==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 23-NOV-01 1GQF . COMPND 2 CHAIN: A, B . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.RIEDL,W.BODE,P.FUENTES-PRIOR . 528 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30078.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 315 59.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 66 12.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 27 5.1 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 . 4 0.8 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 . 1 0.2 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 . 47 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 106 20.1 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+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 2 0 0 0 0 0 0 5 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 0 0 0 2 5 0 1 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 1 3 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 1 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 1 140 A S 0 0 145 0, 0.0 2,-0.4 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 164.5 -12.2 32.8 -5.3 2 141 A I + 0 0 118 1,-0.3 0, 0.0 0, 0.0 0, 0.0 -0.936 360.0 1.5-116.2 134.5 -13.8 36.3 -5.7 3 142 A K S S+ 0 0 184 -2,-0.4 2,-0.5 1,-0.2 -1,-0.3 0.980 72.5 171.1 56.1 84.8 -16.8 37.6 -3.7 4 143 A T + 0 0 92 -3,-0.2 -1,-0.2 1,-0.0 2,-0.2 -0.892 14.9 143.9-130.6 102.6 -17.7 34.7 -1.4 5 144 A T + 0 0 135 -2,-0.5 2,-0.1 1,-0.1 -1,-0.0 -0.592 38.3 96.3-138.5 74.3 -20.3 35.4 1.3 6 145 A R + 0 0 235 -2,-0.2 2,-0.3 2,-0.1 -1,-0.1 -0.499 52.1 97.3-162.5 82.9 -22.5 32.3 1.9 7 146 A D S S- 0 0 112 -2,-0.1 2,-0.2 -3,-0.0 -3,-0.0 -0.977 75.0 -84.4-167.5 155.0 -21.5 30.0 4.7 8 147 A R - 0 0 244 -2,-0.3 3,-0.2 1,-0.0 -2,-0.1 -0.478 51.5-132.4 -64.5 127.8 -22.3 29.1 8.3 9 148 A V - 0 0 103 -2,-0.2 -1,-0.0 1,-0.2 -2,-0.0 -0.880 52.2 -0.4-138.0 109.6 -20.2 31.4 10.5 10 149 A P + 0 0 47 0, 0.0 3,-0.4 0, 0.0 -1,-0.2 0.710 24.2 147.9-165.8 179.7 -18.7 30.0 12.6 11 150 A T S S+ 0 0 108 -3,-0.2 4,-0.1 1,-0.2 -2,-0.1 -0.001 91.2 86.5-102.7 25.4 -17.2 27.6 15.1 12 151 A Y S S+ 0 0 97 2,-0.1 240,-1.9 239,-0.1 2,-0.4 0.067 73.8 80.0-111.5 20.5 -14.2 30.0 15.1 13 152 A Q B S-a 252 0A 71 -3,-0.4 240,-0.2 238,-0.3 2,-0.1 -0.981 86.3-103.6-132.6 142.2 -15.5 32.3 17.8 14 153 A Y - 0 0 12 238,-2.5 2,-0.3 -2,-0.4 240,-0.3 -0.420 46.8-107.9 -60.8 131.7 -15.5 32.1 21.6 15 