==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/DNA 08-JUN-00 1F4R . 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 . 199 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9326.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 129 64.8 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 24.1 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 . 30 15.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 26 13.1 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 4 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 94 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -48.5 -20.7 49.0 39.1 2 83 A L + 0 0 182 1,-0.2 0, 0.0 3,-0.0 0, 0.0 0.755 360.0 37.2 -72.2 -22.7 -19.3 52.4 40.0 3 84 A T S S+ 0 0 79 2,-0.1 155,-0.9 154,-0.0 -1,-0.2 0.590 87.7 124.0-101.5 -17.2 -17.1 52.1 36.9 4 85 A R B -A 157 0A 59 153,-0.2 153,-0.2 1,-0.1 2,-0.2 -0.182 64.9-121.7 -50.5 128.5 -19.6 50.3 34.6 5 86 A L - 0 0 12 151,-3.2 151,-0.3 143,-0.1 2,-0.1 -0.536 37.9-147.4 -71.6 137.3 -20.2 52.1 31.3 6 87 A G >> - 0 0 16 -2,-0.2 3,-1.5 144,-0.0 4,-1.0 -0.341 28.4 -75.1-103.7-175.1 -23.9 52.9 31.0 7 88 A L H 3> S+ 0 0 95 1,-0.3 4,-1.6 2,-0.2 3,-0.3 0.808 121.5 59.7 -43.2 -47.5 -26.7 53.3 28.5 8 89 A E H 34 S+ 0 0 147 1,-0.2 -1,-0.3 2,-0.2 -3,-0.0 0.815 100.7 56.8 -57.9 -33.4 -25.5 56.6 27.2 9 90 A F H <4 S+ 0 0 14 -3,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.915 108.4 45.0 -65.6 -43.7 -22.2 55.2 26.1 10 91 A F H < S+ 0 0 0 -4,-1.0 2,-3.0 -3,-0.3 82,-0.6 0.776 87.1 91.1 -73.3 -28.1 -23.6 52.5 23.9 11 92 A D < + 0 0 76 -4,-1.6 -1,-0.2 61,-0.2 80,-0.1 -0.337 66.7 106.9 -71.2 68.3 -26.2 54.7 22.2 12 93 A Q S S- 0 0 58 -2,-3.0 80,-2.8 81,-0.1 -3,-0.0 -0.932 78.8 -86.9-139.1 158.9 -23.8 55.7 19.3 13 94 A P B > -i 92 0B 61 0, 0.0 4,-2.7 0, 0.0 5,-0.2 -0.354 48.7-100.8 -69.1 155.5 -23.7 54.7 15.7 14 95 A A H > S+ 0 0 5 78,-0.6 4,-3.1 1,-0.2 5,-0.2 0.832 116.4 46.1 -41.0 -56.1 -21.7 51.5 14.8 15 96 A V H > S+ 0 0 47 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.961 116.2 43.0 -59.6 -54.5 -18.5 53.0 13.5 16 97 A P H > S+ 0 0 55 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.896 116.9 50.2 -60.1 -35.7 -18.0 55.5 16.4 17 98 A L H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.934 108.8 49.9 -66.3 -47.7 -19.0 52.8 18.9 18 99 A A H X S+ 0 0 0 -4,-3.1 4,-0.7 -5,-0.2 -1,-0.2 0.899 115.1 44.5 -59.2 -40.1 -16.6 50.2 17.5 19 100 A R H >< S+ 0 0 