==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/RECEPTOR 03-NOV-08 2W2Q . COMPND 2 MOLECULE: PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.J.BOTTOMLEY,A.CIRILLO,L.ORSATTI,L.RUGGERI,T.S.FISHER,J.C.S . 414 5 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18339.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 278 67.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 41 9.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 54 13.0 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 . 3 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 33 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 88 21.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 0 1 1 0 0 0 0 2 1 0 0 0 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 2 4 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 . 1 4 2 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 2 1 1 1 0 0 0 0 1 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 1 153 A S 0 0 100 0, 0.0 291,-0.1 0, 0.0 287,-0.1 0.000 360.0 360.0 360.0-164.8 -3.2 -3.6 9.9 2 154 A I - 0 0 76 67,-0.0 5,-0.1 291,-0.0 67,-0.1 -0.996 360.0 -89.5-133.8 137.7 -5.0 -2.6 13.2 3 155 A P >> - 0 0 3 0, 0.0 4,-1.8 0, 0.0 3,-1.0 -0.138 32.9-125.1 -47.4 135.3 -8.3 -4.2 14.3 4 156 A W H 3> S+ 0 0 52 1,-0.2 4,-2.0 193,-0.2 194,-0.1 0.799 107.7 56.2 -50.9 -34.2 -11.4 -2.2 13.1 5 157 A N H 3> S+ 0 0 1 192,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.786 105.2 47.2 -75.5 -32.9 -12.7 -1.8 16.6 6 158 A L H <> S+ 0 0 10 -3,-1.0 4,-0.6 2,-0.2 -1,-0.2 0.842 113.3 51.0 -76.0 -36.7 -9.6 -0.1 18.1 7 159 A E H >< S+ 0 0 113 -4,-1.8 3,-0.9 1,-0.2 -2,-0.2 0.919 107.1 54.9 -59.6 -46.9 -9.6 2.2 15.1 8 160 A R H 3< S+ 0 0 91 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.784 109.2 45.0 -62.7 -33.3 -13.3 3.0 15.7 9 161 A I H 3< S+ 0 0 2 -4,-1.1 265,-3.4 264,-0.1 -1,-0.2 0.557 96.1 87.4 -88.7 -10.3 -12.8 4.1 19.3 10 162 A T S << S- 0 0 80 -3,-0.9 -1,-0.0 -4,-0.6 263,-0.0 -0.840 78.2-137.2 -94.4 111.5 -9.7 6.2 18.5 11 163 A P - 0 0 29 0, 0.0 266,-0.2 0, 0.0 -2,-0.1 -0.349 16.9-117.2 -69.8 146.5 -10.8 9.7 17.5 12 164 A P 0 0 148 0, 0.0 -2,-0.0 0, 0.0 265,-0.0 0.879 360.0 360.0 -47.4 -48.1 -9.1 11.4 14.5 13 165 A R 0 0 88 264,-0.1 264,-0.3 263,-0.0 -3,-0.0 0.779 360.0 360.0 -84.3 360.0 -7.7 14.3 16.7 14 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 15 178 A S 0 0 138 0, 0.0 216,-0.1 0, 0.0 61,-0.1 0.000 360.0 360.0 360.0 -56.8 -0.8 3.3 36.8 16 179 A L + 0 0 120 215,-0.2 2,-0.2 214,-0.2 215,-0.1 0.570 360.0 109.8 -84.8 -10.5 -3.0 3.2 39.9 17 180 A V - 0 0 11 94,-0.2 59,-0.5 210,-0.1 2,-0.4 -0.443 48.6-164.9 -71.8 134.3 -6.0 