==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 11-NOV-11 4A7B . COMPND 2 MOLECULE: COLLAGENASE 3; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.HARGREAVES,S.GERHARDT . 335 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16902.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 179 53.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 35 10.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 15 4.5 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 . 2 0.6 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 . 24 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 65 19.4 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 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 2 3 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 PARALLEL BRIDGES PER LADDER . 2 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 . 3 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 1 104 A Y 0 0 104 0, 0.0 2,-0.3 0, 0.0 299,-0.1 0.000 360.0 360.0 360.0 161.0 55.4 -10.0 11.1 2 105 A N - 0 0 73 296,-0.5 296,-3.7 305,-0.0 2,-0.2 -0.924 360.0-152.3-146.9 119.6 52.5 -7.5 11.0 3 106 A V B -A 297 0A 57 -2,-0.3 294,-0.2 294,-0.3 3,-0.1 -0.583 45.9 -89.1 -72.6 149.1 52.7 -3.7 11.5 4 107 A F - 0 0 28 292,-1.7 -1,-0.1 -2,-0.2 172,-0.0 -0.269 55.0 -95.2 -55.2 148.3 49.4 -2.2 12.9 5 108 A P - 0 0 52 0, 0.0 -1,-0.1 0, 0.0 171,-0.1 -0.100 34.5-106.6 -60.6 168.3 46.9 -1.2 10.1 6 109 A R S S+ 0 0 43 -3,-0.1 170,-2.3 169,-0.1 2,-0.3 0.845 97.2 18.8 -66.2 -37.2 46.8 2.5 8.8 7 110 A T B S-B 175 0B 36 168,-0.2 2,-0.7 155,-0.1 170,-0.0 -0.855 93.3 -91.8-128.9 160.2 43.5 3.5 10.5 8 111 A L S S+ 0 0 43 166,-2.1 166,-0.3 -2,-0.3 2,-0.3 -0.705 71.6 136.5 -67.3 112.8 41.5 2.2 13.3 9 112 A K - 0 0 74 -2,-0.7 2,-0.3 78,-0.1 117,-0.1 -0.956 61.0 -88.8-147.6 167.7 39.0 -0.2 11.5 10 113 A W - 0 0 21 115,-0.4 5,-0.0 -2,-0.3 115,-0.0 -0.677 26.1-150.9 -78.1 137.6 37.6 -3.7 11.9 11 114 A S S S+ 0 0 121 -2,-0.3 2,-0.3 -6,-0.0 -1,-0.1 0.204 81.5 55.4 -93.5 10.6 39.9 -6.3 10.4 12 115 A K S S- 0 0 98 1,-0.1 -2,-0.1 2,-0.0 36,-0.0 -0.967 71.4-145.4-139.4 149.5 36.8 -8.6 9.7 13 116 A M S S+ 0 0 68 -2,-0.3 36,-2.4 35,-0.1 2,-0.7 0.708 80.6 80.9 -91.7 -23.3 33.6 -7.7 7.8 14 117 A N E +c 49 0C 104 34,-0.2 2,-0.3 36,-0.1 36,-0.2 -0.791 63.1 176.3 -87.7 116.4 31.2 -9.8 9.9 15 118 A L E -c 50 0C 0 34,-3.6 36,-2.1 -2,-0.7 2,-0.3 -0.879 15.8-151.5-123.6 150.8 30.3 -7.9 13.1 16 119 A T E -c 51 0C 36 -2,-0.3 44,-2.8 34,-0.2 2,-0.3 -0.865 8.2-165.6-117.7 155.5 28.0 -8.6 15.9 17 120 A Y E -cd 52 60C 13 34,-2.5 36,-3.2 -2,-0.3 2,-0.4 -0.948 5.6-157.5-137.2 157.8 26.0 -6.4 18.3 18 121 A R E -cd 53 61C 63 42,-2.0 44,-3.2 -2,-0.3 2,-1.1 -0.972 16.3-143.5-136.9 127.0 24.1 -6.8 21.6 19 122 A I E - d 0 62C 10 34,-0.6 44,-0.2 -2,-0.4 3,-0.1 -0.773 23.7-175.4 -82.2 99.6 21.4 -4.6 23.0 20 123 A V - 0 0 58 42,-3.0 2,-0.3 -2,-1.1 43,-0.2 0.842 61.2 -13.5 -71.8 -35.7 22.5 -4.9 26.6 21 124 A N - 0 0 66 41,-0.5 2,-0.4 -3,-0.1 -1,-0.2 -0.941 69.7-115.3-160.2 174.7 19.6 -2.9 28.0 22 125 A Y - 0 0 52 -2,-0.3 6,-0.1 -3,-0.1 5,-0.0 -0.918 17.7-115.8-132.8 146.7 16.7 -0.6 27.0 23 126 A T > - 0 0 5 -2,-0.4 3,-0.7 1,-0.1 8,-0.1 -0.449 22.6-130.3 -70.0 146.5 15.5 2.9 27.4 24 127 A P T 3 S+ 0 0 110 0, 0.0 -1,-0.1 0, 0.0 76,-0.0 0.769 97.4 72.9 -62.6 -22.5 12.2 3.5 29.1 25 128 A D T 3 S+ 0 0 67 75,-0.1 2,-0.3 2,-0.0 78,-0.0 0.589 100.0 27.6 -80.1 -16.6 11.0 5.8 26.2 26 129 A M S < S- 0 0 12 -3,-0.7 79,-0.1 79,-0.1 78,-0.0 -0.942 85.8 -94.4-142.3 156.3 10.3 3.2 23.5 27 130 A T > - 0 0 79 -2,-0.3 4,-2.6 1,-0.1 5,-0.2 -0.296 37.6-111.2 -69.3 158.7 9.2 -0.4 23.2 28 131 A H H > S+ 0 0 118 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.912 121.4 53.6 -48.3 -47.9 11.8 -3.2 22.8 29 132 A S H > S+ 0 0 57 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.939 107.9 47.1 -59.6 -50.8 10.5 -3.6 19.3 30 133 A E H > S+ 0 0 66 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.909 113.3 50.5 -53.9 -42.4 11.0 0.1 18.3 31 134 A V H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.962 111.9 46.9 -63.5 -47.7 14.5 0.1 19.8 32 135 A E H X S+ 0 0 55 -4,-2.9 4,-2.1 -5,-0.2 -1,-0.2 0.887 112.6 49.3 -58.8 -40.2 15.4 -3.0 17.9 33 136 A K H X S+ 0 0 150 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.891 110.8 50.9 -69.9 -40.4 14.0 -1.6 14.6 34 137 A A H X S+ 0 0 10 -4,-2.6 4,-1.9 -5,-0.2 -2,-0.2 0.913 114.5 42.1 -56.9 -49.7 15.9 1.7 15.1 35 138 A F H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.826 111.2 54.4 -72.6 -36.0 19.2 -0.0 15.7 36 139 A K H X S+ 0 0 149 -4,-2.1 4,-1.8 -5,-0.2 -1,-0.2 0.927 112.3 45.5 -62.3 -43.7 18.7 -2.6 12.9 37 140 A K H X S+ 0 0 91 -4,-2.1 4,-1.1 2,-0.2 -2,-0.2 0.875 108.6 56.2 -65.4 -40.4 18.1 0.3 10.4 38 141 A A H X S+ 0 0 0 -4,-1.9 4,-0.6 1,-0.2 3,-0.3 0.869 109.6 45.6 -59.9 -44.0 21.1 2.3 11.8 39 142 A F H >X S+ 0 0 4 -4,-2.0 4,-2.3 1,-0.2 3,-0.9 0.855 107.0 59.2 -66.1 -37.6 23.4 -0.6 11.0 40 143 A K H 3X S+ 0 0 108 -4,-1.8 4,-1.8 1,-0.3 -2,-0.2 0.701 92.3 68.0 -67.0 -21.1 21.8 -1.0 7.6 41 144 A V H 3< S+ 0 0 11 -4,-1.1 -1,-0.3 -3,-0.3 -2,-0.2 0.917 112.6 32.0 -58.3 -39.4 22.8 2.5 6.8 42 145 A W H X< S+ 0 0 0 -3,-0.9 3,-1.1 -4,-0.6 6,-0.3 0.846 116.1 53.3 -92.5 -38.1 26.4 1.2 6.9 43 146 A S H >< S+ 0 0 34 -4,-2.3 3,-1.0 1,-0.2 -3,-0.2 0.850 101.5 63.7 -62.8 -30.7 26.0 -2.3 5.6 44 147 A D T 3< S+ 0 0 94 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.711 111.2 36.9 -63.4 -14.3 24.2 -1.0 2.5 45 148 A V T < S+ 0 0 31 -3,-1.1 -1,-0.2 -4,-0.1 -2,-0.2 0.213 120.9 30.0-132.9 11.9 27.3 0.9 1.4 46 