111 -4,-2.3 3,-0.8 -5,-0.2 -1,-0.2 0.900 111.1 53.9 -71.5 -38.8 -13.8 52.8 17.7 20 101 A A H 3< S+ 0 0 30 -4,-2.5 4,-0.2 -5,-0.3 -2,-0.2 0.803 98.4 65.3 -65.8 -28.1 -14.9 53.8 21.2 21 102 A F H >< S+ 0 0 1 -4,-2.0 3,-1.9 -5,-0.1 19,-0.4 0.808 78.3 98.9 -63.2 -31.7 -14.8 50.2 22.4 22 103 A L T << S+ 0 0 21 -3,-0.8 19,-0.2 -4,-0.7 137,-0.1 -0.375 90.3 19.3 -60.5 129.8 -11.0 50.1 21.9 23 104 A G T 3 S+ 0 0 17 17,-2.5 -1,-0.3 1,-0.4 -2,-0.1 0.061 98.0 115.5 98.4 -27.1 -9.3 50.6 25.2 24 105 A Q < - 0 0 12 -3,-1.9 16,-2.7 -4,-0.2 2,-0.5 -0.381 65.5-123.2 -74.5 157.0 -12.3 49.8 27.3 25 106 A V E -BC 39 157A 14 132,-2.3 132,-3.1 14,-0.2 2,-0.4 -0.900 12.7-147.0-108.4 125.8 -12.2 46.7 29.5 26 107 A L E -BC 38 156A 1 12,-3.5 12,-2.1 -2,-0.5 2,-0.4 -0.757 19.4-160.6 -87.4 133.2 -14.7 43.9 29.2 27 108 A V E -BC 37 155A 0 128,-3.1 128,-2.0 -2,-0.4 2,-0.5 -0.948 12.1-170.1-121.4 137.9 -15.4 42.3 32.5 28 109 A R E -BC 36 154A 22 8,-2.4 8,-3.1 -2,-0.4 2,-0.8 -0.977 10.8-153.6-126.5 117.0 -16.9 38.9 33.2 29 110 A R E -B 35 0A 110 124,-2.8 6,-0.2 -2,-0.5 5,-0.1 -0.819 16.8-155.4 -94.6 111.5 -18.0 37.9 36.7 30 111 A L > - 0 0 11 4,-2.8 3,-1.6 -2,-0.8 108,-0.0 -0.300 29.8-104.1 -79.6 165.0 -17.9 34.2 37.2 31 112 A P T 3 S+ 0 0 122 0, 0.0 -1,-0.1 0, 0.0 4,-0.0 0.827 118.7 65.7 -59.3 -32.6 -19.9 32.2 39.7 32 113 A N T 3 S- 0 0 106 1,-0.1 3,-0.1 2,-0.1 -2,-0.1 0.310 120.0-111.3 -73.9 15.1 -16.9 31.7 42.0 33 114 A G S < S+ 0 0 36 -3,-1.6 -1,-0.1 1,-0.3 2,-0.0 0.269 79.2 132.8 75.4 -15.2 -17.1 35.5 42.4 34 115 A T - 0 0 61 -5,-0.1 -4,-2.8 1,-0.0 2,-0.4 -0.339 47.9-144.1 -66.2 150.9 -13.9 35.8 40.4 35 116 A E E -B 29 0A 68 -6,-0.2 2,-0.3 -3,-0.1 -6,-0.2 -0.979 3.7-150.9-123.5 129.6 -13.9 38.4 37.6 36 117 A L E -B 28 0A 0 -8,-3.1 -8,-2.4 -2,-0.4 2,-0.4 -0.776 17.1-161.7 -96.3 143.8 -12.1 38.0 34.3 37 118 A R E +BD 27 107A 37 70,-1.8 69,-3.0 -2,-0.3 70,-1.6 -0.985 15.4 171.3-134.6 138.2 -10.8 41.1 32.5 38 119 A G E -BD 26 105A 0 -12,-2.1 -12,-3.5 -2,-0.4 2,-0.5 -0.989 26.7-136.1-145.7 132.3 -9.8 41.9 29.0 39 120 A R E -BD 25 104A 68 65,-2.5 65,-3.6 -2,-0.4 2,-0.3 -0.748 32.7-122.0 -86.1 127.9 -9.0 45.2 27.3 40 121 A I E + D 0 103A 1 -16,-2.7 -17,-2.5 -2,-0.5 63,-0.3 -0.558 40.7 162.6 -72.9 130.5 -10.6 45.3 23.9 41 122 A V E + 0 0 0 61,-2.4 145,-2.2 -2,-0.3 2,-0.3 0.447 62.2 40.3-125.3 -8.7 -8.1 45.8 21.0 42 123 A E E +ED 185 102A 0 60,-1.5 59,-2.3 143,-0.3 60,-1.4 -0.978 59.6 155.0-148.3 