1.7 38.0 18 181 A E E -a 113 0A 31 94,-2.3 96,-2.6 -2,-0.2 2,-0.5 -0.980 3.3-158.6-117.2 134.4 -7.1 -1.8 38.8 19 182 A V E -ab 114 77A 1 57,-1.5 59,-2.7 -2,-0.4 2,-0.4 -0.961 6.3-159.0-114.0 118.2 -9.5 -3.7 36.5 20 183 A Y E -ab 115 78A 4 94,-3.3 96,-3.5 -2,-0.5 2,-0.5 -0.806 2.6-162.6 -96.0 135.4 -11.4 -6.6 37.9 21 184 A L E -ab 116 79A 0 57,-2.6 59,-3.3 -2,-0.4 2,-0.7 -0.977 7.3-168.7-118.8 118.9 -12.9 -9.3 35.6 22 185 A L E + b 0 80A 0 94,-2.0 2,-0.2 -2,-0.5 59,-0.2 -0.932 50.3 98.1-101.5 108.5 -15.6 -11.7 36.8 23 186 A D E S- b 0 81A 0 57,-2.2 59,-2.5 -2,-0.7 60,-1.6 -0.668 75.0 -38.5-159.3-154.1 -15.8 -14.3 34.1 24 187 A T S S- 0 0 3 1,-0.2 -1,-0.3 -2,-0.2 30,-0.1 -0.059 79.5 -69.1 -71.0-178.3 -14.6 -17.7 33.2 25 188 A S - 0 0 30 28,-0.5 32,-0.5 58,-0.3 33,-0.4 -0.341 56.8-143.8 -64.5 161.6 -11.1 -19.0 33.9 26 189 A I - 0 0 14 31,-0.2 2,-1.3 -3,-0.1 3,-0.1 -0.948 19.3-120.6-132.2 150.0 -8.4 -17.3 31.9 27 190 A Q > - 0 0 31 27,-0.4 3,-1.7 -2,-0.3 6,-0.2 -0.768 36.0-176.1 -87.9 90.2 -5.1 -18.4 30.2 28 191 A S T 3 S+ 0 0 46 -2,-1.3 7,-0.3 1,-0.3 9,-0.3 0.694 74.2 58.1 -67.7 -22.0 -3.1 -15.9 32.3 29 192 A D T 3 S+ 0 0 81 5,-0.2 -1,-0.3 -3,-0.1 5,-0.1 0.296 73.2 130.7 -93.4 10.1 0.2 -16.7 30.5 30 193 A H S X> S- 0 0 0 -3,-1.7 4,-2.8 1,-0.1 3,-1.6 -0.391 72.0-116.1 -58.6 140.4 -1.1 -15.8 27.1 31 194 A R T 34 S+ 0 0 62 175,-2.8 36,-0.1 1,-0.3 -1,-0.1 0.791 112.8 59.1 -51.2 -33.8 1.4 -13.5 25.3 32 195 A E T 34 S+ 0 0 4 174,-0.3 35,-1.5 1,-0.2 -1,-0.3 0.798 125.8 13.0 -64.4 -33.5 -1.3 -10.7 25.3 33 196 A I T X> S+ 0 0 1 -3,-1.6 3,-2.6 -6,-0.2 4,-1.4 0.433 84.3 140.1-128.8 -7.9 -1.7 -10.6 29.0 34 197 A E T 3< S+ 0 0 127 -4,-2.8 -5,-0.2 1,-0.3 4,-0.1 -0.149 82.0 5.8 -49.0 130.9 1.1 -12.6 30.6 35 198 A G T 34 S+ 0 0 73 -7,-0.3 -1,-0.3 2,-0.3 3,-0.1 0.454 122.3 74.2 73.7 3.1 2.4 -10.9 33.7 36 199 A R T <4 S+ 0 0 118 -3,-2.6 41,-2.3 -8,-0.3 2,-0.6 0.651 83.7 60.8-120.1 -27.4 -0.3 -8.3 33.6 37 200 A V E < S-c 77 0A 10 -4,-1.4 2,-0.5 -9,-0.3 -2,-0.3 -0.941 70.8-152.4-107.2 117.5 -3.4 -10.2 34.7 38 201 A M E -c 78 0A 88 39,-3.1 41,-2.5 -2,-0.6 2,-0.8 -0.778 10.2-140.0 -86.2 126.0 -3.3 -11.6 38.2 39 202 A V E -c 79 0A 78 -2,-0.5 41,-0.1 39,-0.2 39,-0.1 -0.810 21.2-150.8 -85.6 110.6 -5.5 -14.7 38.8 40 203 A T E - 0 0 12 39,-1.9 41,-0.1 -2,-0.8 38,-0.0 -0.273 23.8-112.6 -72.1 167.0 -7.1 -14.4 42.2 41 204 A D E S+ 0 0 143 39,-0.1 2,-0.3 -2,-0.0 -1,-0.1 0.501 77.4 122.5 -79.4 -3.8 -8.0 -17.4 44.3 42 205 A F E + 0 0 24 37,-0.2 39,-2.2 55,-0.1 2,-0.3 -0.445 29.0 158.7 -69.2 124.1 -11.7 -16.6 44.0 43 206 A E E +c 81 0A 121 -2,-0.3 2,-0.3 37,-0.2 39,-0.2 -0.927 9.1 154.2-145.2 118.0 -13.8 -19.4 42.4 