==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 13-MAY-11 2YIG . COMPND 2 MOLECULE: COLLAGENASE 3; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.GERHARDT,D.HARGREAVES . 333 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16733.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 179 53.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 35 10.5 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 . 21 6.3 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 . 68 20.4 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 0 2 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 0 107 0, 0.0 2,-0.3 0, 0.0 298,-0.1 0.000 360.0 360.0 360.0 166.7 53.9 -10.4 10.8 2 105 A N E -A 297 0A 69 295,-0.5 295,-3.5 3,-0.0 2,-0.2 -0.985 360.0-160.9-141.8 131.8 51.1 -7.8 11.1 3 106 A V E -A 296 0A 49 -2,-0.3 293,-0.2 293,-0.3 295,-0.1 -0.642 38.4 -95.4 -94.5 161.6 51.2 -4.0 11.7 4 107 A F - 0 0 20 291,-1.6 -1,-0.1 173,-0.3 4,-0.1 -0.467 48.7-100.4 -71.6 148.6 48.2 -2.1 12.9 5 108 A P - 0 0 47 0, 0.0 -1,-0.1 0, 0.0 171,-0.1 -0.291 25.7-115.2 -63.4 161.7 46.1 -0.5 10.2 6 109 A R S S+ 0 0 196 168,-0.1 169,-2.1 2,-0.1 2,-0.3 0.724 99.9 37.1 -67.6 -27.5 46.4 3.3 9.3 7 110 A T B S-B 174 0B 32 167,-0.2 2,-0.9 154,-0.1 169,-0.0 -0.926 96.7-102.7-123.1 149.8 42.8 4.1 10.5 8 111 A L + 0 0 36 165,-1.9 165,-0.3 -2,-0.3 2,-0.3 -0.703 69.1 140.3 -64.0 105.7 40.9 2.7 13.4 9 112 A K - 0 0 80 -2,-0.9 2,-0.2 78,-0.1 117,-0.1 -0.966 58.4 -92.2-143.5 166.1 38.6 0.2 11.4 10 113 A W - 0 0 24 115,-0.4 5,-0.0 -2,-0.3 115,-0.0 -0.555 24.1-151.2 -73.2 141.0 37.2 -3.3 11.8 11 114 A S S S+ 0 0 126 -2,-0.2 2,-0.3 -6,-0.0 -1,-0.1 0.333 81.4 57.3 -93.7 0.7 39.4 -5.9 10.1 12 115 A K - 0 0 96 1,-0.1 -2,-0.1 2,-0.0 36,-0.0 -0.957 68.9-149.6-129.1 147.8 36.3 -8.1 9.4 13 116 A M S S+ 0 0 75 -2,-0.3 36,-2.4 35,-0.1 2,-0.7 0.646 80.8 78.3 -93.8 -17.3 33.2 -7.1 7.5 14 117 A N E +c 49 0C 108 34,-0.2 2,-0.3 36,-0.1 36,-0.2 -0.861 65.4 175.1 -92.9 111.7 30.8 -9.4 9.4 15 118 A L E -c 50 0C 0 34,-2.9 36,-2.0 -2,-0.7 2,-0.3 -0.896 18.3-146.9-118.8 151.8 30.0 -7.6 12.7 16 119 A T E -c 51 0C 36 -2,-0.3 44,-2.4 34,-0.2 2,-0.3 -0.820 10.0-166.0-113.1 155.6 27.6 -8.5 15.5 17 120 A Y E -cd 52 60C 13 34,-2.0 36,-3.4 -2,-0.3 2,-0.4 -0.973 5.7-158.8-137.8 156.9 25.6 -6.3 17.8 18 121 A R E -cd 53 61C 61 42,-2.1 44,-3.4 -2,-0.3 2,-1.1 -0.982 15.3-145.1-135.9 125.4 23.7 -6.8 21.0 19 122 A I E - d 0 62C 11 34,-0.5 44,-0.2 -2,-0.4 42,-0.1 -0.754 23.0-175.2 -85.9 101.4 20.9 -4.5 22.4 20 123 A V - 0 0 57 42,-3.0 2,-0.3 -2,-1.1 43,-0.2 0.895 61.0 -8.9 -73.2 -36.3 21.8 -5.0 26.1 21 124 A N - 0 0 64 41,-0.7 2,-0.3 -3,-0.1 -1,-0.1 -0.892 69.9-119.0-156.5 175.4 18.9 -3.0 27.5 22 125 A Y - 0 0 50 -2,-0.3 6,-0.1 42,-0.1 42,-0.1 -0.930 18.4-112.9-132.0 150.0 16.1 -0.8 26.4 23 126 A T > - 0 0 5 -2,-0.3 3,-0.7 4,-0.1 8,-0.1 -0.442 21.7-131.5 -74.9 145.4 14.7 2.7 26.8 24 127 A P T 3 S+ 0 0 109 0, 0.0 -1,-0.1 0, 0.0 76,-0.0 0.697 98.7 71.9 -60.4 -23.7 11.4 3.3 28.6 25 128 A D T 3 S+ 0 0 70 2,-0.1 2,-0.3 75,-0.0 78,-0.0 0.626 100.2 31.1 -78.5 -15.8 10.3 5.6 25.8 26 129 A M S < S- 0 0 14 -3,-0.7 79,-0.1 79,-0.1 2,-0.0 -0.915 84.3 -96.0-143.3 157.6 9.7 3.0 23.1 27 130 A T > - 0 0 76 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.324 37.4-115.1 -73.5 162.0 8.6 -0.6 22.5 28 131 A H H > S+ 0 0 116 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.929 119.8 52.8 -60.4 -41.2 11.3 -3.2 22.2 29 132 A S H > S+ 0 0 57 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.933 108.2 48.9 -59.8 -45.2 10.1 -3.8 18.6 30 133 A E H > S+ 0 0 67 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.922 113.6 47.9 -58.8 -45.5 10.4 0.0 17.8 31 134 A V H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.917 111.8 48.7 -62.2 -47.3 13.9 0.1 19.2 32 135 A E H X S+ 0 0 47 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.910 112.3 49.0 -60.5 -42.7 15.0 -3.1 17.3 33 136 A K H X S+ 0 0 118 -4,-2.8 4,-2.3 -5,-0.2 -1,-0.2 0.889 110.1 51.4 -64.5 -41.7 13.6 -1.7 14.1 34 137 A A H X S+ 0 0 12 -4,-2.4 4,-2.4 -5,-0.2 -2,-0.2 0.967 114.3 42.5 -58.9 -49.7 15.4 1.7 14.6 35 138 A F H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 5,-0.2 0.904 112.5 53.5 -66.7 -40.3 18.7 -0.0 15.2 36 139 A K H X S+ 0 0 148 -4,-2.9 4,-1.9 -5,-0.2 -1,-0.2 0.940 113.4 43.4 -59.8 -47.0 18.2 -2.5 12.3 37 140 A K H X S+ 0 0 106 -4,-2.3 4,-1.3 2,-0.2 -1,-0.2 0.885 110.3 55.9 -61.8 -40.0 17.5 0.4 9.9 38 141 A A H X S+ 0 0 0 -4,-2.4 4,-0.7 1,-0.2 -1,-0.2 0.857 108.8 47.7 -62.4 -41.0 20.4 2.4 11.3 39 142 A F H >X S+ 0 0 4 -4,-2.3 4,-2.4 1,-0.2 3,-0.9 0.911 106.3 58.0 -63.6 -37.2 22.8 -0.5 10.5 40 143 A K H 3X S+ 0 0 115 -4,-1.9 4,-1.8 1,-0.3 -2,-0.2 0.782 93.3 68.0 -67.2 -22.7 21.3 -0.8 7.0 41 144 A V H 3< S+ 0 0 12 -4,-1.3 -1,-0.3 1,-0.2 4,-0.2 0.931 113.1 30.6 -56.3 -44.9 22.3 2.9 6.4 42 145 A W H X< S+ 0 0 0 -3,-0.9 3,-0.8 -4,-0.7 6,-0.3 0.825 116.8 53.5 -90.1 -35.8 25.9 1.7 6.5 43 146 A S H >< S+ 0 0 34 -4,-2.4 3,-1.2 1,-0.2 -3,-0.2 0.857 100.7 64.7 -66.4 -31.1 25.7 -1.9 5.1 44 147 A D T 3< S+ 0 0 87 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.705 