==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=16-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 28-JUN-12 4FU4 . COMPND 2 MOLECULE: COLLAGENASE 3; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR E.A.STURA,L.VERA,R.VISSE,H.NAGASE,V.DIVE . 788 4 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37917.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 463 58.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 39 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 177 22.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 1.0 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 . 14 1.8 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 0.3 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 . 61 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 81 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 85 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 1.6 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 3 0 0 0 1 0 1 1 1 1 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 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 . 0 10 2 2 15 5 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 . 4 0 4 4 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 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, 0.0 128,-0.1 0.000 360.0 360.0 360.0 161.0 -6.2 15.4 15.4 2 105 A N E -A 128 0A 78 126,-0.6 126,-3.3 135,-0.0 2,-0.2 -0.991 360.0-158.3-140.1 133.8 -9.1 13.9 17.3 3 106 A V E -A 127 0A 47 -2,-0.3 124,-0.2 124,-0.3 3,-0.1 -0.497 34.0 -97.2 -94.8 175.1 -11.8 11.5 16.3 4 107 A F > - 0 0 3 122,-1.0 3,-1.9 4,-0.2 4,-0.2 -0.591 52.0 -76.7 -88.1 156.1 -15.1 11.0 18.1 5 108 A P G > S+ 0 0 82 0, 0.0 3,-0.9 0, 0.0 -1,-0.1 -0.136 120.6 20.4 -46.5 147.5 -15.8 8.2 20.7 6 109 A R G 3 S- 0 0 164 1,-0.2 3,-0.1 -3,-0.1 -2,-0.0 0.296 120.2 -94.3 62.2 -2.4 -16.5 4.8 19.2 7 110 A T G < - 0 0 58 -3,-1.9 -1,-0.2 1,-0.2 120,-0.0 0.913 46.7-142.8 61.6 47.6 -14.7 6.1 16.0 8 111 A L < + 0 0 19 -3,-0.9 2,-0.3 -4,-0.2 -4,-0.2 -0.160 32.6 169.1 -43.2 111.1 -17.9 7.2 14.3 9 112 A K - 0 0 83 -3,-0.1 2,-0.3 78,-0.1 117,-0.1 -0.922 40.0-118.1-134.8 142.6 -17.3 6.4 10.6 10 113 A W - 0 0 19 -2,-0.3 5,-0.0 115,-0.3 115,-0.0 -0.690 20.6-153.1 -74.2 142.6 -19.5 6.4 7.6 11 114 A S S S+ 0 0 124 -2,-0.3 2,-0.4 2,-0.0 -1,-0.1 0.410 74.8 68.9-100.0 -0.3 -19.5 2.8 6.3 12 115 A K - 0 0 101 1,-0.1 -2,-0.1 0, 0.0 3,-0.0 -0.934 64.1-156.3-116.6 142.5 -20.2 3.9 2.7 13 116 A M S S+ 0 0 80 -2,-0.4 36,-1.4 1,-0.1 2,-1.0 0.848 80.8 68.5 -83.7 -36.8 -17.8 5.8 0.4 14 117 A N E S+b 49 0B 104 34,-0.2 2,-0.2 36,-0.1 36,-0.2 -0.737 73.4 178.5 -89.9 102.7 -20.3 7.4 -1.9 15 118 A L E -b 50 0B 1 34,-2.5 36,-2.1 -2,-1.0 2,-0.4 -0.579 18.2-136.4-109.2 168.7 -22.2 9.9 0.1 16 119 A