==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/DNA 26-APR-00 1EWN . COMPND 2 MOLECULE: DNA (5'-D(*GP*AP*CP*AP*TP*GP*(EDA) . SOURCE 2 SYNTHETIC: YES; . AUTHOR A.Y.LAU,M.D.WYATT,B.J.GLASSNER,L.D.SAMSON,T.ELLENBERGER . 200 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9476.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 129 64.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 48 24.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 13 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 16.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 25 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 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 3 0 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 0 2 2 1 1 0 0 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 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 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 82 A H > 0 0 85 0, 0.0 3,-4.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-125.1 20.1 -47.9 39.5 2 83 A L T 3 + 0 0 187 1,-0.3 0, 0.0 155,-0.0 0, 0.0 0.578 360.0 53.5 -20.0 -39.1 19.4 -51.7 39.9 3 84 A T T 3 S+ 0 0 78 2,-0.1 155,-0.9 154,-0.0 -1,-0.3 0.689 79.0 127.1 -80.4 -18.8 17.0 -51.7 36.9 4 85 A R B < -A 157 0A 63 -3,-4.0 2,-0.3 153,-0.2 153,-0.2 -0.037 64.3-121.0 -43.3 129.2 19.5 -50.1 34.4 5 86 A L - 0 0 11 151,-2.9 151,-0.3 143,-0.1 -1,-0.1 -0.579 38.8-139.4 -73.0 136.4 19.9 -52.0 31.2 6 87 A G >> - 0 0 17 -2,-0.3 3,-1.1 144,-0.0 4,-1.1 -0.278 26.6 -80.8 -96.7-178.3 23.6 -52.9 30.9 7 88 A L H 3> S+ 0 0 93 1,-0.3 4,-1.3 2,-0.2 3,-0.2 0.819 122.4 60.6 -44.8 -42.7 26.3 -53.1 28.3 8 89 A E H 34 S+ 0 0 143 1,-0.2 3,-0.4 2,-0.2 -1,-0.3 0.879 98.8 56.0 -58.4 -42.1 25.1 -56.5 27.0 9 90 A F H <4 S+ 0 0 17 -3,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.902 108.7 46.5 -56.9 -45.5 21.7 -55.1 26.0 10 91 A F H < S+ 0 0 0 -4,-1.1 2,-2.6 -3,-0.2 82,-0.5 0.715 86.8 90.5 -72.3 -23.6 23.2 -52.4 23.8 11 92 A D < + 0 0 76 -4,-1.3 -1,-0.2 -3,-0.4 80,-0.1 -0.350 66.3 105.8 -76.1 65.2 25.6 -54.7 22.0 12 93 A Q S S- 0 0 60 -2,-2.6 80,-2.6 81,-0.1 -3,-0.0 -0.946 79.8 -87.2-136.8 155.1 23.2 -55.6 19.2 13 94 A P B > -i 92 0B 62 0, 0.0 4,-2.6 0, 0.0 5,-0.3 -0.264 49.6 -99.8 -63.7 157.7 23.0 -54.6 15.6 14 95 A A H > S+ 0 0 5 78,-0.6 4,-2.8 1,-0.2 5,-0.2 0.822 117.3 47.3 -44.9 -49.9 21.1 -51.4 14.8 15 96 A V H > S+ 0 0 47 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.962 115.2 43.1 -63.4 -53.3 17.8 -52.9 13.6 16 97 A P H > S+ 0 0 53 0, 0.0 4,-2.9 0, 0.0 -2,-0.2 0.911 117.2 49.5 -59.2 -39.9 17.4 -55.4 16.5 17 98 A L H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.927 109.0 50.8 -63.1 -47.4 18.5 -52.7 18.9 18 99 A A H X S+ 0 0 0 -4,-2.8 4,-0.6 -5,-0.3 -1,-0.2 0.892 115.4 42.7 -59.7 -39.8 16.1 -50.1 17.5 19 100 A R H >< S+ 0 0 109 -4,-2.3 3,-0.9 -5,-0.2 -1,-0.2 0.910 111.7 55.1 -73.2 -39.3 13.2 -52.6 17.8 20 101 A A H 3< S+ 0 0 31 -4,-2.9 4,-0.3 -5,-0.3 -2,-0.2 0.816 98.6 64.0 -61.6 -31.7 14.5 -53.7 21.3 21 102 A F H >< S+ 0 0 1 -4,-2.2 3,-1.6 -5,-0.1 19,-0.3 0.792 77.8 102.0 -63.0 -31.1 14.3 -50.1 22.5 22 103 A L T << S+ 0 0 22 -3,-0.9 19,-0.2 -4,-0.6 137,-0.1 -0.341 90.2 16.3 -59.2 128.0 10.5 -49.9 22.0 23 104 A G T 3 S+ 0 0 13 17,-2.5 -1,-0.3 1,-0.4 -2,-0.1 -0.033 98.7 117.6 98.7 -32.2 8.8 -50.2 25.4 24 105 A Q < - 0 0 10 -3,-1.6 16,-2.5 -4,-0.3 2,-0.5 -0.189 64.4-120.6 -65.4 162.9 12.0 -49.5 27.4 25 106 A V E -BC 39 157A 11 132,-2.5 132,-3.0 14,-0.2 2,-0.4 -0.931 11.9-149.2-116.9 123.4 12.0 -46.4 29.6 26 107 A L E -BC 38 156A 1 12,-2.9 12,-2.2 -2,-0.5 2,-0.4 -0.734 19.2-162.2 -86.2 130.0 14.5 -43.6 29.3 27 108 A V E -BC 37 155A 0 128,-3.0 128,-1.8 -2,-0.4 2,-0.5 -0.954 10.6-168.9-119.8 136.7 15.2 -42.0 32.6 28 109 A R E -BC 36 154A 24 8,-2.7 8,-3.4 -2,-0.4 2,-0.7 -0.970 9.4-155.2-125.3 114.1 16.8 -38.6 33.2 29 110 A R E -B 35 0A 110 124,-2.5 6,-0.3 -2,-0.5 5,-0.1 -0.805 16.3-152.0 -92.2 117.6 17.9 -37.7 36.7 30 111 A L > - 0 0 15 4,-3.3 3,-2.6 -2,-0.7 108,-0.0 -0.395 29.7-101.7 -84.8 163.4 17.9 -33.9 37.2 31 112 A P T 3 S+ 0 0 127 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.813 121.3 62.1 -53.0 -32.5 20.1 -32.0 39.7 32 113 A N T 3 S- 0 0 110 1,-0.1 3,-0.1 2,-0.1 -3,-0.0 0.520 120.9-109.7 -73.7 -1.4 17.2 -31.6 42.1 33 114 A G S < S+ 0 0 29 -3,-2.6 -1,-0.1 1,-0.3 2,-0.0 0.295 78.1 133.7 90.7 -11.0 17.3 -35.4 42.3 34 115 A T - 0 0 58 -5,-0.1 -4,-3.3 1,-0.0 2,-0.5 -0.358 47.8-140.9 -69.6 153.3 14.0 -35.7 40.4 35 116 A E E -B 29 0A 65 -6,-0.3 2,-0.4 -3,-0.1 -6,-0.3 -0.976 4.4-151.4-124.4 127.6 13.8 -38.2 37.6 36 117 A L E -B 28 0A 0 -8,-3.4 -8,-2.7 -2,-0.5 2,-0.4 -0.779 18.4-164.2 -93.5 138.3 12.1 -37.7 34.3 37 118 A R E +BD 27 107A 41 70,-2.1 69,-3.2 -2,-0.4 70,-1.9 -0.986 13.8 171.5-132.2 135.3 10.7 -40.8 32.7 38 119 A G E -BD 26 105A 1 -12,-2.2 -12,-2.9 -2,-0.4 2,-0.5 -0.999 28.2-132.1-142.9 136.4 9.6 -41.6 29.2 39 120 A R E -BD 25 104A 70 65,-3.0 65,-3.3 -2,-0.4 2,-0.4 -0.766 31.0-122.5 -87.9 123.8 8.6 -44.8 27.4 40 121 A I E + D 0 103A 2 -16,-2.5 -17,-2.5 -2,-0.5 63,-0.2 -0.512 41.1 162.4 -68.9 