==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-DEC-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 29-JUN-12 4FVA . COMPND 2 MOLECULE: 5'-TYROSYL-DNA PHOSPHODIESTERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CAENORHABDITIS ELEGANS; . AUTHOR K.SHI,K.KURAHASHI,H.AIHARA . 998 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 42763.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 657 65.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 56 5.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 242 24.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.4 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 0.4 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 0.1 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 . 81 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 94 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 156 15.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 8 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 4 0 4 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 8 0 0 8 8 4 8 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 . 3 1 0 0 8 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 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 1 114 A D 0 0 195 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-178.5 25.5 -5.1 11.7 2 115 A L > + 0 0 45 214,-0.1 3,-2.9 2,-0.1 247,-0.4 0.545 360.0 117.7 -95.3 -7.4 21.9 -4.2 11.4 3 116 A K T 3 S+ 0 0 179 1,-0.3 3,-0.1 246,-0.2 214,-0.0 -0.379 84.0 22.2 -59.3 134.3 21.2 -4.1 15.1 4 117 A G T 3 S+ 0 0 75 1,-0.3 2,-0.4 -2,-0.0 -1,-0.3 0.386 94.5 129.6 82.9 -5.2 20.1 -0.5 15.8 5 118 A F < + 0 0 56 -3,-2.9 244,-1.0 2,-0.0 -1,-0.3 -0.685 32.5 170.1 -81.5 136.5 19.1 -0.0 12.2 6 119 A E E +A 248 0A 122 -2,-0.4 2,-0.3 242,-0.2 242,-0.2 -0.997 16.7 179.2-151.3 138.0 15.7 1.4 11.9 7 120 A V E -A 247 0A 3 240,-2.3 240,-3.3 -2,-0.3 2,-0.4 -0.986 14.6-149.9-142.8 133.6 13.5 2.8 9.1 8 121 A S E -A 246 0A 16 -2,-0.3 32,-2.1 238,-0.3 31,-0.7 -0.884 8.9-167.8-107.2 134.6 9.9 4.1 9.2 9 122 A V E -Ab 245 40A 0 236,-3.8 236,-3.7 -2,-0.4 2,-0.4 -0.980 3.2-172.5-124.3 127.2 7.5 3.9 6.3 10 123 A M E -Ab 244 41A 0 30,-2.5 32,-3.3 -2,-0.5 2,-0.4 -0.924 0.9-169.9-117.7 140.8 4.2 5.8 6.2 11 124 A S E +Ab 243 42A 0 232,-2.4 232,-2.7 -2,-0.4 