T E -b 51 0B 32 34,-0.2 44,-3.1 -2,-0.2 2,-0.3 -0.915 14.9-176.9-126.9 145.9 -25.0 12.4 -0.6 17 120 A Y E -bc 52 60B 13 34,-2.0 36,-3.2 -2,-0.4 2,-0.3 -0.956 7.2-162.6-137.3 162.8 -25.7 16.0 0.4 18 121 A R E - c 0 61B 67 42,-1.8 44,-2.3 -2,-0.3 2,-1.1 -0.965 16.9-142.8-147.3 123.5 -28.5 18.5 -0.1 19 122 A I E - c 0 62B 11 34,-0.4 44,-0.2 -2,-0.3 42,-0.1 -0.761 19.9-172.7 -84.9 98.1 -28.4 22.3 0.3 20 123 A V - 0 0 67 42,-2.9 2,-0.2 -2,-1.1 43,-0.2 0.942 64.0 -10.4 -60.1 -54.4 -31.9 22.9 1.8 21 124 A N S S- 0 0 57 41,-0.5 2,-0.3 0, 0.0 -1,-0.1 -0.819 71.1-124.1-139.0 180.0 -31.8 26.8 1.6 22 125 A Y - 0 0 35 -2,-0.2 6,-0.1 42,-0.1 42,-0.1 -0.877 21.9-101.3-133.2 156.3 -29.3 29.5 0.9 23 126 A T > - 0 0 2 -2,-0.3 3,-1.1 1,-0.1 8,-0.1 -0.558 22.3-139.7 -75.6 137.7 -27.7 32.6 2.4 24 127 A P T 3 S+ 0 0 108 0, 0.0 -1,-0.1 0, 0.0 79,-0.1 0.786 99.1 68.5 -59.3 -27.9 -29.1 35.9 1.1 25 128 A D T 3 S+ 0 0 81 77,-0.2 2,-0.3 2,-0.0 78,-0.0 0.619 104.1 43.3 -75.1 -11.7 -25.5 37.3 1.1 26 129 A M S < S- 0 0 14 -3,-1.1 2,-0.3 79,-0.1 79,-0.1 -0.890 85.5-107.2-130.4 161.3 -24.5 35.0 -1.7 27 130 A T > - 0 0 64 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.667 36.0-113.1 -84.9 142.9 -25.8 33.7 -5.1 28 131 A H H > S+ 0 0 111 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.860 118.9 45.7 -38.9 -50.3 -27.0 30.1 -5.3 29 132 A S H > S+ 0 0 73 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.929 109.8 52.3 -63.8 -48.0 -24.1 29.2 -7.6 30 133 A E H > S+ 0 0 90 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.824 115.0 46.3 -53.2 -32.9 -21.5 31.0 -5.5 31 134 A V H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 5,-0.3 0.898 111.4 48.0 -78.0 -46.1 -23.0 28.9 -2.7 32 135 A E H X S+ 0 0 52 -4,-3.0 4,-1.5 -5,-0.2 -2,-0.2 0.816 109.1 55.4 -64.1 -30.2 -23.0 25.6 -4.5 33 136 A K H X S+ 0 0 150 -4,-2.5 4,-2.1 -5,-0.2 -1,-0.2 0.906 107.3 50.9 -71.7 -38.5 -19.4 26.2 -5.7 34 137 A A H X S+ 0 0 3 -4,-1.1 4,-2.8 -5,-0.2 -2,-0.2 0.979 111.3 43.0 -60.3 -64.2 -18.3 26.6 -2.1 35 138 A F H X S+ 0 0 0 -4,-1.8 4,-2.4 1,-0.3 5,-0.2 0.866 115.8 50.8 -53.1 -40.4 -19.8 23.4 -0.6 36 139 A K H X S+ 0 0 138 -4,-1.5 4,-1.3 -5,-0.3 -1,-0.3 0.895 112.2 46.4 -64.7 -39.8 -18.6 21.5 -3.6 37 140 A K H X S+ 0 0 63 -4,-2.1 4,-1.5 1,-0.2 -2,-0.2 0.867 110.5 56.3 -65.4 -35.4 -15.2 23.0 -3.1 38 141 A A H X S+ 0 0 0 -4,-2.8 4,-0.8 1,-0.2 -2,-0.2 0.861 108.8 42.6 -71.1 -39.4 -15.5 22.1 0.6 39 142 A F H X S+ 0 0 4 -4,-2.4 4,-3.3 2,-0.2 3,-0.2 0.806 105.7 65.2 -72.5 -27.9 -16.2 18.4 0.0 40 143 A K H X S+ 0 0 97 -4,-1.3 4,-3.1 1,-0.2 -2,-0.2 0.893 94.2 61.6 -63.2 -38.4 -13.4 18.4 -2.6 41 144 A V H < S+ 0 0 15 -4,-1.5 4,-0.3 1,-0.2 -1,-0.2 0.918 113.2 33.7 -46.4 -52.9 -11.0 19.2 0.2 42 145 A W H >< S+ 0 0 0 -4,-0.8 3,-1.2 -3,-0.2 -2,-0.2 0.889 116.9 54.3 -77.2 -41.4 -11.9 15.9 1.9 43 146 A S H >< S+ 0 0 29 -4,-3.3 3,-1.6 1,-0.2 -2,-0.2 0.873 95.7 68.0 -61.8 -38.0 -12.4 13.9 -1.2 44 147 A D T 3< S+ 0 0 53 -4,-3.1 -1,-0.2 1,-0.3 122,-0.2 0.704 112.4 31.4 -55.1 -21.6 -9.0 14.8 -2.6 45 148 A V T < S+ 0 0 2 -3,-1.2 -1,-0.3 -4,-0.3 -2,-0.2 0.218 116.7 56.5-126.3 14.6 -7.3 12.7 0.1 46 149 A T S < S- 0 0 6 -3,-1.6 120,-0.2 119,-0.2 121,-0.1 -0.918 83.9-111.4-136.9 165.0 -9.9 9.9 0.8 47 150 A P S S+ 0 0 52 0, 0.0 -4,-0.1 0, 0.0 119,-0.1 0.656 84.7 120.0 -64.3 -14.2 -11.7 7.2 -1.0 48 151 A L - 0 0 4 -6,-0.2 2,-0.3 -34,-0.1 -2,-0.2 0.063 43.2-173.9 -56.3 164.2 -14.7 9.4 -0.3 49 152 A N E -b 14 0B 84 -36,-1.4 -34,-2.5 2,-0.0 2,-0.4 -0.962 11.0-144.1-163.0 136.1 -16.9 10.9 -3.0 50 153 A F E -b 15 0B 34 -2,-0.3 2,-0.5 -36,-0.2 -34,-0.2 -0.926 10.2-172.2-122.6 135.3 -19.8 13.4 -2.8 51 154 A T E -b 16 0B 70 -36,-2.1 -34,-2.0 -2,-0.4 2,-0.5 -0.981 19.2-137.9-125.8 122.4 -23.0 13.6 -4.8 52 155 A R E -b 17 0B 71 -2,-0.5 2,-0.3 -36,-0.2 -34,-0.2 -0.671 16.7-159.7 -78.3 120.8 -25.3 16.5 -4.6 53 156 A L - 0 0 54 -36,-3.2 -34,-0.4 -2,-0.5 3,-0.1 -0.713 10.4-152.4 -90.8 153.3 -29.0 15.6 -4.5 54 157 A H S S+ 0 0 136 -2,-0.3 2,-0.3 1,-0.2 -36,-0.1 0.260 71.4 12.5-110.0 10.2 -31.7 18.2 -5.4 55 158 A D S S+ 0 0 124 2,-0.0 2,-0.4 0, 0.0 -1,-0.2 -0.954 97.8 22.1-172.5 161.0 -34.6 16.8 -3.3 56 159 A G S S- 0 0 38 -2,-0.3 2,-0.5 -3,-0.1 -3,-0.0 -0.637 99.4 -18.5 88.0-132.3 -35.7 14.5 -0.6 57 160 A I + 0 0 133 -2,-0.4 2,-0.2 -40,-0.0 3,-0.1 -0.954 56.9 179.3-127.9 120.2 -33.3 13.2 2.0 58 161 A A - 0 0 7 -2,-0.5 -41,-0.1 1,-0.1 3,-0.1 -0.636 39.3-113.9-103.5 165.3 -29.5 13.1 1.9 59 162 A D S S+ 0 0 38 1,-0.2 2,-0.9 -2,-0.2 -42,-0.2 0.997 111.3 42.8 -56.5 -65.9 -26.8 11.9 4.3 60 163 A I E S-c 17 0B 0 -44,-3.1 -42,-1.8 35,-0.1 2,-0.8 -0.751 77.7-165.2 -89.7 111.9 -25.5 15.4 4.8 61 164 A M E -c 18 0B 24 -2,-0.9 35,-1.3 30,-0.2 2,-0.6 -0.846 6.2-163.9 -98.1 106.9 -28.4 17.8 5.2 62 165 A I E +cd 19 96B 0 -44,-2.3 -42,-2.9 -2,-0.8 -41,-0.5 -0.802 19.4 156.2 -95.4 118.0 -27.1 21.4 4.8 63 166 A S E - d 0 97B 26 33,-1.5 35,-2.2 -2,-0.6 2,-0.4 -0.898 36.1-126.0-135.3 165.6 -29.4 24.3 6.0 64 167 A F E + d 0 98B 16 -2,-0.3 2,-0.3 33,-0.2 35,-0.2 -0.945 33.5 178.8-113.4 132.8 -29.1 27.9 7.2 65 168 A G E - d 0 99B 7 33,-3.0 35,-3.8 -2,-0.4 36,-0.5 -0.860 22.2-145.3-134.7 163.7 -30.7 29.0 10.4 66 169 A I - 0 0 79 -2,-0.3 33,-0.0 33,-0.2 10,-0.0 -0.954 62.9 -44.0-127.9 148.8 -31.2 31.9 12.8 67 170 A K S S+ 0 0 111 -2,-0.3 8,-2.6 7,-0.1 2,-0.5 0.096 131.9 8.4 30.9-131.4 -31.3 31.9 16.6 68 171 A E S S+ 0 0 103 6,-0.3 -2,-0.2 1,-0.1 4,-0.1 -0.664 81.2 164.4 -67.4 124.5 -33.4 28.9 17.7 69 172 A H - 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