==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/DNA 19-MAR-98 1A73 . COMPND 2 MOLECULE: DNA (5'- . SOURCE 2 SYNTHETIC: YES; . AUTHOR K.E.FLICK,R.J.MONNAT JUNIOR,B.L.STODDARD . 324 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15756.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 191 59.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 71 21.9 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 . 5 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 2.5 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 . 25 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 36 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 4 2 0 2 3 1 0 2 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 . 4 4 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 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 2 A A 0 0 137 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -98.8 -11.5 40.1 40.8 2 3 A L - 0 0 32 1,-0.1 2,-0.0 4,-0.1 5,-0.0 -0.326 360.0-126.2 -55.8 134.1 -13.0 38.1 37.9 3 4 A T > - 0 0 73 1,-0.1 4,-2.0 4,-0.0 5,-0.2 -0.312 22.8-103.9 -77.0 170.0 -15.3 35.4 39.5 4 5 A N H > S+ 0 0 123 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.897 124.3 53.5 -61.8 -39.4 -14.9 31.7 38.7 5 6 A A H > S+ 0 0 71 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.896 108.2 50.0 -62.3 -39.4 -17.9 31.9 36.4 6 7 A Q H > S+ 0 0 59 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.860 109.7 50.0 -67.5 -37.0 -16.3 34.8 34.5 7 8 A I H X S+ 0 0 20 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.902 107.8 54.2 -67.2 -40.3 -13.0 32.9 34.1 8 9 A L H X S+ 0 0 54 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.878 106.4 52.4 -60.3 -38.3 -14.9 29.9 32.8 9 10 A A H X S+ 0 0 57 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.860 108.3 50.8 -65.8 -35.9 -16.5 32.2 30.2 10 11 A V H X S+ 0 0 6 -4,-1.4 4,-2.0 2,-0.2 -2,-0.2 0.897 110.4 49.1 -68.7 -39.0 -13.1 33.4 29.1 11 12 A I H X S+ 0 0 6 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.918 111.7 50.1 -67.0 -39.5 -11.9 29.7 28.8 12 13 A D H X S+ 0 0 62 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.907 111.3 46.2 -65.0 -43.4 -15.0 28.9 26.7 13 14 A S H X S+ 0 0 36 