2,-0.3 -1.000 9.2 172.3-134.0 138.5 1.5 5.4 3.6 12 125 A W E - b 0 43A 0 30,-2.2 32,-2.0 -2,-0.4 2,-0.8 -0.952 31.7-148.5-154.0 122.7 -1.6 7.6 3.1 13 126 A N E - b 0 44A 0 228,-0.3 227,-0.5 -2,-0.3 32,-0.2 -0.849 23.3-166.0 -83.9 112.4 -4.4 8.0 0.6 14 127 A I - 0 0 2 30,-2.2 31,-0.1 -2,-0.8 -1,-0.1 0.342 27.4-126.0 -93.5 8.8 -4.9 11.8 1.0 15 128 A D > + 0 0 1 29,-0.3 3,-1.4 1,-0.1 30,-0.1 0.894 45.0 164.7 56.5 45.1 -8.3 12.0 -0.7 16 129 A G T 3 + 0 0 4 29,-1.9 -1,-0.1 28,-0.3 30,-0.1 0.698 67.0 70.0 -65.3 -19.3 -7.2 14.7 -3.2 17 130 A L T 3 S+ 0 0 77 28,-0.1 2,-0.8 1,-0.0 -1,-0.3 0.642 80.7 85.5 -74.6 -13.3 -10.3 14.0 -5.3 18 131 A D < - 0 0 15 -3,-1.4 -1,-0.0 1,-0.1 179,-0.0 -0.816 63.1-167.6 -91.3 112.9 -12.4 15.5 -2.6 19 132 A G > + 0 0 27 -2,-0.8 3,-1.4 2,-0.1 2,-0.3 0.646 50.6 110.3 -77.3 -17.0 -12.5 19.2 -3.2 20 133 A R T 3 S- 0 0 130 1,-0.3 5,-0.1 2,-0.1 -2,-0.1 -0.453 102.1 -17.7 -65.9 121.4 -14.1 20.2 0.1 21 134 A S T 3> S+ 0 0 55 -2,-0.3 4,-2.7 1,-0.1 -1,-0.3 0.804 88.5 156.8 54.5 30.9 -11.6 22.0 2.4 22 135 A L H <> + 0 0 2 -3,-1.4 4,-2.7 2,-0.2 5,-0.2 0.885 66.2 46.6 -56.1 -48.2 -8.8 20.6 0.2 23 136 A L H > S+ 0 0 65 -4,-0.2 4,-2.5 2,-0.2 5,-0.2 0.959 114.2 47.0 -62.6 -48.3 -6.2 23.3 1.0 24 137 A T H > S+ 0 0 50 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.913 114.2 49.1 -58.8 -41.6 -6.8 23.1 4.7 25 138 A R H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.893 109.6 49.9 -66.6 -40.9 -6.7 19.3 4.6 26 139 A M H X S+ 0 0 6 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.891 109.6 52.0 -67.4 -36.9 -3.4 19.3 2.6 27 140 A K H X S+ 0 0 121 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.895 110.2 49.5 -60.1 -41.7 -1.9 21.7 5.1 28 141 A A H X S+ 0 0 15 -4,-2.0 4,-2.7 -5,-0.2 -2,-0.2 0.894 108.8 52.6 -64.3 -41.6 -3.0 19.3 7.8 29 142 A V H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.958 111.3 45.3 -57.3 -50.6 -1.4 16.4 5.9 30 143 A A H X S+ 0 0 4 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.900 112.2 53.8 -62.0 -38.1 1.9 18.2 5.7 31 144 A H H X S+ 0 0 118 -4,-2.3 4,-1.2 2,-0.2 -1,-0.2 0.927 109.7 46.0 -58.6 -48.0 1.6 19.1 9.4 32 145 A I H X S+ 0 0 35 -4,-2.7 4,-2.8 1,-0.2 5,-0.4 0.900 109.5 55.1 -65.8 -41.2 1.1 15.5 10.4 33 146 A V H X S+ 0 0 0 -4,-2.4 4,-3.1 1,-0.2 -1,-0.2 0.929 106.4 51.3 -55.1 -47.1 