==== 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/DNA 05-SEP-12 4GZ1 . COMPND 2 MOLECULE: TYROSYL-DNA PHOSPHODIESTERASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR M.J.SCHELLENBERG,R.S.WILLIAMS . 502 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23348.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 335 66.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 5.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 126 25.1 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 . 2 0.4 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-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 . 29 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 91 18.1 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+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 2 0 0 2 0 0 2 0 0 0 0 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 0 2 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 PARALLEL BRIDGES PER LADDER . 2 3 1 0 5 3 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 2 0 0 2 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 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 1 116 A N 0 0 122 0, 0.0 2,-0.1 0, 0.0 38,-0.0 0.000 360.0 360.0 360.0 101.0 -27.2 -1.0 7.7 2 117 A G - 0 0 38 0, 0.0 3,-0.4 0, 0.0 4,-0.2 -0.231 360.0 -67.7-110.7-163.5 -30.1 1.1 9.0 3 118 A L S > S+ 0 0 160 1,-0.2 3,-1.9 2,-0.2 4,-0.2 0.919 124.9 55.3 -56.3 -48.2 -32.1 1.7 12.1 4 119 A E G > S+ 0 0 179 1,-0.3 3,-0.5 2,-0.1 -1,-0.2 0.867 110.3 45.6 -57.6 -38.0 -33.8 -1.7 12.2 5 120 A D G > S+ 0 0 74 -3,-0.4 3,-1.4 1,-0.2 -1,-0.3 0.254 81.0 106.6 -89.4 12.2 -30.4 -3.6 12.2 6 121 A S G < + 0 0 62 -3,-1.9 -1,-0.2 1,-0.3 -2,-0.1 0.610 69.3 61.2 -71.3 -12.8 -28.8 -1.4 14.8 7 122 A S G < S+ 0 0 53 -3,-0.5 246,-2.6 -4,-0.2 2,-0.3 0.534 93.6 87.0 -88.0 -1.3 -28.9 -4.0 17.6 8 123 A T E < -A 252 0A 33 -3,-1.4 2,-0.5 244,-0.2 244,-0.2 -0.638 57.4-157.9-107.1 149.6 -26.7 -6.4 15.7 9 124 A I E -A 251 0A 1 242,-2.4 242,-2.5 -2,-0.3 2,-0.4 -0.993 16.4-168.9-115.2 130.6 -23.0 -7.1 15.3 10 125 A S E +A 250 0A 16 -2,-0.5 32,-1.4 240,-0.2 31,-1.2 -0.949 13.7 162.2-114.4 143.8 -22.0 -9.0 12.1 11 126 A F E -Ab 249 42A 0 238,-2.4 238,-2.7 -2,-0.4 2,-0.4 -0.989 29.0-141.6-153.1 160.8 -18.6 -10.4 11.5 12 127 A I E -Ab 248 43A 0 30,-1.5 32,-2.9 -2,-0.3 2,-0.4 -0.983 10.7-163.8-119.5 139.0 -16.5 -12.8 9.5 13 128 A T E +Ab 247 44A 0 234,-2.1 234,-2.5 -2,-0.4 2,-0.3 -0.990 22.3 161.8-117.1 136.4 -13.6 -14.9 10.9 14 129 A W E - b 0 45A 1 30,-2.5 32,-1.8 -2,-0.4 2,-0.8 -0.927 40.4-144.5-160.3 122.9 -11.2 -16.4 8.3 15 130 A N E - b 0 46A 0 230,-0.3 229,-0.5 -2,-0.3 32,-0.2 -0.849 25.3-169.3 -83.5 109.8 -7.7 -17.9 8.1 16 131 A I - 0 0 0 