44 207 A N + 0 0 54 37,-2.4 46,-0.3 -2,-0.3 53,-0.1 -0.781 24.6 145.9-139.8 97.7 -17.6 -19.8 42.7 45 208 A V - 0 0 39 -2,-0.3 44,-0.1 44,-0.1 38,-0.1 -0.958 43.4-115.9-131.2 148.0 -19.1 -21.7 39.8 46 209 A P - 0 0 32 0, 0.0 2,-0.1 0, 0.0 42,-0.1 -0.393 46.6 -84.0 -73.4 161.4 -21.9 -24.2 39.2 47 210 A E - 0 0 163 1,-0.1 2,-0.1 -2,-0.1 37,-0.1 -0.418 48.5-107.2 -62.2 134.0 -21.4 -27.8 38.1 48 211 A E 0 0 80 1,-0.1 -1,-0.1 -2,-0.1 -3,-0.0 -0.443 360.0 360.0 -61.0 134.2 -21.1 -28.3 34.3 49 212 A D 0 0 133 -2,-0.1 -1,-0.1 -3,-0.1 -2,-0.0 0.673 360.0 360.0-113.2 360.0 -24.2 -29.9 32.9 50 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 51 221 A S 0 0 96 0, 0.0 152,-0.2 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 -49.1 -8.6 -24.4 26.6 52 222 A K > + 0 0 159 2,-0.2 3,-0.8 1,-0.1 4,-0.4 0.758 360.0 62.4 -88.3 -31.1 -12.3 -24.1 25.9 53 223 A a T 3 S+ 0 0 37 1,-0.2 -28,-0.5 2,-0.1 4,-0.3 0.840 110.9 39.8 -58.4 -35.1 -13.1 -23.2 29.6 54 224 A D T 3> S+ 0 0 29 1,-0.1 4,-2.7 -30,-0.1 -27,-0.4 0.419 85.0 98.3 -99.5 2.0 -11.0 -20.1 29.3 55 225 A S H <> S+ 0 0 24 -3,-0.8 4,-2.0 1,-0.2 5,-0.2 0.925 86.1 45.3 -56.5 -50.1 -11.9 -18.9 25.8 56 226 A H H > S+ 0 0 23 -4,-0.4 4,-1.8 1,-0.2 -1,-0.2 0.950 119.8 38.1 -60.2 -55.0 -14.4 -16.3 27.0 57 227 A G H > S+ 0 0 0 -32,-0.5 4,-2.2 -4,-0.3 -1,-0.2 0.844 114.1 54.4 -67.6 -38.0 -12.4 -14.7 29.8 58 228 A T H X S+ 0 0 0 -4,-2.7 4,-1.8 -33,-0.4 143,-0.3 0.896 109.7 48.2 -62.4 -41.8 -9.0 -14.9 28.0 59 229 A H H X S+ 0 0 0 -4,-2.0 4,-2.2 -5,-0.3 142,-0.4 0.907 112.8 47.5 -65.2 -44.1 -10.5 -13.0 25.0 60 230 A L H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.859 108.2 53.9 -68.2 -38.9 -12.0 -10.3 27.2 61 231 A A H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 5,-0.3 0.908 111.2 49.1 -57.6 -42.0 -8.8 -9.9 29.2 62 232 A G H X S+ 0 0 0 -4,-1.8 4,-2.6 3,-0.2 -2,-0.2 0.890 107.0 53.3 -63.0 -45.1 -7.1 -9.3 25.8 63 233 A V H < S+ 0 0 0 -4,-2.2 8,-2.5 1,-0.2 9,-0.2 0.899 116.0 40.5 -58.7 -43.6 -9.7 -6.8 24.6 64 234 A V H < S- 0 0 0 -4,-2.1 8,-3.3 6,-0.2 -2,-0.2 0.949 140.8 -1.0 -68.9 -50.3 -9.2 -4.7 27.8 65 235 A S H < S+ 0 0 2 -4,-2.6 -3,-0.2 6,-0.2 -2,-0.2 0.352 80.2 142.8-133.6 3.4 -5.4 -5.0 28.2 66 236 A G X - 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0 0 0 4,-2.7 3,-1.8 -2,-0.4 -59,-0.1 0.096 44.3 -76.4 -75.7-168.6 -17.9 -22.5 34.5 85 255 A a T 3 S+ 0 0 43 1,-0.3 -30,-0.1 2,-0.1 -1,-0.1 0.754 133.7 51.2 -66.3 -24.5 -16.5 -24.2 31.4 86 256 A Q T 3 S- 0 0 101 2,-0.1 -1,-0.3 -62,-0.0 331,-0.1 0.310 123.5-104.7 -91.8 6.3 -19.9 -23.7 29.5 87 257 A G S < S+ 0 0 9 -3,-1.8 330,-2.5 1,-0.2 2,-0.4 0.745 76.9 138.3 77.3 26.2 -19.9 -20.0 