==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 14-NOV-03 1RHM . COMPND 2 MOLECULE: CASP-3; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.W.BECKER,J.ROTONDA,S.M.SOISSON . 462 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18697.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 333 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 68 14.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 38 8.2 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 . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.6 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 . 42 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 50 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 108 23.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 1 0 3 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 0 0 2 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 PARALLEL BRIDGES PER LADDER . 4 2 1 4 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 . 2 1 0 0 0 0 0 0 0 0 1 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 1 150 A D 0 0 174 0, 0.0 4,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 109.6 -84.4 22.3 90.1 2 151 A N + 0 0 59 2,-0.1 226,-3.1 225,-0.1 2,-0.4 0.084 360.0 79.6-120.4 15.1 -82.3 25.3 89.1 3 152 A S B S-a 228 0A 33 224,-0.3 226,-0.2 226,-0.0 3,-0.0 -0.975 88.4-105.3-127.7 137.1 -79.5 24.2 91.4 4 153 A Y - 0 0 10 224,-2.6 2,-0.7 -2,-0.4 226,-0.2 -0.249 38.5-106.5 -59.9 148.0 -76.9 21.4 90.7 5 154 A K + 0 0 112 1,-0.1 3,-0.2 74,-0.1 -1,-0.1 -0.679 46.2 165.0 -79.9 115.2 -77.3 18.2 92.6 6 155 A M + 0 0 17 -2,-0.7 -1,-0.1 1,-0.1 73,-0.1 0.213 49.0 94.0-114.8 12.5 -74.6 18.1 95.3 7 156 A D + 0 0 120 72,-0.1 -1,-0.1 4,-0.0 4,-0.1 0.075 52.9 127.0 -95.1 26.9 -76.0 15.3 97.4 8 156AA Y S S- 0 0 72 -3,-0.2 70,-0.1 2,-0.1 69,-0.1 -0.116 81.5 -92.3 -68.5 177.4 -73.9 12.5 95.7 9 161 A P S S+ 0 0 105 0, 0.0 2,-0.3 0, 0.0 69,-0.2 0.921 108.7 20.3 -61.3 -41.6 -71.8 10.3 98.0 10 162 A E E -b 78 0B 74 67,-2.3 69,-2.3 1,-0.1 70,-0.2 -0.970 69.4-130.4-132.7 147.9 -68.8 12.5 97.6 11 162AA M E - 0 0 35 38,-0.7 69,-1.3 -2,-0.3 2,-0.2 0.770 60.5-119.7 -62.3 -29.0 -68.2 16.1 96.6 12 163 A G E -b 80 0B 1 37,-0.3 39,-2.3 67,-0.2 -1,-0.2 -0.666 37.4 -38.2 120.4-176.8 -65.5 15.1 94.1 13 164 A L E -bc 81 51B 0 67,-0.6 69,-1.4 -2,-0.2 2,-0.3 -0.411 33.8-163.8 -85.0 161.0 -61.8 15.6 93.4 14 165 A C E -bc 82 52B 0 37,-1.2 39,-2.1 67,-0.2 2,-0.5 -0.781 11.3-167.6-145.4 92.3 -59.8 18.8 93.8 15 166 A I E -bc 83 53B 1 67,-2.3 69,-3.4 -2,-0.3 2,-0.6 -0.748 1.5-164.7 -86.3 129.3 -56.5 18.5 92.0 16 167 