149 A T S < S- 0 0 7 -3,-1.0 121,-0.3 2,-0.2 118,-0.1 -0.851 91.8 -92.6-154.7 177.5 30.3 -1.4 2.3 47 150 A P S S+ 0 0 45 0, 0.0 -4,-0.1 0, 0.0 2,-0.1 0.330 79.7 132.9 -85.9 10.5 30.8 -5.3 2.6 48 151 A L - 0 0 2 -6,-0.3 2,-0.4 -34,-0.1 -2,-0.2 -0.395 38.5-165.0 -63.9 134.0 30.0 -5.1 6.4 49 152 A N E -c 14 0C 88 -36,-2.4 -34,-3.6 -2,-0.1 2,-0.4 -0.979 2.1-160.0-115.7 136.9 27.5 -7.6 7.9 50 153 A F E -c 15 0C 34 -2,-0.4 2,-0.4 -36,-0.2 -34,-0.2 -0.974 6.7-174.0-121.3 127.8 25.9 -7.1 11.4 51 154 A T E -c 16 0C 91 -36,-2.1 -34,-2.5 -2,-0.4 2,-0.3 -0.974 21.5-129.9-119.4 132.6 24.3 -9.9 13.4 52 155 A R E -c 17 0C 70 -2,-0.4 2,-0.4 -36,-0.2 -34,-0.2 -0.596 17.7-160.7 -74.7 134.9 22.4 -9.3 16.7 53 156 A L E -c 18 0C 63 -36,-3.2 -34,-0.6 -2,-0.3 3,-0.1 -0.935 13.4-148.7-109.7 145.4 23.4 -11.4 19.7 54 157 A H S S- 0 0 130 -2,-0.4 2,-0.2 -36,-0.1 -1,-0.1 0.750 76.9 -15.3 -85.2 -23.5 20.9 -11.7 22.6 55 158 A D S S+ 0 0 116 2,-0.1 -1,-0.1 -37,-0.0 2,-0.1 -0.887 97.2 58.3-159.7-172.0 23.6 -12.0 25.2 56 159 A G S S- 0 0 41 -2,-0.2 2,-0.5 -3,-0.1 -3,-0.1 -0.307 95.9 -27.3 74.7-160.0 27.4 -12.7 25.7 57 160 A I + 0 0 161 -2,-0.1 2,-0.3 4,-0.0 -2,-0.1 -0.800 62.9 175.8-100.7 120.5 30.2 -10.7 24.1 58 161 A A - 0 0 7 -2,-0.5 3,-0.2 1,-0.1 -41,-0.2 -0.814 40.5-115.8-114.1 166.1 29.5 -8.9 20.8 59 162 A D S S+ 0 0 32 -2,-0.3 2,-0.7 1,-0.3 -42,-0.2 0.987 110.2 38.0 -63.4 -57.0 31.7 -6.5 18.9 60 163 A I E S-d 17 0C 0 -44,-2.8 -42,-2.0 35,-0.1 2,-0.5 -0.842 76.1-166.9-100.4 104.4 29.4 -3.6 19.4 61 164 A M E -d 18 0C 38 -2,-0.7 35,-2.3 -44,-0.2 2,-0.4 -0.835 10.5-161.2 -91.1 122.8 27.8 -3.6 22.9 62 165 A I E +de 19 96C 0 -44,-3.2 -42,-3.0 -2,-0.5 -41,-0.5 -0.886 19.4 156.4-108.2 135.3 24.9 -1.1 23.0 63 166 A S E - e 0 97C 25 33,-1.7 35,-2.3 -2,-0.4 2,-0.4 -0.987 36.2-129.7-155.6 162.7 23.5 0.3 26.3 64 167 A F E + e 0 98C 12 -2,-0.3 2,-0.3 33,-0.2 35,-0.2 -0.930 39.0 153.0-112.5 129.7 21.6 3.1 27.8 65 168 A G E - e 0 99C 15 33,-2.2 35,-2.3 -2,-0.4 36,-0.4 -0.949 31.0-134.3-150.4 169.0 23.1 4.8 30.9 66 169 A I - 0 0 85 -2,-0.3 33,-0.0 2,-0.2 10,-0.0 -0.919 63.9 -27.2-126.1 158.4 23.1 8.0 32.8 67 170 A K S S+ 0 0 109 -2,-0.3 8,-2.4 7,-0.1 2,-0.5 -0.066 127.7 14.1 44.0-132.9 25.9 10.1 34.4 68 171 A E S S+ 0 0 133 6,-0.2 -2,-0.2 1,-0.1 4,-0.1 -0.592 70.8 158.4 -70.4 119.8 28.8 7.7 35.4 69 172 A H S S- 0 0 47 -2,-0.5 -1,-0.1 2,-0.1 3,-0.1 0.102 70.4 -64.2-136.5 22.9 28.1 4.5 33.7 70 173 A G S S+ 0 0 31 1,-0.3 2,-0.2 0, 0.0 -2,-0.1 0.742 103.1 59.8 102.9 30.3 31.6 2.8 33.5 71 174 A D S S- 0 0 3 21,-0.0 -1,-0.3 0, 0.0 -2,-0.1 -0.883 91.4 -83.0-157.3-166.8 34.0 4.8 31.4 72 175 A F S S+ 0 0 128 -2,-0.2 -4,-0.0 1,-0.2 170,-0.0 0.128 109.4 74.8 -93.9 21.2 35.8 8.2 31.0 73 176 A Y - 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