30,-2.2 31,-0.1 -2,-0.8 -1,-0.1 0.325 28.3-124.9 -96.2 8.1 -6.8 -16.6 4.7 17 132 A D > + 0 0 12 29,-0.3 3,-1.6 1,-0.1 30,-0.1 0.895 41.5 168.1 57.2 50.1 -3.6 -18.7 4.1 18 133 A G T 3 + 0 0 2 29,-1.4 -1,-0.1 28,-0.3 30,-0.1 0.658 69.6 73.8 -66.4 -15.2 -1.2 -15.9 3.4 19 134 A L T 3 S+ 0 0 96 1,-0.1 2,-0.9 28,-0.1 -1,-0.3 0.661 81.1 79.4 -72.8 -15.7 1.6 -18.4 3.8 20 135 A D < - 0 0 33 -3,-1.6 -1,-0.1 1,-0.1 0, 0.0 -0.835 62.7-176.7 -88.9 104.6 0.6 -19.8 0.4 21 136 A G > + 0 0 55 -2,-0.9 3,-1.6 2,-0.1 2,-0.3 0.679 47.7 107.2 -74.5 -17.4 2.1 -17.4 -2.0 22 137 A C T 3 S- 0 0 67 1,-0.3 5,-0.1 2,-0.1 -2,-0.1 -0.460 100.9 -12.4 -72.7 128.4 0.7 -19.0 -5.1 23 138 A N T 3> S+ 0 0 55 -2,-0.3 4,-2.3 1,-0.1 -1,-0.3 0.730 89.9 149.4 58.0 24.6 -2.1 -16.9 -6.7 24 139 A L H <> + 0 0 8 -3,-1.6 4,-2.7 1,-0.2 5,-0.2 0.898 63.2 51.5 -63.0 -41.9 -2.2 -14.8 -3.5 25 140 A P H > S+ 0 0 53 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.930 113.4 44.9 -60.9 -42.7 -3.3 -11.4 -5.1 26 141 A E H > S+ 0 0 41 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.892 113.0 51.3 -64.3 -39.4 -6.3 -13.1 -6.8 27 142 A R H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.895 107.7 52.5 -66.2 -38.1 -7.2 -15.0 -3.7 28 143 A A H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.894 106.9 53.5 -62.3 -38.4 -7.1 -11.7 -1.7 29 144 A R H X S+ 0 0 106 -4,-1.9 4,-2.1 -5,-0.2 -1,-0.2 0.891 106.5 53.2 -64.4 -36.3 -9.4 -10.2 -4.2 30 145 A G H X S+ 0 0 7 -4,-1.8 4,-1.5 2,-0.2 -2,-0.2 0.910 108.9 47.7 -63.8 -42.3 -11.8 -13.1 -3.6 31 146 A V H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 3,-0.2 0.944 112.1 50.9 -60.9 -44.4 -11.7 -12.5 0.2 32 147 A C H X S+ 0 0 6 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.849 104.8 55.5 -66.8 -34.0 -12.4 -8.8 -0.5 33 148 A S H X S+ 0 0 76 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.880 107.4 51.0 -66.1 -33.6 -15.4 -9.6 -2.8 34 149 A C H X S+ 0 0 13 -4,-1.5 4,-1.9 -3,-0.2 5,-0.3 0.925 108.7 50.5 -65.9 -44.3 -16.9 -11.6 0.1 35 150 A L H X S+ 0 0 3 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.884 110.3 50.9 -60.4 -37.6 -16.4 -8.6 2.5 36 151 A A H < S+ 0 0 80 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.871 108.1 53.0 -67.9 -35.4 -18.1 -6.4 -0.1 37 152 A L H < S+ 0 0 126 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.913 123.8 23.8 -65.8 -43.5 -21.1 -8.7 -0.4 38 153 A Y H < S- 0 0 111 -4,-1.9 -2,-0.2 -5,-0.1 -1,-0.2 0.621 85.1-150.2-101.0 -17.4 -21.9 -9.0 3.3 39 154 A S < - 0 0 38 -4,-2.2 -3,-0.1 -5,-0.3 -29,-0.1 0.897 22.5-162.1 44.3 57.3 -20.4 -5.7 4.6 40 155 A P - 0 0 0 0, 0.0 -29,-0.2 0, 0.0 -1,-0.1 -0.284 23.4-131.1 -66.0 152.3 -19.6 -7.1 8.1 41 156 A D S S+ 0 0 0 -31,-1.2 39,-2.6 1,-0.2 