A I E -bc 84 54B 0 37,-2.4 39,-1.7 -2,-0.5 2,-0.7 -0.914 2.6-166.7-117.3 102.7 -54.1 21.3 92.9 17 168 A I E -bc 85 55B 2 67,-3.0 69,-2.0 -2,-0.6 2,-0.6 -0.819 10.2-175.5 -90.1 119.4 -51.2 21.6 90.4 18 169 A N E -bc 86 56B 0 37,-2.5 39,-1.8 -2,-0.7 2,-0.7 -0.895 5.6-173.6-121.2 100.4 -48.6 23.9 92.1 19 170 A N + 0 0 1 67,-2.6 3,-0.1 -2,-0.6 37,-0.1 -0.844 19.9 152.2 -98.7 114.3 -45.6 24.8 90.0 20 171 A K + 0 0 56 -2,-0.7 11,-1.9 1,-0.2 2,-0.5 0.789 60.4 47.9-106.3 -42.9 -43.0 26.7 92.0 21 172 A N - 0 0 73 9,-0.2 2,-0.3 10,-0.1 -1,-0.2 -0.890 66.0-163.9-110.9 131.4 -39.7 25.9 90.3 22 173 A F - 0 0 22 -2,-0.5 76,-0.2 6,-0.3 75,-0.1 -0.781 31.4 -92.6-112.2 153.8 -39.1 26.1 86.5 23 174 A H >> - 0 0 87 74,-3.6 3,-2.1 -2,-0.3 4,-0.7 -0.318 33.1-121.0 -61.5 143.3 -36.3 24.6 84.4 24 175 A K G >4 S+ 0 0 201 1,-0.3 3,-1.2 2,-0.2 -1,-0.1 0.860 111.9 68.0 -52.3 -36.4 -33.4 27.0 83.8 25 175AA S G 34 S+ 0 0 119 1,-0.3 -1,-0.3 2,-0.1 73,-0.1 0.715 96.6 52.0 -57.7 -25.1 -34.3 26.6 80.1 26 175BA T G <4 S- 0 0 28 -3,-2.1 -1,-0.3 71,-0.3 -2,-0.2 0.686 95.2-141.3 -87.1 -20.0 -37.6 28.5 80.5 27 175CA G << + 0 0 59 -3,-1.2 2,-0.2 -4,-0.7 -3,-0.1 0.507 50.8 143.5 72.7 2.9 -36.0 31.5 82.2 28 176 A M - 0 0 68 -5,-0.5 -6,-0.3 69,-0.1 -1,-0.2 -0.521 46.5-126.5 -77.7 142.9 -39.0 31.7 84.6 29 177 A T - 0 0 103 -2,-0.2 -1,-0.1 1,-0.1 2,-0.1 -0.467 34.4 -83.7 -86.9 160.2 -38.3 32.8 88.2 30 178 A S - 0 0 66 -2,-0.1 2,-1.4 1,-0.1 -9,-0.2 -0.356 37.1-127.0 -63.8 138.9 -39.4 30.9 91.3 31 179 A R > - 0 0 20 -11,-1.9 3,-2.3 55,-0.1 4,-0.2 -0.518 28.0-160.0 -91.6 72.0 -43.0 31.6 92.4 32 180 A S T 3 S+ 0 0 61 -2,-1.4 136,-0.1 1,-0.3 134,-0.1 -0.237 75.3 26.8 -53.6 126.2 -42.4 32.5 96.1 33 181 A G T >> S+ 0 0 6 133,-0.1 4,-1.7 134,-0.1 3,-0.6 0.114 82.8 114.8 106.5 -19.9 -45.6 32.2 98.1 34 182 A T H <> S+ 0 0 0 -3,-2.3 4,-2.6 1,-0.3 -2,-0.1 0.811 74.9 56.2 -52.8 -31.7 -47.1 29.5 95.9 35 183 A D H 3> S+ 0 0 75 2,-0.2 4,-2.7 -4,-0.2 5,-0.3 0.905 101.4 54.7 -68.6 -41.3 -46.8 27.1 98.9 36 184 A V H <> S+ 0 0 64 -3,-0.6 4,-2.2 1,-0.2 -1,-0.2 0.912 112.2 45.7 -58.1 -40.8 -48.9 29.4 101.1 37 185 A D H X S+ 0 0 0 -4,-1.7 4,-2.9 2,-0.2 5,-0.3 0.955 109.7 53.8 -64.9 -50.7 -51.6 29.3 98.4 38 186 A A H X S+ 0 0 7 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.870 114.1 41.4 -51.8 -43.0 -51.3 25.5 98.0 39 187 A A H X S+ 0 0 59 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.889 111.6 55.7 -73.7 -39.8 -51.8 24.9 101.7 40 188 A N H X S+ 0 0 38 -4,-2.2 4,-1.9 -5,-0.3 -2,-0.2 0.912 112.7 42.8 -57.5 -46.3 -54.6 27.6 102.0 41 189 A L H X S+ 0 0 0 -4,-2.9 