133.0 -10.1 44.8 17.9 43 124 A T E -ED 184 100A 0 141,-2.9 141,-3.0 -2,-0.3 2,-0.3 -0.927 22.9-145.5-147.2 167.8 -13.7 45.3 16.9 44 125 A E E -ED 183 99A 0 55,-2.1 55,-2.6 -2,-0.3 2,-0.4 -0.999 12.4-135.8-142.0 141.4 -15.8 45.5 13.7 45 126 A A E - D 0 98A 0 137,-3.1 2,-0.5 -2,-0.3 53,-0.2 -0.774 8.9-165.2 -98.7 140.8 -18.8 47.5 12.8 46 127 A Y E - D 0 97A 29 51,-2.3 51,-1.6 -2,-0.4 -32,-0.1 -0.976 6.9-161.6-123.6 110.1 -21.9 46.1 11.0 47 128 A L - 0 0 65 -2,-0.5 3,-0.2 49,-0.2 49,-0.1 0.633 30.1-131.3 -73.1 -15.9 -24.0 48.9 9.7 48 129 A G + 0 0 0 1,-0.2 6,-0.3 3,-0.1 -1,-0.2 -0.894 67.1 11.5 117.4-136.9 -27.2 47.1 9.2 49 130 A P S S+ 0 0 62 0, 0.0 9,-2.4 0, 0.0 -1,-0.2 0.865 131.2 43.0 -56.0 -45.4 -29.7 46.9 6.2 50 131 A E S S+ 0 0 66 -3,-0.2 2,-0.8 7,-0.2 127,-0.1 0.802 94.4 92.6 -74.2 -29.6 -27.4 48.5 3.7 51 132 A D > - 0 0 0 1,-0.2 3,-1.2 5,-0.1 -3,-0.1 -0.545 59.9-165.6 -69.9 106.2 -24.4 46.5 4.9 52 133 A E T 3 S+ 0 0 112 -2,-0.8 -1,-0.2 1,-0.2 5,-0.1 0.528 85.1 59.7 -72.5 -4.1 -24.3 43.4 2.8 53 134 A A T 3 S+ 0 0 26 -5,-0.1 -1,-0.2 124,-0.1 2,-0.2 0.572 90.1 91.4 -97.6 -10.4 -21.9 41.7 5.2 54 135 A A S X S- 0 0 0 -3,-1.2 3,-1.7 -6,-0.3 42,-0.0 -0.506 80.5-127.3 -88.0 153.9 -24.3 41.9 8.1 55 136 A H T 3 S+ 0 0 44 1,-0.3 -1,-0.1 -2,-0.2 10,-0.1 0.786 113.4 58.9 -63.6 -26.8 -26.8 39.3 9.3 56 137 A S T > S+ 0 0 0 39,-0.3 3,-1.1 3,-0.1 -1,-0.3 0.173 76.8 139.6 -89.5 16.6 -29.3 42.2 9.1 57 138 A R G X S+ 0 0 83 -3,-1.7 3,-1.9 1,-0.3 -7,-0.2 -0.300 70.6 16.6 -60.5 146.9 -28.7 42.8 5.4 58 139 A G G 3 S- 0 0 54 -9,-2.4 -1,-0.3 1,-0.3 3,-0.1 0.808 132.2 -69.6 60.1 30.7 -31.8 43.6 3.5 59 140 A G G < S+ 0 0 42 -3,-1.1 -1,-0.3 1,-0.2 -2,-0.2 0.614 81.4 169.8 65.0 10.2 -33.7 44.3 6.7 60 141 A R < + 0 0 135 -3,-1.9 2,-0.3 -11,-0.1 -1,-0.2 -0.373 4.4 172.8 -57.4 126.4 -33.6 40.6 7.5 61 142 A Q + 0 0 105 -3,-0.1 5,-0.1 -2,-0.1 -5,-0.1 -0.926 3.9 156.6-144.2 114.8 -34.8 40.4 11.1 62 143 A T - 0 0 70 -2,-0.3 4,-0.3 1,-0.0 3,-0.0 -0.668 56.9 -92.8-127.8-178.8 -35.4 37.1 12.9 63 144 A P S > S+ 0 0 112 0, 0.0 3,-0.6 0, 0.0 4,-0.2 0.814 120.6 60.6 -68.2 -27.7 -35.6 35.8 16.5 64 145 A R T 3 S+ 0 0 107 1,-0.2 3,-0.3 2,-0.1 13,-0.1 0.932 115.7 29.4 -64.0 -46.4 -31.9 34.8 16.2 65 146 A N T >> S+ 0 0 6 1,-0.2 3,-1.4 2,-0.1 4,-0.6 0.153 79.3 119.6-101.7 19.5 -30.6 38.3 15.6 66 147 A R H X> + 0 0 118 -3,-0.6 3,-1.9 -4,-0.3 4,-0.5 0.852 66.4 70.6 -51.6 -36.8 -33.3 40.3 17.4 67 148 A G H >4 