111.0 34.8 -61.7 -23.7 23.8 -0.6 2.1 45 148 A V T < S+ 0 0 30 -3,-0.8 -1,-0.2 -4,-0.2 -2,-0.2 0.235 122.2 36.7-121.1 16.4 26.9 1.4 1.0 46 149 A T S < S- 0 0 6 -3,-1.2 120,-0.3 2,-0.2 117,-0.1 -0.795 90.5 -98.4-147.1-178.6 29.8 -0.9 2.1 47 150 A P S S+ 0 0 42 0, 0.0 -4,-0.1 0, 0.0 118,-0.1 0.301 79.4 128.5 -89.1 6.5 30.4 -4.7 2.2 48 151 A L - 0 0 1 -6,-0.3 2,-0.4 -34,-0.1 -2,-0.2 -0.353 39.1-168.3 -65.9 143.9 29.5 -4.6 6.0 49 152 A N E -c 14 0C 81 -36,-2.4 -34,-2.9 -2,-0.1 2,-0.4 -0.982 4.7-155.9-129.0 142.9 26.9 -7.1 7.3 50 153 A F E -c 15 0C 37 -2,-0.4 2,-0.4 -36,-0.2 -34,-0.2 -0.977 7.0-171.5-124.7 134.1 25.4 -6.9 10.8 51 154 A T E -c 16 0C 89 -36,-2.0 -34,-2.0 -2,-0.4 2,-0.3 -0.988 21.8-128.3-125.0 132.5 23.8 -9.7 12.8 52 155 A R E -c 17 0C 74 -2,-0.4 2,-0.5 -36,-0.2 -34,-0.2 -0.571 18.4-160.9 -80.4 135.0 21.9 -9.3 16.0 53 156 A L E -c 18 0C 59 -36,-3.4 -34,-0.5 -2,-0.3 5,-0.1 -0.949 11.6-150.2-109.8 139.6 23.0 -11.3 19.0 54 157 A H S S- 0 0 136 -2,-0.5 2,-0.3 1,-0.1 -1,-0.1 0.760 73.8 -16.2 -82.1 -24.8 20.5 -11.8 21.8 55 158 A D S S+ 0 0 107 2,-0.1 -1,-0.1 -3,-0.1 2,-0.1 -0.940 98.5 52.2-159.1-170.0 23.1 -12.1 24.5 56 159 A G S S- 0 0 36 -2,-0.3 2,-0.7 -3,-0.1 -3,-0.1 -0.429 98.1 -17.9 69.3-156.2 26.8 -12.7 25.2 57 160 A I + 0 0 157 -2,-0.1 2,-0.3 4,-0.0 -2,-0.1 -0.813 61.3 173.5-100.6 113.2 29.6 -10.8 23.5 58 161 A A - 0 0 6 -2,-0.7 3,-0.2 1,-0.1 -41,-0.1 -0.756 41.2-119.3-102.5 159.0 28.9 -8.8 20.4 59 162 A D S S+ 0 0 32 -2,-0.3 2,-0.7 1,-0.2 -42,-0.2 0.943 109.4 38.7 -56.6 -51.9 31.3 -6.5 18.6 60 163 A I E S-d 17 0C 0 -44,-2.4 -42,-2.1 35,-0.1 2,-0.5 -0.868 76.7-166.9-107.0 99.8 28.9 -3.5 19.1 61 164 A M E -d 18 0C 38 -2,-0.7 35,-1.9 -3,-0.2 2,-0.4 -0.781 9.2-159.8 -87.4 127.3 27.2 -3.6 22.5 62 165 A I E +de 19 96C 0 -44,-3.4 -42,-3.0 -2,-0.5 -41,-0.7 -0.896 19.8 157.7-111.7 133.2 24.3 -1.2 22.6 63 166 A S E - e 0 97C 27 33,-1.9 35,-2.1 -2,-0.4 2,-0.4 -0.976 33.7-132.6-152.2 160.6 22.9 0.1 25.9 64 167 A F E + e 0 98C 12 -2,-0.3 2,-0.3 33,-0.2 35,-0.2 -0.950 40.0 143.1-111.1 136.5 20.9 2.9 27.3 65 168 A G E - e 0 99C 17 33,-2.6 35,-2.2 -2,-0.4 36,-0.4 -0.967 34.3-125.5-160.9 179.8 22.1 4.7 30.5 66 169 A I - 0 0 83 -2,-0.3 33,-0.0 2,-0.2 10,-0.0 -0.889 63.9 -23.3-134.2 160.0 22.4 8.0 32.4 67 170 A K S S+ 0 0 110 -2,-0.3 8,-2.5 7,-0.1 2,-0.6 -0.053 126.6 12.5 40.6-128.9 25.1 10.0 34.1 68 171 A E S S+ 0 0 136 6,-0.3 -2,-0.2 1,-0.1 4,-0.1 -0.685 70.1 160.8 -80.6 120.0 28.1 7.7 35.0 69 172 A H - 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