154 A N + 0 0 96 1,-0.2 -1,-0.1 -2,-0.1 242,-0.1 -0.465 37.8 177.5 -65.0 119.8 -19.0 31.2 22.8 16 155 A M + 0 0 22 -2,-0.3 2,-2.0 240,-0.1 -1,-0.2 0.458 41.9 119.5-103.3 -1.9 -20.7 34.2 24.4 17 156 A N + 0 0 131 72,-0.1 2,-0.3 240,-0.1 71,-0.1 -0.440 46.6 124.6 -66.2 84.1 -24.0 32.5 25.1 18 156AA F S S- 0 0 59 -2,-2.0 71,-0.1 1,-0.1 69,-0.1 -0.979 76.8-109.4-145.2 156.4 -23.8 32.9 28.9 19 161 A E S S+ 0 0 158 -2,-0.3 2,-0.3 1,-0.1 69,-0.2 0.883 106.5 10.3 -51.4 -41.2 -25.9 34.3 31.7 20 162 A K B -b 88 0B 99 67,-1.6 69,-1.8 1,-0.1 70,-0.2 -0.977 68.6-125.9-140.7 154.3 -23.3 37.1 32.0 21 162AA L - 0 0 21 38,-0.7 69,-2.3 -2,-0.3 2,-0.2 0.917 68.1-106.1 -62.3 -43.5 -20.3 38.4 30.1 22 163 A G - 0 0 1 37,-0.5 39,-2.7 67,-0.2 -1,-0.2 -0.804 38.5 -52.4 141.2 179.2 -18.2 38.0 33.2 23 164 A K E -c 61 0C 34 67,-0.4 69,-2.3 -2,-0.2 2,-0.4 -0.591 36.3-158.3 -90.2 151.9 -16.4 40.0 35.9 24 165 A C E -cd 62 92C 0 37,-1.7 39,-1.8 -2,-0.2 2,-0.4 -0.902 5.3-159.5-132.9 103.7 -14.1 42.9 35.3 25 166 A I E -cd 63 93C 2 67,-2.1 69,-3.3 -2,-0.4 2,-0.5 -0.700 5.8-168.1 -84.7 130.0 -11.7 43.8 38.1 26 167 A I E -cd 64 94C 0 37,-2.5 39,-3.2 -2,-0.4 2,-0.8 -0.907 3.8-168.1-122.3 102.5 -10.3 47.3 37.9 27 168 A I E -cd 65 95C 0 67,-2.6 69,-2.0 -2,-0.5 2,-0.7 -0.818 7.5-173.4 -91.3 109.6 -7.3 48.0 40.2 28 169 A N E -cd 66 96C 2 37,-3.3 39,-1.3 -2,-0.8 2,-0.8 -0.780 1.8-176.2-109.7 87.5 -6.9 51.8 40.1 29 170 A N + 0 0 0 67,-1.6 3,-0.1 -2,-0.7 37,-0.1 -0.746 21.2 148.6 -89.5 110.1 -3.7 52.6 42.1 30 171 A K + 0 0 41 -2,-0.8 11,-2.3 1,-0.2 2,-0.5 0.697 62.0 51.3-107.7 -31.3 -3.2 56.4 42.3 31 172 A N - 0 0 74 9,-0.2 2,-0.4 10,-0.0 -1,-0.2 -0.953 62.8-173.3-118.1 126.0 -1.4 56.8 45.7 32 173 A F - 0 0 22 -2,-0.5 76,-0.2 6,-0.3 75,-0.1 -0.905 32.6 -97.2-118.5 145.8 1.7 54.8 46.7 33 174 A D >>> - 0 0 71 74,-3.3 3,-1.4 -2,-0.4 4,-0.6 -0.092 29.3-118.8 -56.1 154.9 3.4 54.7 50.1 34 175 A K G >45S+ 0 0 200 1,-0.3 3,-1.4 2,-0.2 -1,-0.1 0.916 112.9 67.3 -61.4 -44.2 6.4 56.9 50.7 35 175AA V G 345S+ 0 0 147 1,-0.3 -1,-0.3 2,-0.1 -2,-0.1 0.543 97.6 59.8 -54.7 -4.0 8.6 53.9 51.4 36 175BA T G <45S- 0 0 24 -3,-1.4 -1,-0.3 2,-0.1 -2,-0.2 0.805 92.4-144.5 -94.3 -37.6 8.0 53.3 47.6 37 175CA G T <<5 + 0 0 59 -3,-1.4 2,-0.3 -4,-0.6 -3,-0.1 0.539 53.8 133.7 82.2 7.4 9.5 56.4 46.2 38 176 A M < - 0 0 23 -5,-0.6 -1,-0.3 1,-0.1 -6,-0.3 -0.669 51.7-124.1 -93.6 145.9 6.8 56.6 43.5 39 177 A G - 0 0 34 -2,-0.3 2,-0.1 