S+ 0 0 0 -3,-0.3 3,-1.8 1,-0.3 -1,-0.3 0.859 89.3 59.4 -47.9 -44.1 -30.5 41.7 19.7 68 149 A M H <4 S+ 0 0 3 -3,-1.4 27,-1.2 1,-0.3 28,-0.8 0.792 109.2 45.7 -56.5 -29.8 -29.1 43.8 16.8 69 150 A F H << S+ 0 0 23 -3,-1.9 -1,-0.3 -4,-0.6 -2,-0.2 0.445 100.5 88.6 -94.0 -1.7 -32.5 45.5 16.7 70 151 A M S << S- 0 0 51 -3,-1.8 4,-0.2 -4,-0.5 3,-0.1 -0.295 95.5 -53.6 -90.4 176.6 -32.9 46.0 20.4 71 152 A K S > S- 0 0 114 1,-0.1 3,-1.9 2,-0.1 -1,-0.2 -0.147 71.7 -89.7 -52.1 139.8 -31.7 48.9 22.6 72 153 A P T 3 S+ 0 0 21 0, 0.0 19,-0.2 0, 0.0 -61,-0.2 -0.226 117.5 39.2 -51.3 134.3 -28.0 49.8 22.2 73 154 A G T 3 S+ 0 0 0 17,-2.1 75,-2.8 1,-0.5 2,-0.3 0.265 84.0 128.3 104.1 -10.0 -25.9 47.9 24.7 74 155 A T B < -J 147 0C 4 -3,-1.9 16,-3.4 73,-0.2 -1,-0.5 -0.644 59.9-122.5 -79.0 136.4 -28.0 44.8 24.2 75 156 A L E -F 89 0A 0 71,-3.0 70,-1.9 -2,-0.3 2,-0.4 -0.503 19.1-164.0 -83.1 148.8 -25.9 41.7 23.4 76 157 A Y E +F 88 0A 2 12,-2.7 12,-2.1 68,-0.2 2,-0.5 -0.907 16.4 174.9-132.6 99.9 -26.3 39.6 20.3 77 158 A V E +F 87 0A 0 -2,-0.4 2,-0.3 10,-0.2 10,-0.2 -0.945 5.9 176.6-111.0 126.5 -24.5 36.3 20.8 78 159 A Y E -F 86 0A 30 8,-1.7 8,-1.7 -2,-0.5 2,-0.4 -0.897 30.0-115.5-131.6 159.6 -24.8 33.7 18.1 79 160 A I E -F 85 0A 74 -2,-0.3 2,-0.4 6,-0.2 6,-0.2 -0.783 30.3-167.9 -93.8 133.2 -23.4 30.2 17.3 80 161 A I E >> +F 84 0A 48 4,-2.9 4,-2.3 -2,-0.4 3,-1.8 -0.956 68.8 1.6-124.6 142.3 -21.2 29.8 14.2 81 162 A Y T 34 S- 0 0 200 -2,-0.4 -1,-0.1 1,-0.3 4,-0.1 0.705 115.1 -84.7 56.0 21.8 -20.1 26.6 12.5 82 163 A G T 34 S+ 0 0 70 2,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.891 126.4 65.6 50.0 43.1 -22.2 24.9 15.1 83 164 A M T <4 S+ 0 0 126 -3,-1.8 2,-0.3 1,-0.4 -2,-0.2 0.451 89.7 47.9-161.8 -23.8 -19.2 25.1 17.5 84 165 A Y E < -F 80 0A 98 -4,-2.3 -4,-2.9 56,-0.0 -1,-0.4 -0.868 62.3-130.0-131.0 164.9 -18.3 28.6 18.4 85 166 A F E -F 79 0A 55 -2,-0.3 2,-0.4 46,-0.2 49,-0.3 -0.809 9.1-157.0-113.7 154.3 -19.8 31.8 19.7 86 167 A C E -F 78 0A 6 -8,-1.7 -8,-1.7 -2,-0.3 2,-0.6 -1.000 12.2-146.8-129.9 128.7 -19.5 35.4 18.4 87 168 A M E +F 77 0A 0 13,-0.4 13,-2.2 -2,-0.4 2,-0.3 -0.876 22.2 170.6-105.0 116.4 -20.2 38.3 20.8 88 169 A N E -FG 76 99A 5 -12,-2.1 -12,-2.7 -2,-0.6 2,-0.5 -0.843 22.7-145.5-118.7 155.8 -21.8 41.5 19.3 89 170 A I E -FG 75 98A 0 9,-2.2 9,-2.2 -2,-0.3 -14,-0.2 -0.986 25.7-119.9-123.8 118.7 -23.1 44.6 21.1 90 171 A S E - 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