==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 24-AUG-11 3TJO . COMPND 2 MOLECULE: SERINE PROTEASE HTRA1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.EIGENBROT,M.ULTSCH . 593 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27284.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 382 64.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 208 35.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 7 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 9 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 1.0 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 . 37 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 50 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 65 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.5 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 0 3 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 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 0 0 PARALLEL BRIDGES PER LADDER . 0 8 8 3 10 1 3 2 1 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 . 0 0 0 0 0 3 3 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 1 160 A M 0 0 95 0, 0.0 4,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 169.3 62.6 -27.0 53.3 2 161 A D > + 0 0 140 1,-0.2 3,-0.5 2,-0.2 6,-0.2 0.909 360.0 37.0 -66.9 -47.0 59.4 -25.6 51.7 3 162 A P T 3 S+ 0 0 83 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 0.671 117.8 54.7 -78.6 -14.4 61.1 -23.7 48.9 4 163 A N T 3 S+ 0 0 110 4,-0.1 -2,-0.2 5,-0.0 5,-0.0 0.418 82.0 116.8 -95.7 -2.4 63.7 -26.5 48.6 5 164 A S S X> S- 0 0 26 -3,-0.5 4,-2.3 -4,-0.5 3,-0.6 -0.287 77.4-116.8 -64.4 150.9 61.1 -29.3 48.1 6 165 A L H 3> S+ 0 0 42 358,-0.2 4,-2.7 1,-0.2 5,-0.2 0.886 115.2 57.6 -56.0 -39.6 61.0 -31.3 44.9 7 166 A R H 34 S+ 0 0 51 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.820 112.1 40.7 -62.9 -32.4 57.5 -29.9 44.1 8 167 A H H <4 S+ 0 0 139 -3,-0.6 -1,-0.2 -6,-0.2 -2,-0.2 0.834 119.7 44.9 -82.7 -35.7 58.8 -26.3 44.3 9 168 A K H < S+ 0 0 104 -4,-2.3 -2,-0.2 1,-0.1 -3,-0.2 0.888 119.4 30.8 -75.1 -43.4 62.1 -27.0 42.5 10 169 A Y S < S+ 0 0 28 -4,-2.7 2,-1.7 -5,-0.2 3,-0.4 0.356 78.3 106.4-112.5 3.8 61.2 -29.1 39.5 11 170 A N > + 0 0 6 -4,-0.5 4,-1.1 -5,-0.2 -1,-0.1 -0.296 33.4 140.3 -84.4 56.8 57.7 -28.2 38.4 12 171 A F H > + 0 0 3 -2,-1.7 4,-1.5 1,-0.2 -1,-0.2 0.783 65.7 58.3 -71.4 -27.3 58.7 -26.3 35.3 13 172 A I H > S+ 0 0 0 -3,-0.4 4,-2.5 304,-0.2 -1,-0.2 0.929 102.1 54.7 -68.2 -43.7 55.9 -27.7 33.0 14 173 A A H > S+ 0 0 2 303,-0.6 4,-2.1 1,-0.2 -1,-0.2 0.872 106.4 52.8 -53.7 -40.7 53.3 -26.3 35.4 15 174 A D H X S+ 0 0 70 -4,-1.1 4,-1.5 2,-0.2 -1,-0.2 0.883 109.1 48.8 -61.0 -42.1 55.0 -22.8 35.0 16 175 A V H X S+ 0 0 3 -4,-1.5 4,-1.8 2,-0.2 -2,-0.2 0.920 111.0 50.2 -64.3 -44.6 54.7 -23.1 31.2 17 176 A V H X S+ 0 0 1 -4,-2.5 4,-2.9 1,-0.2 -2,-0.2 0.897 107.0 53.5 -62.9 -44.3 51.0 -24.1 31.4 18 177 A E H < S+ 0 0 135 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.888 111.1 47.8 -57.4 -43.0 50.1 -21.2 33.7 19 178 A K H < S+ 0 0 142 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.876 121.7 32.9 -63.6 -40.3 51.7 -18.8 31.2 20 179 A I H >< S+ 0 0 0 -4,-1.8 3,-1.9 1,-0.1 4,-0.3 0.793 94.3 81.7 -96.2 -29.6 50.0 -20.2 28.1 21 180 A A G >< S+ 0 0 5 -4,-2.9 3,-2.1 1,-0.3 -1,-0.1 0.817 84.5 61.1 -51.8 -44.5 46.5 -21.5 29.1 22 181 A P G 3 S+ 0 0 56 0, 0.0 52,-0.4 0, 0.0 -1,-0.3 0.763 105.3 50.2 -56.8 -24.7 44.7 -18.1 29.0 23 182 A A G < S+ 0 0 1 -3,-1.9 26,-2.7 -4,-0.2 2,-0.4 0.442 90.3 97.1 -93.7 1.8 45.6 -17.8 25.3 24 183 A V E < -A 48 0A 1 -3,-2.1 2,-0.3 -4,-0.3 50,-0.2 -0.761 57.8-166.2 -93.9 133.0 44.3 -21.3 24.3 25 184 A V E -A 47 0A 0 22,-2.5 22,-2.0 -2,-0.4 100,-0.4 -0.850 21.7-126.1-121.4 156.7 40.8 -21.5 22.9 26 185 A H E -AB 46 72A 4 46,-2.6 46,-2.7 -2,-0.3 2,-0.4 -0.794 27.4-160.9 -93.1 139.0 38.1 -24.1 22.2 27 186 A I E -AB 45 71A 1 18,-2.7 18,-3.0 -2,-0.4 2,-0.4 -0.992 7.1-172.0-128.5 127.4 36.7 -24.1 18.6 28 187 A E E -AB 44 70A 36 42,-3.0 42,-2.6 -2,-0.4 2,-0.5 -0.951 12.1-148.5-118.7 141.3 33.5 -25.6 17.4 29 188 A L E -AB 43 69A 8 14,-2.7 13,-3.1 -2,-0.4 14,-1.3 -0.922 18.1-161.9-108.2 131.4 32.3 -26.0 13.8 30 189 A F E -AB 41 68A 23 38,-2.8 38,-0.8 -2,-0.5 2,-0.4 -0.808 8.7-164.4-113.4 150.7 28.5 -25.8 13.1 31 190 A R E -A 40 0A 142 9,-2.3 9,-2.6 -2,-0.3 2,-0.2 -0.984 28.1-112.0-129.1 145.8 26.3 -26.8 10.3 32 191 A K E -A 39 0A 106 -2,-0.4 7,-0.2 7,-0.2 6,-0.1 -0.529 35.7-117.0 -68.8 136.2 22.7 -25.8 9.5 33 192 A L > - 0 0 28 5,-2.8 3,-1.0 -2,-0.2 -1,-0.1 -0.470 19.2-123.9 -69.4 150.6 20.2 -28.6 9.9 34 193 A P T 3 S+ 0 0 119 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.878 109.3 39.3 -64.2 -35.9 18.4 -29.6 6.7 35 194 A F T 3 S+ 0 0 175 3,-0.0 2,-0.3 2,-0.0 3,-0.1 0.200 120.2 37.4 -97.6 11.9 14.9 -29.0 8.1 36 195 A S S < S- 0 0 42 -3,-1.0 -3,-0.1 2,-0.2 0, 0.0 -0.971 70.8-121.5-158.7 160.0 15.6 -25.9 10.2 37 196 A K S S+ 0 0 192 -2,-0.3 -1,-0.1 -5,-0.1 -2,-0.0 0.748 84.4 108.3 -75.5 -26.4 17.5 -22.6 10.5 38 197 A R - 0 0 155 -6,-0.1 -5,-2.8 1,-0.1 2,-0.4 -0.092 61.9-143.1 -56.7 145.6 19.0 -24.1 13.7 39 198 A E E -A 32 0A 52 -7,-0.2 -7,-0.2 -9,-0.0 -1,-0.1 -0.929 10.8-162.4-122.2 139.4 22.7 -25.2 13.7 40 199 A V E -A 31 0A 38 -9,-2.6 -9,-2.3 -2,-0.4 2,-0.2 -0.859 30.2 -99.7-119.2 149.9 24.4 -28.1 15.3 41 200 A P E +A 30 0A 72 0, 0.0 -11,-0.3 0, 0.0 3,-0.1 -0.509 38.8 167.4 -69.3 131.5 28.1 -28.9 16.2 42 201 A V E + 0 0 75 -13,-3.1 2,-0.3 1,-0.3 -12,-0.2 0.523 65.8 21.0-117.9 -17.9 29.8 -31.2 13.7 43 202 A A E -A 29 0A 38 -14,-1.3 -14,-2.7 19,-0.0 -1,-0.3 -0.986 59.1-163.2-151.3 154.8 33.4 -30.7 14.7 44 203 A S E +A 28 0A 70 -2,-0.3 2,-0.2 -16,-0.2 -16,-0.2 -0.998 23.6 136.7-140.9 139.2 35.4 -29.6 17.7 45 204 A G E -A 27 0A 2 -18,-3.0 -18,-2.7 -2,-0.3 2,-0.3 -0.857 38.2-103.0-158.6-164.6 39.1 -28.6 18.1 46 205 A S E +A 26 0A 0 111,-1.5 13,-0.4 -2,-0.2 2,-0.3 -0.835 27.6 168.6-128.2 167.1 41.4 -26.1 19.7 47 206 A G E -A 25 0A 0 -22,-2.0 -22,-2.5 -2,-0.3 2,-0.3 -0.902 24.2-119.8-156.8-172.9 43.4 -23.0 18.7 48 207 A F E -AC 24 57A 0 9,-2.1 9,-2.7 -2,-0.3 2,-0.4 -0.998 23.6-111.8-142.3 147.7 45.4 -20.2 20.2 49 208 A I E + C 0 56A 1 -26,-2.7 57,-2.1 -2,-0.3 7,-0.3 -0.613 30.3 175.2 -78.1 126.2 45.2 -16.4 20.2 50 209 A V + 0 0 30 5,-2.9 2,-0.3 -2,-0.4 6,-0.2 0.550 64.1 40.5-111.3 -13.9 48.1 -14.8 18.2 51 210 A S S > S- 0 0 26 4,-1.3 3,-2.2 53,-0.2 4,-0.3 -0.995 76.7-123.8-137.8 150.2 47.0 -11.0 18.3 52 211 A E T 3 S+ 0 0 103 -2,-0.3 51,-1.6 1,-0.3 -1,-0.1 0.728 109.7 57.7 -64.2 -22.7 45.5 -8.9 21.1 53 212 A D T 3 S- 0 0 101 49,-0.1 -1,-0.3 45,-0.0 46,-0.2 0.293 129.5 -83.7 -95.2 9.6 42.5 -7.9 18.9 54 213 A G < + 0 0 0 -3,-2.2 43,-2.0 1,-0.3 2,-0.4 0.669 68.5 153.6 105.7 21.0 41.5 -11.5 18.4 55 214 A L E - D 0 96A 48 -4,-0.3 -5,-2.9 41,-0.2 -4,-1.3 -0.668 25.7-166.8 -73.0 