2,-0.3 0.846 91.0 18.1 -66.6 -35.3 -18.9 -4.7 11.0 42 157 A V E -bC 11 79A 0 -32,-1.4 -30,-1.5 37,-0.2 2,-0.4 -0.981 63.5-159.3-139.6 147.0 -15.7 -6.6 12.0 43 158 A V E -bC 12 78A 0 35,-2.2 35,-3.2 -2,-0.3 2,-0.5 -0.996 4.3-160.7-130.4 127.7 -13.4 -9.1 10.3 44 159 A F E -bC 13 77A 0 -32,-2.9 -30,-2.5 -2,-0.4 2,-0.4 -0.936 19.6-175.4-104.9 119.7 -11.0 -11.4 12.2 45 160 A L E -bC 14 76A 0 31,-2.9 31,-2.3 -2,-0.5 2,-0.3 -0.906 12.5-164.3-119.9 144.8 -8.2 -12.7 10.0 46 161 A Q E +b 15 0A 0 -32,-1.8 -30,-2.2 -2,-0.4 -29,-0.3 -0.915 69.8 28.3-123.0 157.0 -5.4 -15.2 10.5 47 162 A E E S+ 0 0 18 -2,-0.3 -29,-1.4 1,-0.2 2,-0.2 0.807 74.9 163.0 60.4 37.6 -2.2 -15.8 8.4 48 163 A V E - C 0 74A 0 26,-2.7 26,-2.3 -3,-0.2 -1,-0.2 -0.566 17.7-166.6 -74.7 143.1 -2.0 -12.3 7.2 49 164 A I >> - 0 0 30 -2,-0.2 4,-1.4 24,-0.2 3,-0.8 -0.868 36.7 -97.2-125.8 164.9 1.4 -11.3 5.7 50 165 A P H 3> S+ 0 0 52 0, 0.0 4,-1.2 0, 0.0 3,-0.5 0.881 121.9 50.6 -57.2 -41.3 2.7 -7.8 5.0 51 166 A P H 3> S+ 0 0 60 0, 0.0 4,-1.5 0, 0.0 3,-0.2 0.837 105.9 58.5 -62.4 -30.7 1.8 -7.8 1.2 52 167 A Y H <> S+ 0 0 0 -3,-0.8 4,-2.3 1,-0.2 5,-0.2 0.848 97.9 59.3 -67.0 -34.4 -1.7 -9.0 2.1 53 168 A C H X S+ 0 0 12 -4,-1.4 4,-2.0 -3,-0.5 -1,-0.2 0.885 103.9 51.9 -59.2 -39.1 -2.2 -5.9 4.2 54 169 A A H X S+ 0 0 55 -4,-1.2 4,-1.5 2,-0.2 -2,-0.2 0.881 107.3 51.6 -64.5 -38.0 -1.5 -3.9 1.0 55 170 A Y H X S+ 0 0 77 -4,-1.5 4,-2.6 1,-0.2 5,-0.2 0.899 110.8 48.9 -64.9 -40.2 -4.2 -5.9 -0.9 56 171 A L H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 7,-0.2 0.871 106.9 55.0 -67.4 -35.9 -6.7 -5.2 1.9 57 172 A K H < S+ 0 0 135 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.848 115.4 41.0 -64.5 -31.4 -5.9 -1.4 1.9 58 173 A K H < S+ 0 0 153 -4,-1.5 3,-0.3 -5,-0.1 -2,-0.2 0.904 128.8 24.2 -80.1 -44.7 -6.7 -1.4 -1.9 59 174 A R H < S+ 0 0 130 -4,-2.6 -3,-0.2 1,-0.2 -2,-0.2 0.406 130.6 38.4-110.7 -0.5 -9.8 -3.7 -2.1 60 175 A A >< + 0 0 9 -4,-1.9 3,-1.8 -5,-0.2 -1,-0.2 -0.266 69.6 148.5-137.2 50.2 -11.2 -3.3 1.5 61 176 A A T 3 + 0 0 65 -3,-0.3 -4,-0.1 1,-0.3 -2,-0.1 0.624 59.9 70.5 -68.1 -15.7 -10.4 0.3 2.0 62 177 A S T 3 S+ 0 0 51 -3,-0.1 19,-3.0 2,-0.0 2,-0.4 0.412 88.2 82.8 -81.3 2.6 -13.5 1.0 4.3 63 178 A Y E < S-D 80 0A 13 -3,-1.8 2,-0.4 17,-0.2 17,-0.2 -0.914 72.8-138.6-110.3 133.1 -11.8 -1.1 7.1 64 179 A T E -D 79 0A 49 15,-2.7 15,-2.3 -2,-0.4 2,-0.5 -0.757 27.0-138.1 -78.4 134.7 -9.2 0.0 9.6 65 180 A I E -D 78 0A 39 -2,-0.4 2,-0.5 13,-0.2 13,-0.2 -0.851 20.7-176.1-106.5 120.2 -6.5 -2.7 10.0 66 181 A I E -D 77 0A 18 11,-2.4 11,-2.7 -2,-0.5 2,-0.2 -0.975 17.7-157.2-110.8 124.4 -5.1 -3.7 13.4 67 182 A T E -D 76 0A 41 -2,-0.5 9,-0.2 9,-0.2 3,-0.1 -0.692 25.2-142.7-110.1 157.0 -2.3 -6.3 13.3 68 