -77.7 132.8 21.5 36.9 73.3 53 131 A I - 0 0 15 -36,-2.3 -34,-0.4 -2,-0.2 3,-0.1 -0.938 16.4-158.5-121.8 146.0 17.8 37.6 72.7 54 132 A S S S+ 0 0 58 -2,-0.4 2,-0.3 1,-0.3 -1,-0.1 0.539 76.9 15.4-101.4 -6.8 14.9 35.1 72.7 55 133 A Q S S+ 0 0 127 2,-0.0 164,-0.3 -37,-0.0 -1,-0.3 -0.959 98.4 40.3-162.9 146.5 12.3 37.0 70.7 56 134 A G S S- 0 0 40 -2,-0.3 2,-0.7 -3,-0.1 -3,-0.1 -0.571 96.8 -36.4 107.0-174.7 12.3 40.0 68.3 57 135 A E - 0 0 129 -2,-0.2 2,-0.2 4,-0.0 -41,-0.1 -0.790 57.0-165.8 -93.6 116.9 14.8 41.1 65.7 58 136 A A - 0 0 4 -2,-0.7 3,-0.2 1,-0.1 -41,-0.2 -0.605 27.1-127.6 -94.8 156.2 18.4 40.4 66.4 59 137 A D S S+ 0 0 27 -43,-0.3 2,-0.6 1,-0.2 -42,-0.2 0.943 102.1 38.0 -64.8 -48.3 21.3 42.0 64.6 60 138 A I E S-c 17 0B 0 -44,-2.3 -42,-2.1 35,-0.1 2,-0.3 -0.890 74.1-164.1-112.2 107.4 22.9 38.6 64.0 61 139 A N E -c 18 0B 11 -2,-0.6 35,-2.8 32,-0.2 2,-0.5 -0.706 6.4-157.9 -88.5 136.1 20.6 35.6 63.2 62 140 A I E +cd 19 96B 1 -44,-2.4 -42,-2.5 -2,-0.3 -41,-0.6 -0.979 22.2 162.0-116.8 125.0 22.1 32.2 63.6 63 141 A A E - d 0 97B 2 33,-2.2 35,-2.6 -2,-0.5 2,-0.5 -0.988 38.4-130.7-147.6 153.8 20.6 29.3 61.8 64 142 A F E + d 0 98B 11 -2,-0.3 2,-0.3 33,-0.2 35,-0.2 -0.940 38.8 167.4-102.3 122.5 21.1 25.7 60.5 65 143 A Y E - d 0 99B 87 33,-2.3 35,-2.9 -2,-0.5 36,-0.4 -0.902 21.9-143.5-132.7 163.2 20.1 25.3 56.8 66 144 A Q - 0 0 106 -2,-0.3 33,-0.1 33,-0.2 10,-0.0 -0.942 53.5 -37.6-130.8 150.0 20.6 22.7 54.1 67 145 A R S S+ 0 0 122 -2,-0.3 8,-2.3 7,-0.1 2,-0.8 0.003 121.3 11.4 39.9-130.0 21.1 22.8 50.3 68 146 A D + 0 0 124 6,-0.3 -2,-0.1 1,-0.1 -1,-0.1 -0.647 65.5 161.8 -81.5 112.1 19.2 25.6 48.6 69 147 A H - 0 0 39 -2,-0.8 -1,-0.1 -4,-0.1 -2,-0.1 -0.052 61.0 -97.2-120.0 28.3 17.8 27.9 51.3 70 148 A G S S+ 0 0 64 1,-0.1 -2,-0.1 2,-0.0 0, 0.0 0.519 98.4 98.7 74.1 9.8 17.0 31.0 49.2 71 149 A D S S- 0 0 19 2,-0.1 -1,-0.1 21,-0.0 -3,-0.0 0.272 94.1-108.8-109.9 9.9 20.0 33.2 49.8 72 150 A N S S+ 0 0 158 1,-0.1 -4,-0.1 0, 0.0 -2,-0.0 0.544 99.7 89.0 76.7 8.5 22.0 32.4 46.6 73 151 A S - 0 0 55 -6,-0.1 -4,-0.1 11,-0.0 -1,-0.1 -0.704 65.8-164.4-132.6 75.0 24.7 30.4 48.4 74 152 A P - 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