30.4 88 258 A K E +J 416 0B 48 328,-0.2 -4,-2.7 -42,-0.1 -1,-0.2 -0.879 21.2 161.0-112.8 133.2 -22.5 -20.5 33.2 89 259 A G E -J 415 0B 0 326,-3.1 326,-2.2 -2,-0.4 2,-0.3 -0.686 29.6-115.0-130.6-173.9 -22.7 -18.9 36.6 90 260 A T E > -J 414 0B 12 -8,-0.5 4,-1.6 -46,-0.3 324,-0.2 -0.867 20.3-124.2-122.3 158.8 -25.1 -18.1 39.4 91 261 A V H > S+ 0 0 2 322,-2.4 4,-2.5 -2,-0.3 5,-0.1 0.927 114.4 50.9 -61.9 -44.5 -26.4 -14.8 40.9 92 262 A S H > S+ 0 0 6 321,-0.3 4,-2.3 2,-0.2 5,-0.2 0.907 109.2 48.7 -63.8 -45.5 -25.1 -16.0 44.4 93 263 A G H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.873 112.3 50.0 -58.8 -40.8 -21.6 -16.8 43.1 94 264 A T H X S+ 0 0 0 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.877 109.2 51.9 -65.1 -39.5 -21.5 -13.4 41.4 95 265 A L H X S+ 0 0 3 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.901 110.3 47.7 -60.3 -45.0 -22.7 -11.8 44.7 96 266 A I H X S+ 0 0 16 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.836 111.0 52.8 -66.5 -35.2 -19.9 -13.5 46.7 97 267 A G H X S+ 0 0 0 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.927 109.6 47.0 -63.0 -48.1 -17.4 -12.4 43.9 98 268 A L H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.840 110.6 53.6 -62.7 -35.7 -18.5 -8.8 44.2 99 269 A E H X S+ 0 0 4 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.875 105.4 53.9 -64.4 -39.6 -18.2 -9.2 48.0 100 270 A F H X S+ 0 0 53 -4,-1.9 4,-1.5 1,-0.2 -2,-0.2 0.843 109.0 49.4 -60.8 -37.0 -14.6 -10.5 47.5 101 271 A I H X S+ 0 0 0 -4,-1.6 4,-2.8 2,-0.2 5,-0.2 0.908 104.4 57.1 -70.1 -44.6 -13.8 -7.3 45.5 102 272 A R H < S+ 0 0 36 -4,-2.1 4,-0.4 1,-0.2 -2,-0.2 0.906 108.5 48.0 -51.8 -46.4 -15.3 -5.0 48.1 103 273 A K H >X S+ 0 0 75 -4,-1.7 4,-1.7 1,-0.2 3,-1.0 0.882 110.0 51.8 -60.2 -42.6 -12.8 -6.5 50.6 104 274 A S H 3X S+ 0 0 11 -4,-1.5 4,-2.0 1,-0.3 -2,-0.2 0.902 99.9 62.4 -61.7 -43.9 -9.9 -6.0 48.1 105 275 A Q H 3< S+ 0 0 39 -4,-2.8 -1,-0.3 1,-0.2 -2,-0.2 0.688 115.4 35.1 -52.8 -20.0 -10.9 -2.4 47.7 106 276 A L H <4 S+ 0 0 109 -3,-1.0 -2,-0.2 -4,-0.4 -1,-0.2 0.657 114.8 54.5-107.9 -24.3 -10.0 -2.1 51.4 107 277 A V H < S+ 0 0 108 -4,-1.7 -3,-0.2 1,-0.2 -2,-0.2 0.951 123.1 21.3 -78.3 -53.8 -7.1 -4.6 51.7 108 278 A Q S < S- 0 0 91 -4,-2.0 -1,-0.2 -5,-0.1 2,-0.1 -0.683 105.4-148.6-114.6 76.9 -4.8 -3.2 49.0 109 279 A P + 0 0 79 0, 0.0 2,-0.1 0, 0.0 -3,-0.1 -0.461 32.3 15.6 -96.0 168.4 -6.0 0.5 48.6 110 280 A V + 0 0 136 1,-0.2 -2,-0.0 -5,-0.2 -3,-0.0 0.162 61.5 92.9-102.5-112.1 -6.5 2.9 47.1 111 281 A G S S- 0 0 27 -2,-0.1 -1,-0.2 -94,-0.1 -94,-0.2 0.115 79.0 -56.1 90.3 154.2 -6.6 3.6 43.3 112 282 A P - 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