4,-3.0 2,-0.2 5,-0.4 0.929 109.0 57.1 -66.8 -47.7 -56.5 25.8 99.2 42 190 A R H X S+ 0 0 121 -4,-2.0 4,-1.7 -5,-0.3 -2,-0.2 0.931 111.8 43.2 -49.6 -50.1 -55.9 22.3 100.5 43 191 A E H X S+ 0 0 79 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.902 113.4 50.9 -63.6 -44.7 -57.5 23.3 103.8 44 192 A T H X S+ 0 0 4 -4,-1.9 4,-1.2 1,-0.2 -2,-0.2 0.926 114.9 40.7 -61.4 -49.3 -60.4 25.2 102.3 45 193 A F H <>S+ 0 0 3 -4,-3.0 5,-2.7 2,-0.2 -1,-0.2 0.788 110.0 60.1 -73.8 -24.3 -61.5 22.4 100.0 46 194 A R H ><5S+ 0 0 135 -4,-1.7 3,-1.8 -5,-0.4 -2,-0.2 0.936 105.8 48.3 -65.4 -44.4 -60.8 19.8 102.7 47 195 A N H 3<5S+ 0 0 80 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.811 105.7 57.6 -64.8 -28.6 -63.4 21.6 104.8 48 196 A L T 3<5S- 0 0 27 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.299 123.4-109.7 -83.6 10.3 -65.8 21.6 101.8 49 197 A K T < 5 + 0 0 159 -3,-1.8 -38,-0.7 1,-0.2 -37,-0.3 0.762 66.9 148.6 68.4 31.2 -65.4 17.8 101.9 50 198 A Y < - 0 0 10 -5,-2.7 2,-1.6 -39,-0.2 -1,-0.2 -0.681 55.9-119.2 -94.9 150.3 -63.3 17.5 98.7 51 199 A E E -c 13 0B 88 -39,-2.3 -37,-1.2 -2,-0.3 2,-0.1 -0.670 41.6-157.9 -87.3 84.8 -60.7 14.7 98.2 52 200 A V E -c 14 0B 25 -2,-1.6 2,-0.4 -39,-0.2 -37,-0.2 -0.377 16.1-176.8 -68.6 139.0 -57.8 17.1 97.8 53 201 A R E -c 15 0B 73 -39,-2.1 -37,-2.4 -2,-0.1 2,-0.3 -0.988 10.3-155.2-136.7 124.7 -54.6 15.9 95.9 54 202 A N E -c 16 0B 40 -2,-0.4 2,-0.3 -39,-0.2 -37,-0.2 -0.713 11.0-178.0-102.0 153.8 -51.5 18.1 95.6 55 203 A K E -c 17 0B 93 -39,-1.7 -37,-2.5 -2,-0.3 2,-0.4 -0.986 9.7-154.8-146.6 143.3 -48.8 17.9 93.0 56 204 A N E -c 18 0B 89 -2,-0.3 -37,-0.2 1,-0.2 -39,-0.1 -0.962 59.5 -7.0-131.8 145.4 -45.7 20.0 92.6 57 205 A D S S+ 0 0 54 -39,-1.8 2,-0.3 -2,-0.4 -1,-0.2 0.908 74.5 176.1 42.4 64.4 -43.4 21.2 89.9 58 206 A L - 0 0 19 -3,-0.1 39,-2.4 1,-0.1 40,-0.2 -0.692 27.2-123.4 -94.9 149.7 -44.9 19.1 87.1 59 207 A T > - 0 0 25 37,-0.3 4,-2.3 -2,-0.3 5,-0.2 -0.361 31.8-103.0 -82.4 170.6 -43.6 19.3 83.5 60 208 A R H > S+ 0 0 93 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.943 124.5 50.1 -61.3 -45.7 -46.0 20.2 80.7 61 209 A E H > S+ 0 0 100 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.900 109.8 52.4 -57.9 -41.1 -46.1 16.5 79.6 62 210 A E H > S+ 0 0 78 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.910 106.1 52.3 -62.4 -43.4 -46.8 15.5 83.1 63 211 A I H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.913 111.6 45.7 -60.1 -45.0 -49.7 17.9 83.5 64 212 A V H X S+ 0 0 11 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.945 113.8 49.5 -63.3 -47.6 -51.4 16.6 80.4 