132.5 43.3 -13.3 15.6 56 215 A I E -CD 49 95A 0 39,-2.7 39,-2.6 -2,-0.4 2,-0.4 -0.981 10.0-150.6-129.0 133.1 43.4 -17.0 16.3 57 216 A V E +CD 48 94A 0 -9,-2.7 -9,-2.1 -2,-0.4 2,-0.3 -0.850 30.0 141.3-103.6 139.0 45.5 -19.7 14.6 58 217 A T E - D 0 93A 0 35,-1.9 35,-3.0 -2,-0.4 2,-0.2 -0.874 51.5 -77.1-153.2-175.7 44.4 -23.3 14.3 59 218 A N E >> - D 0 92A 6 -13,-0.4 4,-1.6 33,-0.3 3,-1.1 -0.514 35.8-115.2 -89.8 163.4 44.7 -26.0 11.6 60 219 A A T 34 S+ 0 0 8 31,-0.8 32,-0.1 27,-0.3 -1,-0.1 0.479 115.9 60.9 -74.3 -3.9 42.6 -26.2 8.4 61 220 A H T 34 S+ 0 0 151 30,-0.3 -1,-0.2 1,-0.1 3,-0.1 0.551 102.9 50.4 -95.4 -10.7 41.1 -29.5 9.7 62 221 A V T <4 S+ 0 0 16 -3,-1.1 2,-0.4 1,-0.3 -2,-0.2 0.827 124.5 25.0 -89.7 -41.3 39.7 -27.7 12.7 63 222 A V < + 0 0 0 -4,-1.6 -1,-0.3 6,-0.0 2,-0.1 -0.988 66.1 178.1-123.2 142.2 38.1 -24.9 10.6 64 223 A T - 0 0 57 -2,-0.4 2,-1.5 -3,-0.1 3,-0.4 -0.491 38.3-109.0-148.1 67.7 37.0 -25.4 6.9 65 224 A N S S+ 0 0 102 1,-0.2 18,-0.1 -2,-0.1 -1,-0.0 -0.253 99.3 62.3 64.9 -75.4 35.3 -22.4 5.0 66 225 A K S S+ 0 0 181 -2,-1.5 -1,-0.2 2,-0.0 2,-0.1 0.706 93.4 80.5 -64.5 -19.6 31.6 -23.1 4.4 67 226 A H S S- 0 0 32 -3,-0.4 2,-0.2 1,-0.1 -36,-0.2 -0.457 81.1-106.6-101.8 156.7 30.6 -23.4 8.1 68 227 A R E -B 30 0A 124 -38,-0.8 -38,-2.8 -2,-0.1 2,-0.5 -0.548 36.7-148.4 -70.3 140.7 29.8 -21.2 11.1 69 228 A V E -BE 29 81A 1 12,-0.5 12,-2.9 -2,-0.2 2,-0.4 -0.968 11.1-166.0-124.0 125.0 32.6 -21.1 13.7 70 229 A K E -BE 28 80A 76 -42,-2.6 -42,-3.0 -2,-0.5 2,-0.4 -0.919 5.5-163.7-107.3 131.7 32.2 -20.7 17.5 71 230 A V E -BE 27 79A 0 8,-3.2 8,-2.5 -2,-0.4 2,-0.5 -0.941 0.2-163.7-111.2 137.1 35.2 -19.8 19.7 72 231 A E E -BE 26 78A 23 -46,-2.7 -46,-2.6 -2,-0.4 6,-0.2 -0.988 11.1-145.5-121.5 125.9 35.2 -20.2 23.5 73 232 A L > - 0 0 13 4,-2.9 3,-2.0 -2,-0.5 -48,-0.1 -0.294 35.8 -94.0 -78.2 169.4 37.8 -18.5 25.7 74 233 A K T 3 S+ 0 0 82 -52,-0.4 -1,-0.1 1,-0.3 -51,-0.1 0.824 125.5 52.5 -53.8 -37.1 39.2 -20.1 28.9 75 234 A N T 3 S- 0 0 120 -53,-0.1 -1,-0.3 2,-0.1 54,-0.1 0.427 124.0-100.4 -82.0 1.1 36.6 -18.2 31.1 76 235 A G S < S+ 0 0 24 -3,-2.0 -2,-0.1 52,-0.5 2,-0.1 0.303 71.7 148.7 99.2 -9.6 33.7 -19.6 29.0 77 236 A A - 0 0 25 51,-0.1 -4,-2.9 -5,-0.1 2,-0.4 -0.398 33.6-152.0 -60.0 130.0 33.1 -16.4 26.9 78 