1,-0.1 -1,-0.1 -0.417 36.0 -82.9 -86.9 161.8 4.8 59.7 42.6 40 178 A V - 0 0 71 -2,-0.1 2,-1.2 1,-0.1 -9,-0.2 -0.352 36.4-132.0 -63.0 137.4 1.1 60.2 42.5 41 179 A R > - 0 0 29 -11,-2.3 3,-0.8 -3,-0.1 4,-0.3 -0.750 28.1-167.8 -93.6 92.6 -0.6 59.0 39.3 42 180 A N T 3 S+ 0 0 68 -2,-1.2 148,-0.1 1,-0.2 149,-0.1 -0.334 71.5 27.6 -73.7 163.1 -2.9 61.9 38.3 43 181 A G T 3> S+ 0 0 9 146,-0.2 4,-2.9 145,-0.2 -1,-0.2 0.240 87.8 109.3 70.4 -18.7 -5.5 61.3 35.7 44 182 A T H <> S+ 0 0 0 -3,-0.8 4,-2.8 1,-0.2 5,-0.2 0.807 77.8 53.9 -58.1 -29.3 -5.6 57.6 36.8 45 183 A D H > S+ 0 0 68 -4,-0.3 4,-3.3 2,-0.2 5,-0.3 0.950 106.4 48.6 -70.0 -49.7 -9.0 58.4 38.1 46 184 A K H > S+ 0 0 110 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.948 115.0 48.6 -53.0 -50.4 -10.2 59.8 34.8 47 185 A D H >X S+ 0 0 5 -4,-2.9 4,-2.6 2,-0.2 3,-0.6 0.979 112.7 44.3 -50.5 -70.4 -8.9 56.7 33.3 48 186 A A H 3X S+ 0 0 4 -4,-2.8 4,-2.8 1,-0.3 -2,-0.2 0.864 113.7 51.2 -42.6 -51.5 -10.4 54.2 35.7 49 187 A E H 3X S+ 0 0 112 -4,-3.3 4,-2.3 1,-0.2 -1,-0.3 0.908 111.8 47.3 -56.6 -43.2 -13.7 56.1 35.6 50 188 A A H S+ 0 0 0 -4,-2.8 5,-2.3 1,-0.2 4,-0.8 0.815 113.4 57.0 -61.1 -28.4 -16.5 47.9 30.3 56 194 A R H ><5S+ 0 0 119 -4,-2.3 3,-1.1 -5,-0.3 -1,-0.2 0.944 105.4 51.9 -65.3 -46.6 -19.8 48.2 32.2 57 195 A S H 3<5S+ 0 0 58 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.873 102.4 57.8 -57.7 -39.2 -21.4 49.1 28.8 58 196 A L H 3<5S- 0 0 16 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.799 130.6 -99.9 -61.8 -24.6 -19.9 46.0 27.2 59 197 A G T <<5S+ 0 0 25 -3,-1.1 -38,-0.7 -4,-0.8 -37,-0.5 0.677 70.6 151.9 110.7 28.9 -21.7 44.2 29.9 60 198 A F < - 0 0 0 -5,-2.3 2,-1.9 -39,-0.2 -1,-0.2 -0.716 50.1-130.6 -94.4 141.6 -19.0 43.5 32.5 61 199 A D E -c 23 0C 66 -39,-2.7 -37,-1.7 -2,-0.3 2,-0.2 -0.638 46.5-174.7 -86.5 78.3 -19.7 43.1 36.2 62 200 A V E -c 24 0C 14 -2,-1.9 2,-0.4 -39,-0.2 -37,-0.2 -0.537 20.7-176.6 -86.4 142.8 -17.0 45.6 37.0 63 201 A I E -c 25 0C 73 -39,-1.8 -37,-2.5 -2,-0.2 2,-0.5 -0.999 17.2-142.1-134.6 133.5 -15.7 46.6 40.4 64 202 A V E -c 26 0C 49 -2,-0.4 2,-0.5 -39,-0.2 -37,-0.2 -0.852 14.2-172.3-103.0 129.2 -13.0 49.2 41.0 65 203 A Y E -c 27 0C 53 -39,-3.2 -37,-3.3 -2,-0.5 3,-0.3 -0.975 12.1-157.0-119.0 126.2 -10.4 48.8 43.7 66 204 A N E +c 28 0C 80 -2,-0.5 -37,-0.3 -39,-0.2 41,-0.1 -0.714 61.0 0.0-109.9 158.3 -8.1 51.7 44.5 67 205 A D S S- 0 0 42 -39,-1.3 -1,-0.2 -2,-0.3 2,-0.1 0.830 