4.0 14.3 8.2 34 147 A K H < S+ 0 0 123 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.782 114.2 45.1 -63.7 -29.0 6.3 16.8 10.0 35 148 A N H < S+ 0 0 117 -4,-1.2 -2,-0.2 -3,-0.3 -1,-0.2 0.837 117.8 39.7 -83.7 -37.8 5.2 15.4 13.4 36 149 A V H < S- 0 0 35 -4,-2.8 -2,-0.2 -5,-0.1 -3,-0.2 0.813 91.1-163.6 -76.4 -34.6 5.3 11.7 12.6 37 150 A N < - 0 0 103 -4,-3.1 -3,-0.1 -5,-0.4 -29,-0.1 0.893 9.3-168.2 55.4 53.0 8.5 12.4 10.6 38 151 A P - 0 0 1 0, 0.0 -29,-0.1 0, 0.0 -1,-0.1 -0.362 25.7-135.6 -71.3 152.5 8.7 9.1 8.7 39 152 A D S S+ 0 0 67 -31,-0.7 40,-1.1 1,-0.2 2,-0.4 0.842 94.2 24.8 -71.8 -34.8 11.9 8.3 6.8 40 153 A I E S-bC 9 78A 2 -32,-2.1 -30,-2.5 38,-0.2 2,-0.4 -0.992 72.2-166.6-134.9 135.1 9.8 7.2 3.8 41 154 A L E -bC 10 77A 0 36,-2.7 36,-2.9 -2,-0.4 2,-0.5 -0.985 5.4-163.5-131.5 124.6 6.3 8.3 2.8 42 155 A F E -bC 11 76A 0 -32,-3.3 -30,-2.2 -2,-0.4 2,-0.4 -0.907 13.2-172.1 -98.5 129.7 3.9 6.9 0.2 43 156 A L E -bC 12 75A 0 32,-2.9 32,-2.1 -2,-0.5 2,-0.3 -0.943 4.6-171.9-119.0 147.6 1.0 9.0 -1.0 44 157 A Q E +b 13 0A 0 -32,-2.0 -30,-2.2 -2,-0.4 -29,-0.3 -0.928 66.6 28.4-129.6 160.7 -2.0 8.1 -3.2 45 158 A E E S+ 0 0 21 -2,-0.3 -29,-1.9 1,-0.2 2,-0.3 0.903 75.2 165.9 53.1 45.5 -4.8 10.3 -4.7 46 159 A V E - C 0 73A 1 27,-2.8 27,-2.1 -3,-0.2 2,-0.3 -0.728 16.2-163.9 -82.5 139.7 -2.5 13.3 -4.9 47 160 A V - 0 0 15 -2,-0.3 25,-0.1 2,-0.2 24,-0.1 -0.860 28.9-122.6-124.2 160.1 -3.9 16.1 -7.1 48 161 A D S > S+ 0 0 63 22,-0.3 3,-1.4 23,-0.3 2,-0.2 0.880 87.0 91.3 -66.8 -38.7 -2.4 19.2 -8.7 49 162 A R T 3 S- 0 0 144 1,-0.3 -2,-0.2 2,-0.1 0, 0.0 -0.403 105.4 -4.2 -65.8 126.7 -4.8 21.5 -7.0 50 163 A D T 3 S+ 0 0 55 -2,-0.2 -1,-0.3 1,-0.1 4,-0.3 0.837 86.8 140.4 62.7 34.9 -3.7 22.9 -3.7 51 164 A L X> + 0 0 11 -3,-1.4 4,-2.7 1,-0.2 3,-1.3 0.674 38.4 97.3 -80.1 -15.7 -0.5 20.8 -3.8 52 165 A A H 3> S+ 0 0 27 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.831 78.3 52.1 -46.4 -49.6 1.7 23.5 -2.4 53 166 A P H 34 S+ 0 0 11 0, 0.0 -1,-0.3 0, 0.0 4,-0.2 0.863 116.5 42.6 -59.6 -33.7 1.7 22.4 1.3 54 167 A I H X4 S+ 0 0 0 -3,-1.3 3,-2.1 -4,-0.3 -2,-0.2 0.929 112.5 51.5 -72.3 -49.9 2.7 19.0 0.1 55 168 A D H >< S+ 0 0 25 -4,-2.7 3,-1.7 1,-0.3 -1,-0.2 0.805 99.3 66.8 -57.9 -31.3 5.3 20.3 -2.4 56 169 A K G >< S+ 0 0 136 -4,-2.7 3,-1.4 -5,-0.3 -1,-0.3 0.645 79.9 79.1 -66.3 -14.8 6.8 22.4 0.4 57 170 A L G X> + 0 0 2 -3,-2.1 3,-2.5 1,-0.3 4,-1.9 0.609 67.6 90.8 -67.3 -7.3 7.9 19.1 2.1 58 171 A Q G <4 S+ 0 0 60 -3,-1.7 -1,-0.3 1,-0.3 -2,-0.1 0.651 71.5 69.5 -65.0 -12.5 10.7 19.2 -0.5 59 172 A S G <4 S+ 0 0 84 -3,-1.4 -1,-0.3 1,-0.2 -2,-0.1 0.717 115.6 25.1 -73.0 -19.2 12.7 21.1 2.1 60 173 A L T <4 S+ 0 0 77 -3,-2.5 20,-0.6 1,-0.2 2,-0.3 0.601 128.2 32.4-114.0 -23.6 12.8 17.9 4.1 61 174 A Y E < S-D 79 0A 7 -4,-1.9 2,-0.5 18,-0.2 18,-0.2 -0.918 72.2-115.4-133.5 155.0 12.4 15.1 1.4 62 175 A K E -D 78 0A 35 16,-3.4 16,-2.2 -2,-0.3 2,-0.5 -0.837 41.6-149.2 -82.1 134.0 13.1 14.2 -2.1 63 176 A I E -D 77 0A 16 -2,-0.5 2,-0.5 14,-0.2 14,-0.2 -0.936 17.1-174.3-115.3 126.1 9.7 14.0 -3.8 64 177 A Y E -D 76 0A 3 12,-2.6 12,-2.6 -2,-0.5 2,-0.4 -0.973 9.0-159.3-119.9 118.0 8.9 11.7 -6.7 65 178 A Y E -D 75 0A 35 -2,-0.5 10,-0.2 10,-0.2 3,-0.2 -0.796 12.3-145.3 -95.9 138.8 5.5 12.0 -8.4 66 179 A S S S- 0 0 10 8,-2.8 -1,-0.1 -2,-0.4 9,-0.1 0.890 88.0 -10.8 -69.1 -38.1 4.2 9.1 -10.4 67 180 A N S > S- 0 0 51 7,-0.4 3,-2.0 3,-0.1 -1,-0.2 -0.267 74.8-164.2-165.6 55.6 2.3 11.1 -13.0 68 181 A K T 3 S+ 0 0 63 1,-0.3 3,-0.1 -3,-0.2 -21,-0.0 -0.170 76.8 33.2 -57.5 141.5 2.0 14.8 -12.2 69 182 A G T 3 S+ 0 0 40 1,-0.4 -1,-0.3 2,-0.1 2,-0.1 0.166 91.3 113.4 94.8 -19.1 -0.6 16.6 -14.2 70 183 A C S < S- 0 0 24 -3,-2.0 -1,-0.4 1,-0.1 -22,-0.3 -0.325 91.2 -93.7 -71.9 168.0 -2.9 13.6 -14.5 71 184 A Q S S- 0 0 121 1,-0.2 -23,-0.3 -3,-0.1 2,-0.3 0.905 104.5 -14.1 -52.7 -46.5 -6.3 13.8 -12.7 72 185 A Y S S+ 0 0 22 -25,-0.1 2,-0.3 -5,-0.1 -25,-0.2 -0.976 73.9 165.0-153.3 161.0 -4.7 12.1 -9.7 73 186 A Y E -C 46 0A 8 -27,-2.1 -27,-2.8 -2,-0.3 2,-0.2 -0.869 29.9 -95.4-161.6-177.3 -1.5 10.2 -9.0 74 187 A T E - 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0 0 17 7,-2.4 3,-1.4 -2,-0.5 7,-0.2 -0.516 17.8-149.9 -63.2 121.5 -1.3 -1.1 -15.2 93 206 A Q T 3 S+ 0 0 131 -2,-0.4 -1,-0.2 1,-0.3 343,-0.1 0.850 93.9 50.1 -63.5 -35.6 -2.5 -2.2 -18.7 94 207 A N T 3 S+ 0 0 57 35,-0.1 2,-0.4 -3,-0.0 -1,-0.3 0.297 88.3 112.4 -87.7 7.6 -5.9 -3.4 -17.4 95 208 A S < - 0 0 9 -3,-1.4 3,-0.3 4,-0.2 25,-0.0 -0.677 41.8-176.6 -90.3 135.9 -6.6 -0.1 -15.5 96 209 A G S S+ 0 0 64 -2,-0.4 -1,-0.1 1,-0.1 -3,-0.0 0.309 84.7 63.3 -98.6 8.5 -9.3 2.3 -16.4 97 210 A M S S- 0 0 36 2,-0.0 -1,-0.1 25,-0.0 -2,-0.0 0.034 111.8-107.3-125.3 25.0 -8.2 4.6 -13.6 98 211 A Y + 0 0 131 -3,-0.3 2,-0.2 1,-0.2 -2,-0.1 0.771 60.8 170.4 56.2 30.0 -4.6 5.6 -14.6 99 212 A R + 0 0 11 -7,-0.2 -7,-2.4 -8,-0.1 2,-0.3 -0.466 7.2 179.5 -80.2 148.8 -3.3 3.3 -11.9 100 213 A T E -F 91 0B 5 -9,-0.2 2,-0.7 -2,-0.2 19,-0.6 -0.895 35.9-122.0-142.0 160.8 0.4 2.6 -11.7 101 214 A L E -FG 90 118B 0 -11,-3.2 -11,-3.1 -2,-0.3 2,-0.6 -0.961 33.5-158.1-107.2 111.9 3.1 0.7 -9.9 102 215 A Q E -FG 89 117B 0 15,-2.9 15,-2.7 -2,-0.7 2,-0.5 -0.827 10.0-169.9 -95.2 120.6 5.6 3.4 -8.8 103 216 A I E -FG 88 116B 4 -15,-3.6 -15,-2.9 -2,-0.6 2,-0.5 -0.945 11.9-176.9-119.8 120.9 9.0 2.1 -8.1 104 217 A L E -FG 87 115B 0 11,-2.8 11,-2.6 -2,-0.5 2,-0.4 -0.979 9.7-170.8-115.8 121.8 11.9 4.0 -6.5 105 218 A E E +FG 86 114B 22 -19,-2.5 -20,-3.4 -2,-0.5 -19,-1.8 -0.910 30.2 105.7-111.2 135.0 15.1 2.1 -6.2 106 219 A G E -FG 84 113B 1 7,-2.5 7,-2.9 -2,-0.4 2,-0.3 -0.854 53.4-100.4-171.2-152.8 18.1 3.4 -4.3 107 220 A S E -FG 83 112B 31 -24,-1.3 -24,-3.0 5,-0.3 2,-0.5 -0.988 6.8-152.8-152.7 152.0 20.0 3.0 -1.0 108 221 A I E > S- G 0 111B 25 3,-1.7 3,-1.6 -2,-0.3 2,-0.3 -0.990 81.6 -29.6-126.1 120.7 20.3 4.6 2.4 109 222 A G T 3 S- 0 0 70 -2,-0.5 -26,-0.1 -28,-0.4 -2,-0.0 -0.587 127.6 -32.5 67.6-131.1 23.7 4.1 3.8 110 223 A G T 3 S+ 0 0 89 -2,-0.3 2,-0.5 -3,-0.1 -1,-0.2 0.375 113.5 108.3 -97.3 4.1 24.9 0.8 2.4 111 224 A L E < -G 108 0B 22 -3,-1.6 -3,-1.7 40,-0.0 2,-0.2 -0.722 65.3-135.7 -97.4 123.2 21.5 -0.8 2.2 112 225 A K E -G 107 0B 65 -2,-0.5 40,-2.8 -5,-0.2 2,-0.4 -0.534 28.0-169.4 -68.6 133.7 19.8 -1.4 -1.1 113 226 A V E -Gh 106 152B 1 -7,-2.9 -7,-2.5 -2,-0.2 2,-0.5 -0.995 16.0-166.4-134.6 129.0 16.1 -0.3 -0.9 114 227 A F E -Gh 105 153B 7 38,-2.6 40,-2.9 -2,-0.4 2,-0.5 -0.967 8.5-165.5-111.0 130.0 13.2 -0.9 -3.3 115 228 A L E -Gh 104 154B 0 -11,-2.6 -11,-2.8 -2,-0.5 2,-0.5 -0.973 5.2-175.8-117.6 121.4 10.1 1.2 -2.8 116 229 A L E +Gh 103 155B 0 38,-3.0 40,-2.4 -2,-0.5 2,-0.4 -0.960 5.2 179.8-123.1 113.3 6.9 0.1 -4.6 117 230 A N E +Gh 102 156B 0 -15,-2.7 -15,-2.9 -2,-0.5 2,-0.3 -0.936 8.5 162.1-117.9 131.3 3.8 2.3 -4.2 118 231 A T E -Gh 101 157B 0 38,-2.1 40,-1.2 -2,-0.4 2,-0.4 -0.952 35.8-149.2-145.4 162.0 0.4 1.7 -5.8 119 232 A H E - 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