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.861 112.7 52.6 -68.4 -32.5 -14.6 31.9 24.3 14 15 A W H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 5,-0.3 0.953 110.2 46.7 -66.1 -48.7 -10.9 31.0 24.0 15 16 A E H X S+ 0 0 7 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.903 109.6 55.3 -59.3 -41.7 -11.7 27.3 23.1 16 17 A E H < S+ 0 0 114 -4,-2.3 4,-0.4 1,-0.2 -1,-0.2 0.890 113.5 40.3 -58.3 -44.9 -14.3 28.5 20.6 17 18 A T H >< S+ 0 0 20 -4,-1.8 3,-1.3 2,-0.2 -2,-0.2 0.924 116.2 47.0 -72.0 -48.3 -11.8 30.7 18.8 18 19 A V H >< S+ 0 0 0 -4,-2.7 3,-2.1 1,-0.3 -2,-0.2 0.843 102.3 67.1 -64.2 -31.8 -8.9 28.3 18.9 19 20 A G T 3< S+ 0 0 18 -4,-2.4 -1,-0.3 -5,-0.3 -2,-0.2 0.766 98.9 52.8 -59.3 -24.7 -11.2 25.5 17.7 20 21 A Q T < S+ 0 0 146 -3,-1.3 -1,-0.3 -4,-0.4 -2,-0.2 0.361 83.1 111.0 -93.7 2.5 -11.5 27.4 14.4 21 22 A F S < S- 0 0 10 -3,-2.1 22,-0.1 1,-0.1 29,-0.0 -0.425 90.5 -79.7 -72.0 152.0 -7.7 27.6 13.8 22 23 A P - 0 0 76 0, 0.0 20,-2.0 0, 0.0 2,-0.7 -0.316 46.8-138.7 -54.0 131.9 -6.4 25.5 10.9 23 24 A V E -A 41 0A 66 18,-0.2 2,-0.5 -3,-0.1 18,-0.2 -0.879 20.6-165.1 -99.1 115.7 -6.2 21.9 12.2 24 25 A I E -A 40 0A 63 16,-3.2 16,-2.6 -2,-0.7 2,-0.6 -0.879 12.7-140.2-108.5 130.8 -3.0 20.3 10.9 25 26 A T E -A 39 0A 76 -2,-0.5 2,-0.4 14,-0.2 14,-0.2 -0.791 22.5-173.6 -90.7 119.8 -2.3 16.5 11.1 26 27 A H E -A 38 0A 64 12,-3.0 12,-2.8 -2,-0.6 2,-0.6 -0.949 19.8-141.2-118.0 137.0 1.3 15.6 12.0 27 28 A H E -A 37 0A 143 -2,-0.4 10,-0.2 10,-0.2 -2,-0.0 -0.860 34.4-178.2 -95.4 120.9 2.8 12.1 12.0 28 29 A V E -A 36 0A 7 8,-1.7 8,-3.0 -2,-0.6 2,-0.2 -0.857 31.9-104.4-128.2 155.5 5.1 11.8 15.0 29 30 A P E -A 35 0A 36 0, 0.0 111,-2.8 0, 0.0 6,-0.2 -0.564 25.4-175.5 -74.9 137.6 7.5 9.4 16.7 30 31 A L E - 0 0 27 4,-2.7 98,-2.7 1,-0.3 99,-0.5 0.500 48.2-101.7-107.3 -9.5 6.0 7.8 19.8 31 32 A G E > S+A 34 0A 1 3,-0.8 3,-1.9 97,-0.2 -1,-0.3 -0.249 98.7 63.4 104.6 162.0 9.2 5.9 20.8 32 33 A G T 3 S- 0 0 60 1,-0.3 3,-0.1 93,-0.2 97,-0.1 0.864 129.1 -64.7 53.6 39.1 10.0 2.2 20.4 33 34 A G T 3 S+ 0 0 80 1,-0.2 -1,-0.3 96,-0.0 2,-0.2 0.339 103.3 131.5 69.0 -6.6 9.9 2.6 16.6 34 35 A L E < -A 31 0A 90 -3,-1.9 -4,-2.7 94,-0.1 -3,-0.8 -0.477 45.0-148.9 -82.6 149.3 6.2 3.4 16.6 35 36 A Q E +A 29 0A 123 -6,-0.2 2,-0.2 -2,-0.2 -8,-0.0 -0.913 17.8 179.5-115.7 142.0 4.6 6.3 14.7 36 37 A G E -A 28 0A 13 -8,-3.0 -8,-1.7 -2,-0.4 2,-0.4 -0.642 23.6-114.9-128.2-172.6 1.5 8.2 15.9 37 38 A T E -A 27 0A 61 -10,-0.2 2,-0.4 -2,-0.2 -10,-0.2 -0.996 21.8-173.9-133.7 134.2 -0.7 11.1 14.7 38 39 A L E -A 26 0A 7 -12,-2.8 -12,-3.0 -2,-0.4 2,-0.7 -0.974 14.4-148.6-126.1 140.2 -1.3 14.4 16.4 39 40 A H E -A 25 0A 52 -2,-0.4 2,-0.3 -14,-0.2 -14,-0.2 -0.902 18.7-165.2-114.5 105.7 -3.8 17.1 15.3 40 41 A C E -A 24 0A 2 -16,-2.6 -16,-3.2 -2,-0.7 2,-0.9 -0.701 17.4-145.1 -94.8 139.4 -2.5 20.6 16.1 41 42 A Y E -A 23 0A 16 -2,-0.3 64,-2.6 -18,-0.2 2,-0.4 -0.859 31.4-156.8-103.6 96.1 -4.7 23.7 16.1 42 43 A E B -B 104 0B 21 -20,-2.0 62,-0.2 -2,-0.9 3,-0.1 -0.644 14.7-133.7 -90.9 125.7 -2.3 26.3 14.8 43 44 A I - 0 0 0 60,-2.3 7,-0.1 -2,-0.4 6,-0.1 -0.444 44.8 -95.8 -67.1 139.2 -2.4 30.0 15.2 44 45 A P - 0 0 35 0, 0.0 -1,-0.1 0, 0.0 5,-0.0 -0.098 23.7-121.6 -56.0 157.2 -1.7 31.8 11.9 45 46 A L S S+ 0 0 125 -3,-0.1 2,-0.3 1,-0.1 4,-0.1 0.708 92.8 17.7 -73.5 -22.6 1.8 33.0 11.0 46 47 A A S S- 0 0 62 2,-0.2 -1,-0.1 3,-0.0 0, 0.0 -0.944 101.2 -33.1-145.4 164.9 0.6 36.6 10.6 47 48 A A S S+ 0 0 74 -2,-0.3 2,-0.1 2,-0.1 -2,-0.1 -0.276 102.6 53.5 -64.2 148.1 -2.3 38.8 11.6 48 49 A P + 0 0 118 0, 0.0 -2,-0.2 0, 0.0 3,-0.1 0.541 61.9 167.7 -81.1 149.5 -5.2 38.4 11.9 49 50 A Y - 0 0 28 4,-0.5 2,-0.2 1,-0.4 5,-0.1 0.766 57.4 -71.8 -95.3 -31.6 -4.7 35.5 14.3 50 51 A G S > S- 0 0 28 3,-0.4 3,-2.3 -7,-0.1 -1,-0.4 -0.687 70.2 -45.3 148.2 159.3 -8.3 35.2 15.7 51 52 A V T 3 S+ 0 0 94 1,-0.3 -34,-0.1 -2,-0.2 3,-0.1 -0.296 127.5 9.5 -56.6 123.5 -10.6 37.1 17.9 52 53 A G T 3 S+ 0 0 20 1,-0.2 12,-2.4 -2,-0.1 2,-0.4 0.295 103.7 117.3 91.3 -7.2 -8.8 38.2 21.1 53 54 A F E < +C 63 0C 15 -3,-2.3 -4,-0.5 10,-0.2 -3,-0.4 -0.788 30.4 163.6-105.1 137.0 -5.3 37.2 19.8 54 55 A A E -C 62 0C 53 8,-1.7 8,-2.5 -2,-0.4 2,-0.5 -0.993 34.9-117.3-144.6 147.2 -2.3 39.4 19.2 55 56 A K E +C 61 0C 81 -2,-0.3 6,-0.3 6,-0.2 -8,-0.0 -0.744 27.1 172.9 -90.8 127.8 1.4 38.5 18.7 56 57 A N E S+ 0 0 84 4,-1.5 5,-0.2 -2,-0.5 -1,-0.1 0.399 70.9 11.0-109.8 -1.6 3.9 39.9 21.3 57 58 A G E > S-C 60 0C 15 3,-1.6 3,-1.8 1,-0.1 -1,-0.2 -0.980 