81.3-178.0 39.5 48.2 -4.6 52.1 46.1 68 206 A C - 0 0 2 -3,-0.3 39,-3.6 39,-0.1 2,-0.2 -0.460 20.8-128.8 -76.0 145.7 -4.4 48.3 46.5 69 207 A S > - 0 0 30 37,-0.3 4,-3.5 38,-0.2 5,-0.4 -0.504 29.9-102.4 -88.6 163.7 -1.3 46.9 48.2 70 208 A C H > S+ 0 0 21 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.895 128.3 48.2 -51.3 -40.3 0.7 44.1 46.7 71 209 A A H > S+ 0 0 67 2,-0.2 4,-3.0 3,-0.2 -1,-0.3 0.912 113.4 47.4 -66.2 -42.2 -1.1 41.8 49.2 72 210 A K H > S+ 0 0 81 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.963 112.5 47.5 -62.0 -56.3 -4.5 43.3 48.3 73 211 A M H X S+ 0 0 0 -4,-3.5 4,-1.9 1,-0.2 5,-0.2 0.920 116.2 44.9 -52.0 -49.0 -4.0 43.0 44.5 74 212 A Q H X S+ 0 0 45 -4,-2.3 4,-2.5 -5,-0.4 -1,-0.2 0.942 112.5 54.8 -62.7 -43.7 -2.8 39.5 44.9 75 213 A D H X S+ 0 0 69 -4,-3.0 4,-2.1 -5,-0.2 -2,-0.2 0.959 110.1 40.8 -54.3 -63.7 -5.6 38.8 47.3 76 214 A L H X S+ 0 0 12 -4,-2.8 4,-3.2 1,-0.2 5,-0.2 0.893 112.6 54.7 -57.9 -41.2 -8.6 39.9 45.1 77 215 A L H X S+ 0 0 0 -4,-1.9 4,-2.2 -5,-0.3 5,-0.2 0.963 110.9 46.6 -56.0 -48.8 -7.1 38.3 42.0 78 216 A K H X S+ 0 0 102 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.838 111.8 52.0 -60.6 -34.7 -6.9 35.0 43.8 79 217 A K H X S+ 0 0 100 -4,-2.1 4,-1.4 -5,-0.2 -1,-0.2 0.921 107.1 51.6 -67.8 -43.8 -10.4 35.5 45.1 80 218 A A H < S+ 0 0 2 -4,-3.2 3,-0.4 1,-0.3 -2,-0.2 0.906 111.2 47.2 -60.0 -41.3 -11.7 36.1 41.6 81 219 A S H < S+ 0 0 9 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.816 105.6 62.9 -67.1 -29.9 -10.1 32.9 40.4 82 220 A E H < S+ 0 0 115 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.843 91.4 87.9 -63.0 -36.2 -11.6 31.3 43.4 83 221 A E S < S- 0 0 83 -4,-1.4 2,-0.7 -3,-0.4 44,-0.2 0.126 85.3-105.7 -61.2 174.1 -15.1 32.0 42.2 84 222 A D + 0 0 101 1,-0.1 3,-0.4 42,-0.1 -1,-0.1 -0.914 31.5 177.1-107.4 110.0 -17.4 30.0 39.9 85 224 A H > + 0 0 8 -2,-0.7 3,-1.7 1,-0.2 -1,-0.1 0.005 37.6 127.1-101.9 29.7 -17.6 31.4 36.5 86 225 A T T 3 S+ 0 0 75 1,-0.3 -1,-0.2 -68,-0.0 -67,-0.1 0.839 78.5 42.4 -54.4 -36.8 -19.8 28.7 35.1 87 226 A N T 3 S+ 0 0 79 -3,-0.4 -67,-1.6 -69,-0.1 2,-0.4 -0.207 100.2 98.5-104.8 42.1 -22.4 31.2 33.9 88 227 A A B < -b 20 0B 2 -3,-1.7 -67,-0.2 39,-0.2 -66,-0.2 -0.974 60.9-151.1-131.3 143.6 -19.8 33.6 32.5 89 228 A A S S- 0 0 1 -69,-1.8 2,-0.3 -2,-0.4 -67,-0.2 0.819 75.3 -35.7 -80.1 -32.5 -18.5 34.2 29.0 90 229 A C - 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