183 A G S S- 0 0 0 7,-2.6 2,-0.3 -2,-0.2 8,-0.1 0.513 86.1 -2.2 -89.5 -11.4 -0.8 -8.9 15.7 69 184 A N - 0 0 54 6,-0.4 -1,-0.1 1,-0.1 5,-0.1 -0.960 59.5-125.9-165.6 176.4 2.8 -8.4 14.4 70 185 A E S S+ 0 0 159 -2,-0.3 2,-0.3 1,-0.1 4,-0.1 0.711 86.4 28.5-103.8 -29.0 4.9 -6.5 11.9 71 186 A E S S+ 0 0 147 2,-0.1 2,-0.3 -22,-0.1 -1,-0.1 -0.829 104.6 18.1-134.0 168.1 6.8 -9.3 10.1 72 187 A G S S- 0 0 51 -2,-0.3 2,-0.3 -3,-0.1 -3,-0.1 -0.578 111.5 -35.1 74.7-131.5 6.3 -12.9 9.2 73 188 A Y S S+ 0 0 48 -2,-0.3 2,-0.3 -24,-0.1 -24,-0.2 -0.964 71.8 153.2-129.2 150.6 2.7 -14.0 9.4 74 189 A F E -C 48 0A 14 -26,-2.3 -26,-2.7 -2,-0.3 2,-0.1 -0.937 38.5 -89.4-162.8 171.1 0.1 -12.7 12.0 75 190 A T E - 0 0 4 -2,-0.3 -7,-2.6 -29,-0.2 -6,-0.4 -0.441 33.9-165.6 -90.2 169.2 -3.5 -12.1 12.8 76 191 A A E -CD 45 67A 0 -31,-2.3 -31,-2.9 -9,-0.2 2,-0.5 -0.989 15.4-149.0-150.8 153.9 -5.5 -8.9 12.1 77 192 A I E -CD 44 66A 0 -11,-2.7 -11,-2.4 -2,-0.3 2,-0.4 -0.995 16.6-157.4-123.8 126.8 -8.8 -7.4 13.2 78 193 A L E -CD 43 65A 0 -35,-3.2 -35,-2.2 -2,-0.5 2,-0.5 -0.883 4.9-160.1-107.2 133.6 -10.5 -5.1 10.6 79 194 A L E -CD 42 64A 3 -15,-2.3 -15,-2.7 -2,-0.4 2,-0.4 -0.960 22.1-118.3-119.7 127.4 -13.0 -2.5 11.8 80 195 A K E >> - D 0 63A 25 -39,-2.6 4,-2.3 -2,-0.5 3,-1.8 -0.440 32.7-124.1 -67.7 117.5 -15.7 -0.9 9.6 81 196 A K T 34 S+ 0 0 113 -19,-3.0 4,-0.1 -2,-0.4 -1,-0.1 -0.335 94.6 22.7 -60.6 137.0 -15.1 2.9 9.4 82 197 A G T 34 S+ 0 0 89 2,-0.4 -1,-0.3 1,-0.1 3,-0.1 0.319 124.5 54.8 87.1 -10.9 -18.1 4.9 10.4 83 198 A R T <4 S+ 0 0 66 -3,-1.8 28,-0.5 1,-0.3 2,-0.5 0.681 100.4 51.6-115.6 -40.3 -19.5 2.1 12.5 84 199 A V E < -F 110 0B 19 -4,-2.3 2,-0.6 26,-0.1 -2,-0.4 -0.869 64.6-151.4-111.0 130.7 -16.9 1.0 14.9 85 200 A K E -F 109 0B 137 24,-2.7 24,-1.9 -2,-0.5 2,-0.4 -0.905 18.0-139.0-101.6 117.4 -15.0 3.3 17.2 86 201 A F E +F 108 0B 95 -2,-0.6 22,-0.2 22,-0.2 3,-0.1 -0.637 28.7 167.6 -77.9 125.6 -11.4 2.1 18.1 87 202 A K E - 0 0 105 20,-2.8 2,-0.3 -2,-0.4 21,-0.2 0.785 58.5 -26.3-107.8 -42.4 -10.4 2.5 21.7 88 203 A S E -F 107 0B 50 19,-1.5 19,-2.6 2,-0.0 2,-0.4 -0.975 45.4-130.1-168.9 161.7 -7.3 0.4 22.2 89 204 A Q E -F 106 0B 92 -2,-0.3 2,-0.4 17,-0.2 17,-0.2 -0.977 22.2-173.6-115.8 131.6 -5.2 -2.6 21.0 90 205 A E E -F 105 0B 78 15,-3.0 15,-3.0 -2,-0.4 2,-0.4 -0.970 5.7-165.7-123.9 142.3 -3.8 -5.2 23.4 91 206 A I E -F 104 0B 72 -2,-0.4 13,-0.2 13,-0.2 -2,-0.0 -0.995 2.3-164.7-126.9 128.8 -1.4 -8.0 22.6 92 207 A I E -F 103 0B 29 11,-2.7 11,-2.5 -2,-0.4 2,-0.1 -0.948 20.3-131.7-111.7 124.3 -0.9 -10.9 25.0 93 208 A P E -F 102 0B 89 0, 0.0 9,-0.2 0, 0.0 3,-0.1 -0.361 5.4-146.1 -73.9 156.2 2.2 -13.2 24.3 94 209 A F > - 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