65 213 A E H X S+ 0 0 112 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.884 111.8 48.6 -57.4 -43.7 -50.8 13.0 81.4 66 214 A L H X S+ 0 0 27 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.910 113.2 46.4 -64.2 -45.0 -52.2 13.6 84.9 67 215 A M H X S+ 0 0 0 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.878 110.3 53.9 -65.5 -39.1 -55.3 15.3 83.6 68 216 A R H X S+ 0 0 108 -4,-2.8 4,-0.9 -5,-0.2 3,-0.2 0.944 111.9 45.4 -60.0 -47.4 -55.8 12.5 81.0 69 217 A D H X S+ 0 0 77 -4,-2.3 4,-0.5 1,-0.2 3,-0.5 0.874 108.2 55.2 -64.2 -42.0 -55.7 9.9 83.9 70 218 A V H < S+ 0 0 2 -4,-2.4 3,-0.4 1,-0.2 -1,-0.2 0.819 107.7 50.8 -63.1 -31.0 -58.0 11.8 86.2 71 219 A S H < S+ 0 0 10 -4,-1.5 46,-0.3 -3,-0.2 -1,-0.2 0.719 103.2 57.6 -79.7 -22.5 -60.7 12.0 83.5 72 220 A K H < S+ 0 0 159 -4,-0.9 -1,-0.2 -3,-0.5 -2,-0.2 0.553 90.1 97.0 -83.7 -6.7 -60.5 8.2 82.8 73 221 A E S < S- 0 0 57 -4,-0.5 2,-0.6 -3,-0.4 44,-0.2 -0.383 88.9-102.5 -74.6 160.2 -61.4 7.7 86.5 74 222 A D + 0 0 95 1,-0.1 3,-0.2 -2,-0.1 -1,-0.1 -0.773 37.2 175.5 -92.1 123.1 -65.0 7.0 87.4 75 224 A H > + 0 0 0 -2,-0.6 3,-1.5 1,-0.1 -1,-0.1 0.174 42.2 118.1-110.4 15.3 -66.8 10.0 88.9 76 225 A S T 3 S+ 0 0 55 1,-0.3 -1,-0.1 -68,-0.0 -2,-0.0 0.795 82.1 41.5 -51.0 -37.0 -70.2 8.4 89.1 77 226 A K T 3 S+ 0 0 124 -3,-0.2 -67,-2.3 -69,-0.1 2,-0.3 0.521 102.0 90.3 -91.4 -6.2 -70.3 8.8 92.9 78 227 A R E < -b 10 0B 25 -3,-1.5 -67,-0.2 -69,-0.2 -66,-0.1 -0.694 62.8-153.4 -94.0 143.0 -68.8 12.3 92.8 79 228 A S E S- 0 0 0 -69,-2.3 2,-0.3 -2,-0.3 -67,-0.2 0.785 71.2 -13.2 -83.7 -30.8 -70.9 15.5 92.6 80 229 A S E -b 12 0B 0 -69,-1.3 -67,-0.6 -70,-0.2 2,-0.4 -0.920 58.5-120.4-158.2-178.9 -68.3 17.7 90.9 81 230 A F E -bd 13 123B 0 41,-2.0 43,-2.7 -2,-0.3 2,-0.4 -0.996 19.3-171.2-137.1 140.1 -64.7 18.2 89.8 82 231 A V E -bd 14 124B 0 -69,-1.4 -67,-2.3 -2,-0.4 2,-0.4 -0.985 4.2-179.6-138.9 127.2 -62.2 20.9 90.8 83 232 A C E -bd 15 125B 0 41,-2.5 43,-2.3 -2,-0.4 2,-0.4 -0.985 6.8-166.6-128.4 123.7 -58.8 21.6 89.4 84 233 A V E -bd 16 126B 0 -69,-3.4 -67,-3.0 -2,-0.4 2,-0.4 -0.883 3.0-164.3-109.6 139.9 -56.6 24.5 90.6 85 234 A L E -bd 17 127B 5 41,-2.6 43,-2.7 -2,-0.4 2,-0.5 -0.988 6.7-176.0-125.6 132.2 -53.5 25.6 88.7 86 235 A L E +bd 18 128B 1 -69,-2.0 -67,-2.6 -2,-0.4 2,-0.3 -0.953 40.0 93.5-129.0 109.7 -50.8 27.8 90.1 87 236 A S S S- 0 0 7 41,-2.0 43,-0.3 -2,-0.5 2,-0.1 -0.943 72.0 -67.4-170.8-171.6 -48.1 28.8 87.7 88 237 A H + 0 0 41 -2,-0.3 7,-2.0 7,-0.2 2,-0.3 -0.303 62.3 130.6 -84.8 177.2 -46.6 31.2 85.2 89 238 A G - 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