122.5 10.3 -45.1 24.0 41 122 A V E + 0 0 0 61,-2.4 145,-2.2 -2,-0.4 2,-0.3 0.489 61.2 35.8-119.2 -7.2 7.7 -45.4 21.3 42 123 A E E +ED 185 102A 0 60,-1.4 59,-2.3 143,-0.2 60,-1.4 -0.960 59.2 165.4-152.4 131.3 9.6 -44.6 18.1 43 124 A T E -ED 184 100A 0 141,-3.0 141,-3.0 -2,-0.3 2,-0.4 -0.914 17.9-151.3-139.3 165.7 13.2 -45.2 17.0 44 125 A Q E -ED 183 99A 0 55,-2.1 55,-3.2 -2,-0.3 2,-0.2 -0.989 13.3-139.7-145.5 129.4 15.1 -45.0 13.8 45 126 A A E - D 0 98A 0 137,-3.2 2,-0.4 -2,-0.4 53,-0.2 -0.624 9.5-167.5 -94.7 149.5 18.2 -47.0 12.7 46 127 A Y E - D 0 97A 34 51,-2.2 51,-1.8 -2,-0.2 -32,-0.1 -0.994 9.4-158.6-130.9 119.7 21.3 -46.0 10.9 47 128 A L - 0 0 68 -2,-0.4 3,-0.3 1,-0.2 49,-0.2 0.370 34.4-121.4 -87.3 5.1 23.5 -48.9 9.7 48 129 A G S > S+ 0 0 0 47,-0.5 3,-1.0 1,-0.2 6,-0.3 -0.733 70.0 3.4 105.8-150.0 26.8 -47.2 9.2 49 130 A P T 3 S+ 0 0 59 0, 0.0 9,-2.8 0, 0.0 -1,-0.2 0.776 131.2 46.7 -50.8 -39.0 29.2 -46.7 6.2 50 131 A E T 3 S+ 0 0 65 -3,-0.3 2,-1.0 7,-0.2 -2,-0.1 0.679 91.1 92.5 -81.5 -19.6 26.9 -48.4 3.7 51 132 A D X - 0 0 0 -3,-1.0 3,-2.0 1,-0.2 6,-0.2 -0.666 60.3-164.4 -80.4 102.6 23.9 -46.4 4.9 52 133 A E T 3 S+ 0 0 116 -2,-1.0 -1,-0.2 1,-0.3 5,-0.1 0.546 86.0 60.4 -65.5 -6.8 23.7 -43.4 2.6 53 134 A A T 3 S+ 0 0 30 -5,-0.1 -1,-0.3 124,-0.1 2,-0.2 0.485 90.9 92.4 -97.6 -3.1 21.3 -41.7 5.0 54 135 A A S X S- 0 0 1 -3,-2.0 3,-1.7 -6,-0.3 42,-0.0 -0.587 78.4-129.3 -96.0 153.8 23.7 -41.8 7.9 55 136 A H T 3 S+ 0 0 50 1,-0.3 -1,-0.1 -2,-0.2 10,-0.1 0.767 113.2 56.6 -63.7 -25.4 26.3 -39.2 9.2 56 137 A S T > S+ 0 0 0 39,-0.3 3,-1.2 -5,-0.1 -1,-0.3 0.308 77.5 137.5 -91.1 7.9 28.7 -42.1 9.1 57 138 A R G X S+ 0 0 81 -3,-1.7 3,-1.8 1,-0.3 -7,-0.2 -0.205 72.1 16.2 -55.6 145.6 28.2 -42.9 5.4 58 139 A G G 3 S- 0 0 58 -9,-2.8 -1,-0.3 1,-0.3 3,-0.1 0.799 133.4 -68.7 60.6 28.7 31.4 -43.7 3.5 59 140 A G G < S+ 0 0 40 -3,-1.2 -1,-0.3 1,-0.2 2,-0.2 0.657 79.2 172.2 66.4 15.2 33.2 -44.2 6.8 60 141 A R < + 0 0 131 -3,-1.8 2,-0.4 -4,-0.3 -1,-0.2 -0.424 5.7 168.4 -60.1 121.7 33.0 -40.5 7.6 61 142 A Q + 0 0 104 -2,-0.2 5,-0.1 -3,-0.1 -5,-0.1 -0.974 3.9 158.2-142.6 123.8 34.2 -40.3 11.2 62 143 A T - 0 0 67 -2,-0.4 4,-0.4 1,-0.0 -2,-0.0 -0.787 57.8 -92.2-134.7 176.9 35.1 -37.1 13.1 63 144 A P S S+ 0 0 111 0, 0.0 3,-0.3 0, 0.0 4,-0.2 0.785 122.5 58.8 -64.8 -22.3 35.4 -36.0 16.7 64 145 A R S S+ 0 0 101 1,-0.2 3,-0.4 2,-0.1 13,-0.2 0.950 114.6 30.1 -70.0 -52.2 31.8 -34.9 16.5 65 146 A N S >> S+ 0 0 6 1,-0.2 3,-1.5 2,-0.1 4,-0.5 0.186 82.1 117.4 -94.9 18.3 30.2 -38.3 15.6 66 147 A R G >4 + 0 0 116 -4,-0.4 3,-1.9 -3,-0.3 4,-0.4 0.831 63.1 73.1 -53.7 -33.6 32.8 -40.4 17.4 67 148 A G G >4 S+ 0 0 0 -3,-0.4 3,-1.5 1,-0.3 -1,-0.3 0.853 89.8 57.1 -49.6 -40.4 30.0 -41.7 19.6 68 149 A M G <4 S+ 0 0 3 -3,-1.5 27,-1.2 1,-0.3 28,-0.6 0.744 109.4 47.0 -63.4 -24.4 28.6 -43.8 16.8 69 150 A F G << S+ 0 0 25 -3,-1.9 -1,-0.3 -4,-0.5 -2,-0.2 0.345 100.6 85.6 -99.8 4.0 32.0 -45.5 16.5 70 151 A M S < S- 0 0 46 -3,-1.5 4,-0.2 -4,-0.4 3,-0.1 -0.416 96.6 -52.5 -97.3 176.2 32.4 -46.1 20.3 71 152 A K S > S- 0 0 109 -2,-0.1 3,-2.0 1,-0.1 19,-0.2 -0.141 71.4 -88.1 -53.2 138.7 31.1 -49.0 22.4 72 153 A P T 3 S+ 0 0 18 0, 0.0 19,-0.2 0, 0.0 -61,-0.2 -0.155 117.9 38.6 -46.9 132.8 27.4 -49.8 22.1 73 154 A G T 3 S+ 0 0 0 17,-2.2 75,-2.8 1,-0.5 2,-0.2 0.201 84.4 127.6 105.0 -14.6 25.4 -47.8 24.6 74 155 A T B < -J 147 0C 4 -3,-2.0 16,-3.6 73,-0.2 -1,-0.5 -0.554 59.4-123.4 -74.9 139.3 27.6 -44.7 24.0 75 156 A L E -F 89 0A 0 71,-2.7 70,-2.1 68,-0.2 2,-0.5 -0.583 18.4-163.9 -87.6 148.8 25.5 -41.6 23.2 76 157 A Y E +F 88 0A 3 12,-2.8 12,-2.2 -2,-0.2 2,-0.5 -0.948 17.5 174.4-130.7 104.2 25.9 -39.5 20.1 77 158 A V E +F 87 0A 0 -2,-0.5 2,-0.3 10,-0.2 10,-0.2 -0.967 5.3 174.9-115.9 126.1 24.2 -36.2 20.6 78 159 A Y E -F 86 0A 30 8,-1.6 8,-1.7 -2,-0.5 2,-0.4 -0.890 31.1-113.8-131.8 162.6 24.5 -33.5 18.0 79 160 A I E -F 85 0A 75 -2,-0.3 2,-0.4 6,-0.2 6,-0.2 -0.800 31.2-167.2 -95.2 132.4 23.1 -30.0 17.2 80 161 A I E >> +F 84 0A 48 4,-3.5 4,-2.5 -2,-0.4 3,-1.6 -0.943 68.5 2.8-123.8 143.9 20.9 -29.6 14.2 81 162 A Y T 34 S- 0 0 194 -2,-0.4 -1,-0.1 1,-0.3 4,-0.1 0.690 115.4 -84.6 56.6 20.9 19.7 -26.4 12.5 82 163 A G T 34 S+ 0 0 69 2,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.903 127.4 63.4 49.8 46.8 21.9 -24.7 15.0 83 164 A M T <4 S+ 0 0 124 -3,-1.6 2,-0.3 1,-0.4 -2,-0.2 0.405 90.7 50.9-166.5 -26.7 19.0 -24.8 17.4 84 165 A Y E < -F 80 0A 99 -4,-2.5 -4,-3.5 56,-0.0 -1,-0.4 -0.878 61.9-133.0-128.7 160.7 18.0 -28.4 18.4 85 166 A F E -F 79 0A 57 -2,-0.3 2,-0.4 46,-0.3 49,-0.3 -0.795 8.9-157.6-111.3 155.1 19.6 -31.6 19.6 86 167 A C E -F 78 0A 6 -8,-1.7 -8,-1.6 -2,-0.3 2,-0.6 -1.000 12.3-145.4-131.0 131.4 19.2 -35.2 18.4 87 168 A M E +F 77 0A 1 13,-0.4 13,-2.5 -2,-0.4 2,-0.3 -0.889 21.6 173.2-106.8 120.9 19.9 -38.1 20.7 88 169 A N E -FG 76 99A 5 -12,-2.2 -12,-2.8 -2,-0.6 2,-0.5 -0.896 20.2-146.9-122.7 150.3 21.4 -41.3 19.2 89 170 A I E -FG 75 98A 1 9,-2.5 9,-2.1 -2,-0.3 -14,-0.2 -0.979 25.1-119.1-120.6 123.6 22.7 -44.4 21.0 90 171 A S E - 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