93.0 -81.2-165.7 165.1 6.9 38.1 20.0 58 59 A P T 3 S+ 0 0 122 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.846 131.6 4.4 -41.2 -46.0 8.2 35.9 17.1 59 60 A T T 3 S+ 0 0 74 -3,-0.0 2,-0.4 2,-0.0 -4,-0.0 -0.225 114.7 98.2-135.7 43.9 6.5 32.9 18.6 60 61 A R E < +C 57 0C 124 -3,-1.8 -3,-1.6 16,-0.0 -4,-1.5 -0.995 44.6 174.7-131.6 136.6 4.7 34.5 21.6 61 62 A W E -C 55 0C 6 -2,-0.4 15,-2.7 -6,-0.3 2,-0.3 -0.939 14.4-150.1-138.4 161.7 1.0 35.5 21.7 62 63 A Q E -CD 54 75C 48 -8,-2.5 -8,-1.7 -2,-0.3 2,-0.5 -0.935 9.2-139.9-131.4 155.1 -1.5 36.9 24.2 63 64 A Y E -CD 53 74C 1 11,-3.0 11,-2.5 -2,-0.3 2,-0.4 -0.964 22.8-169.0-116.9 129.6 -5.3 36.6 24.6 64 65 A K E + D 0 73C 98 -12,-2.4 2,-0.4 -2,-0.5 9,-0.2 -0.968 12.2 173.1-128.0 136.6 -7.2 39.6 25.7 65 66 A R E - D 0 72C 82 7,-2.4 7,-2.6 -2,-0.4 2,-0.6 -0.998 22.4-142.6-138.0 138.1 -10.8 40.2 26.9 66 67 A T E - D 0 71C 86 -2,-0.4 2,-0.5 5,-0.2 5,-0.2 -0.917 22.2-176.7-105.1 119.8 -12.4 43.3 28.2 67 68 A I E > - D 0 70C 32 3,-2.5 3,-1.7 -2,-0.6 -2,-0.0 -0.967 68.1 -15.4-122.7 119.6 -14.8 42.6 31.0 68 69 A N T 3 S- 0 0 134 -2,-0.5 -1,-0.2 1,-0.3 3,-0.1 0.926 129.1 -53.9 56.0 44.6 -16.9 45.4 32.7 69 70 A Q T 3 S+ 0 0 194 1,-0.2 2,-0.5 -3,-0.1 -1,-0.3 0.373 115.6 110.9 74.0 -4.8 -14.6 47.9 31.1 70 71 A V E < -D 67 0C 73 -3,-1.7 -3,-2.5 2,-0.0 2,-0.3 -0.904 64.7-131.5-107.7 130.3 -11.4 46.5 32.4 71 72 A V E -D 66 0C 88 -2,-0.5 2,-0.4 -5,-0.2 -5,-0.2 -0.602 22.3-168.9 -78.5 131.6 -8.9 44.9 30.0 72 73 A H E -D 65 0C 42 -7,-2.6 -7,-2.4 -2,-0.3 2,-0.4 -0.966 3.8-174.2-122.7 139.3 -7.6 41.5 30.9 73 74 A R E +D 64 0C 149 -2,-0.4 2,-0.3 -9,-0.2 -9,-0.2 -0.998 4.6 178.6-139.1 141.1 -4.7 39.8 29.1 74 75 A W E -D 63 0C 39 -11,-2.5 -11,-3.0 -2,-0.4 5,-0.1 -0.942 43.0 -90.2-136.4 155.5 -3.1 36.3 29.4 75 76 A G E >> -D 62 0C 19 -2,-0.3 3,-1.4 -13,-0.2 4,-0.6 -0.464 49.4-116.4 -60.9 142.0 -0.3 34.4 27.7 76 77 A S T 34 S+ 0 0 0 -15,-2.7 3,-0.2 1,-0.3 -14,-0.1 0.734 111.1 42.9 -58.5 -28.7 -2.1 32.6 24.8 77 78 A H T 34 S+ 0 0 8 -16,-0.3 -1,-0.3 1,-0.2 4,-0.2 0.485 102.0 71.4 -94.2 -4.9 -1.4 29.1 26.0 78 79 A T T X4 S+ 0 0 32 -3,-1.4 3,-1.3 1,-0.2 -2,-0.2 0.655 71.2 87.3 -85.0 -15.3 -2.2 29.8 29.6 79 80 A V G >< S+ 0 0 0 -4,-0.6 3,-1.8 1,-0.3 