237 A T E +E 72 0A 71 -6,-0.2 2,-0.3 -2,-0.1 -6,-0.2 -0.867 17.8 175.1-114.9 143.0 31.8 -17.4 23.5 79 238 A Y E -E 71 0A 57 -8,-2.5 -8,-3.2 -2,-0.4 2,-0.4 -0.993 32.1-121.8-142.2 142.3 32.2 -15.5 20.2 80 239 A E E -E 70 0A 98 -2,-0.3 18,-0.4 -10,-0.2 2,-0.3 -0.758 38.4-141.1 -79.4 134.2 31.3 -16.2 16.6 81 240 A A E -E 69 0A 5 -12,-2.9 -12,-0.5 -2,-0.4 2,-0.5 -0.731 4.6-136.8-100.7 147.0 34.5 -16.1 14.5 82 241 A K E -F 96 0A 128 14,-2.9 14,-2.0 -2,-0.3 2,-0.6 -0.869 24.0-126.5 -93.6 133.8 35.1 -14.7 11.1 83 242 A I E +F 95 0A 49 -2,-0.5 12,-0.2 12,-0.2 3,-0.1 -0.717 32.4 173.6 -80.2 118.8 37.2 -16.9 8.8 84 243 A K E - 0 0 123 10,-2.5 2,-0.3 -2,-0.6 11,-0.2 0.871 62.0 -7.7 -91.5 -44.7 40.1 -14.7 7.6 85 244 A D E -F 94 0A 22 9,-1.8 9,-3.0 2,-0.0 2,-0.5 -0.947 50.9-167.6-162.3 128.4 42.3 -17.2 5.7 86 245 A V E -F 93 0A 26 -2,-0.3 2,-0.8 7,-0.2 7,-0.2 -0.981 3.6-169.1-122.7 117.7 42.5 -21.0 5.2 87 246 A D E >> -F 92 0A 38 5,-3.2 5,-2.0 -2,-0.5 4,-1.4 -0.893 4.0-177.5-105.5 101.3 45.6 -22.5 3.6 88 247 A E T 45S+ 0 0 139 -2,-0.8 -1,-0.1 3,-0.2 -28,-0.1 0.750 81.0 54.3 -72.5 -26.5 44.6 -26.1 2.8 89 248 A K T 45S+ 0 0 211 1,-0.2 -1,-0.2 3,-0.1 -2,-0.1 0.940 117.8 34.7 -69.7 -48.8 48.1 -27.0 1.5 90 249 A A T 45S- 0 0 17 2,-0.1 -2,-0.2 98,-0.1 -1,-0.2 0.659 106.0-129.3 -76.8 -18.0 49.8 -25.8 4.7 91 250 A D T <5 + 0 0 18 -4,-1.4 -31,-0.8 1,-0.2 2,-0.4 0.845 63.0 132.5 67.4 37.7 46.8 -27.0 6.9 92 251 A I E < -DF 59 87A 0 -5,-2.0 -5,-3.2 -33,-0.3 2,-0.4 -0.952 35.9-169.2-123.0 137.6 46.6 -23.6 8.6 93 252 A A E -DF 58 86A 0 -35,-3.0 -35,-1.9 -2,-0.4 2,-0.5 -0.970 8.6-158.0-125.6 146.5 43.6 -21.4 9.4 94 253 A L E +DF 57 85A 9 -9,-3.0 -10,-2.5 -2,-0.4 -9,-1.8 -0.988 19.9 172.5-119.6 121.3 43.3 -17.8 10.6 95 254 A I E -DF 56 83A 0 -39,-2.6 -39,-2.7 -2,-0.5 2,-0.4 -0.776 17.3-143.1-122.9 171.8 40.1 -16.8 12.3 96 255 A K E -DF 55 82A 46 -14,-2.0 -14,-2.9 -2,-0.3 2,-0.3 -0.996 9.3-169.1-143.4 130.4 39.0 -13.6 14.1 97 256 A I - 0 0 2 -43,-2.0 2,-0.6 -2,-0.4 -16,-0.1 -0.790 22.2-132.9-112.5 161.4 36.8 -12.9 17.1 98 257 A D + 0 0 129 -18,-0.4 2,-0.4 -2,-0.3 -44,-0.1 -0.746 37.1 164.1-115.1 78.2 35.5 -9.5 18.4 99 258 A H - 0 0 45 -2,-0.6 2,-0.6 -46,-0.2 4,-0.1 -0.818 40.1-122.4 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