4,-0.2 0.865 79.5 59.9 -56.2 -43.3 -5.9 30.2 29.3 80 81 A P G 3 S+ 0 0 11 0, 0.0 3,-0.3 0, 0.0 -1,-0.3 0.811 108.4 48.2 -56.7 -24.9 -6.9 26.5 29.8 81 82 A F G X S+ 0 0 3 -3,-1.3 3,-1.9 1,-0.2 -2,-0.2 0.196 71.3 114.0-103.7 18.6 -5.2 26.6 33.2 82 83 A L T < S+ 0 0 44 -3,-1.8 -1,-0.2 1,-0.3 -3,-0.1 0.675 80.5 49.2 -63.9 -19.7 -6.7 29.8 34.7 83 84 A L T 3 S+ 0 0 73 -3,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.322 99.1 86.8-101.5 9.4 -8.6 27.8 37.4 84 85 A E S < S- 0 0 60 -3,-1.9 230,-0.1 1,-0.1 -3,-0.0 -0.656 93.9 -82.6-105.1 160.6 -5.5 25.8 38.4 85 86 A P - 0 0 75 0, 0.0 -1,-0.1 0, 0.0 228,-0.1 -0.310 36.3-145.6 -57.3 147.0 -2.8 26.6 41.0 86 87 A D S S+ 0 0 104 -4,-0.1 7,-2.6 -3,-0.1 2,-0.3 0.329 74.3 32.2-102.3 6.8 -0.2 28.8 39.3 87 88 A N E -E 92 0D 86 5,-0.3 2,-0.3 27,-0.0 5,-0.2 -0.966 58.7-169.8-152.2 163.2 2.9 27.5 41.1 88 89 A I E > S+E 91 0D 52 3,-2.3 3,-2.3 -2,-0.3 223,-0.1 -0.943 74.9 2.6-158.0 135.8 4.1 24.2 42.5 89 90 A N T 3 S- 0 0 120 -2,-0.3 3,-0.1 1,-0.3 -1,-0.0 0.873 132.2 -58.6 52.9 36.8 7.2 23.3 44.7 90 91 A G T 3 S+ 0 0 78 1,-0.2 2,-0.4 0, 0.0 -1,-0.3 0.649 114.9 119.4 70.5 13.8 7.9 27.1 44.7 91 92 A K E < -E 88 0D 101 -3,-2.3 -3,-2.3 23,-0.0 -1,-0.2 -0.911 69.0-111.6-116.2 141.9 8.1 27.1 40.9 92 93 A T E -E 87 0D 95 -2,-0.4 23,-0.5 -5,-0.2 -5,-0.3 -0.444 33.6-120.8 -68.8 136.9 5.9 29.0 38.5 93 94 A C E -F 114 0E 7 -7,-2.6 2,-0.3 21,-0.1 21,-0.2 -0.594 34.5-171.8 -79.1 141.4 3.6 26.9 36.4 94 95 A T E -F 113 0E 27 19,-2.9 19,-2.2 -2,-0.2 2,-0.6 -0.923 31.3 -97.4-133.7 157.0 4.1 27.2 32.6 95 96 A A E -F 112 0E 22 -2,-0.3 2,-0.5 17,-0.2 17,-0.2 -0.655 40.3-165.4 -78.2 115.4 2.3 26.0 29.4 96 97 A S E -F 111 0E 0 15,-2.9 15,-1.8 -2,-0.6 2,-0.8 -0.909 13.9-138.4-109.1 121.1 4.1 22.9 28.2 97 98 A H E > -F 110 0E 25 -2,-0.5 3,-1.1 13,-0.2 13,-0.2 -0.685 11.6-169.2 -80.8 108.6 3.4 21.6 24.7 98 99 A L T 3 S+ 0 0 1 11,-3.1 40,-0.5 -2,-0.8 41,-0.4 0.739 95.0 49.1 -66.9 -20.0 3.1 17.8 24.7 99 100 A C T 3 S- 0 0 7 10,-0.8 -1,-0.3 2,-0.1 3,-0.1 0.501 102.2-135.6 -95.8 -6.1 3.2 18.2 20.9 100 101 A H < + 0 0 44 -3,-1.1 2,-0.6 9,-0.3 -2,-0.1 0.800 64.3 127.9 54.7 31.2 6.3 20.4 20.9 101 102 A N > - 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