==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 12-DEC-05 2FCC . COMPND 2 MOLECULE: DNA (5'-D(*CP*CP*AP*GP*GP*AP*(PED)P*GP*AP*AP*GP*C . SOURCE 2 SYNTHETIC: YES; . AUTHOR G.GOLAN,D.O.ZHARKOV,A.S.FERNANDES,M.L.DODSON,A.K.MCCULLOUGH, . 274 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15910.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 170 62.0 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 . 6 2.2 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 11 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 17.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 97 35.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.1 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 0 0 0 0 3 0 1 0 0 2 0 2 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 . 3 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 T 0 0 75 0, 0.0 2,-0.4 0, 0.0 18,-0.1 0.000 360.0 360.0 360.0 106.4 -6.4 140.2 29.2 2 3 A R - 0 0 39 16,-0.1 2,-0.5 49,-0.0 21,-0.2 -0.985 360.0-155.0-137.4 125.9 -8.1 137.3 27.7 3 4 A I - 0 0 0 -2,-0.4 2,-0.3 19,-0.1 63,-0.0 -0.849 20.3-154.7 -94.7 128.0 -6.8 134.4 25.6 4 5 A N - 0 0 1 -2,-0.5 4,-0.1 1,-0.1 106,-0.1 -0.756 14.8-158.7-102.3 155.6 -9.5 132.9 23.3 5 6 A L + 0 0 15 -2,-0.3 105,-0.1 105,-0.2 3,-0.1 0.378 59.6 105.3-111.3 1.2 -9.4 129.3 22.0 6 7 A T S S- 0 0 5 1,-0.2 2,-0.5 104,-0.1 -2,-0.1 -0.187 87.8 -68.3 -79.9 170.5 -11.8 129.9 19.2 7 8 A L >> - 0 0 110 1,-0.2 3,-3.0 2,-0.1 4,-0.9 -0.442 39.3-145.2 -62.5 113.8 -11.2 130.2 15.4 8 9 A V G >4 S+ 0 0 8 -2,-0.5 3,-0.9 1,-0.3 -1,-0.2 0.850 99.4 58.8 -48.9 -38.4 -9.3 133.4 14.9 9 10 A S G 34 S+ 0 0 43 1,-0.2 -1,-0.3 7,-0.0 -2,-0.1 0.618 103.3 53.7 -70.2 -9.5 -11.0 133.9 11.6 10 11 A E G <4 S+ 0 0 114 -3,-3.0 -1,-0.2 2,-0.1 -2,-0.2 0.634 82.9 114.3 -95.6 -20.2 -14.4 133.9 13.4 11 12 A L S << S- 0 0 4 -4,-0.9 2,-0.1 -3,-0.9 -3,-0.0 -0.155 71.7-113.8 -54.1 146.0 -13.5 136.6 15.9 12 13 A A > - 0 0 2 118,-0.1 4,-2.9 1,-0.1 3,-0.4 -0.459 33.6-105.4 -75.3 153.8 -15.4 139.9 15.8 13 14 A D H > S+ 0 0 19 116,-3.4 4,-2.4 1,-0.2 5,-0.2 0.928 120.9 45.9 -45.7 -54.3 -13.3 142.9 14.8 14 15 A Q H > S+ 0 0 46 115,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.827 114.1 47.6 -64.4 -31.4 -13.2 144.2 18.3 15 16 A H H > S+ 0 0 8 -3,-0.4 4,-2.2 2,-0.2 5,-0.2 0.853 110.1 53.9 -77.1 -31.2 -12.4 140.9 19.9 16 17 A L H X S+ 0 0 0 -4,-2.9 4,-2.1 2,-0.2 -2,-0.2 0.937 110.3 45.6 -65.6 -46.2 -9.7 140.3 17.3 17 18 A M H X S+ 0 0 67 -4,-2.4 4,-1.8 -5,-0.2 5,-0.2 0.911 111.7 53.5 -64.3 -41.7 -7.9 143.6 18.1 18 19 A A H X S+ 0 0 25 -4,-1.7 4,-2.1 -5,-0.2 3,-0.4 0.965 112.0 41.6 -58.3 -57.1 -8.2 143.0 21.8 19 20 A E H X S+ 0 0 1 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.875 109.5 61.3 -61.5 -35.7 -6.6 139.5 21.8 20 21 A Y H < S+ 0 0 22 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.895 114.0 33.6 -58.4 -41.0 -3.9 140.8 19.3 21 22 A R H < S+ 0 0 144 -4,-1.8 -1,-0.2 -3,-0.4 -2,-0.2 0.739 122.1 48.0 -87.9 -21.9 -2.7 143.4 21.8 22 23 A E H >< S+ 0 0 31 -4,-2.1 3,-1.8 -5,-0.2 4,-0.4 0.841 95.3 67.4 -87.6 -37.3 -3.3 141.4 24.9 23 24 A L T >X S+ 0 0 0 -4,-2.7 3,-1.8 1,-0.3 4,-0.5 0.892 94.0 58.9 -55.3 -42.0 -1.8 138.0 24.2 24 25 A P H 3> S+ 0 0 40 0, 0.0 4,-1.4 0, 0.0 3,-0.5 0.717 87.5 77.1 -64.2 -13.2 1.8 139.2 24.1 25 26 A R H <> S+ 0 0 108 -3,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.817 86.9 61.5 -63.1 -27.5 1.4 140.4 27.7 26 27 A V H <> S+ 0 0 1 -3,-1.8 4,-2.6 -4,-0.4 -1,-0.2 0.885 98.2 54.4 -66.6 -38.5 1.8 136.8 28.8 27 28 A F H X S+ 0 0 0 -4,-0.5 4,-2.8 -3,-0.5 -1,-0.2 0.937 111.2 46.8 -60.4 -44.8 5.3 136.5 27.3 28 29 A G H X S+ 0 0 32 -4,-1.4 4,-2.5 2,-0.2 5,-0.2 0.930 109.8 51.9 -62.6 -46.5 6.3 139.6 29.3 29 30 A A H X S+ 0 0 32 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.927 114.5 43.7 -57.8 -43.9 4.8 138.3 32.5 30 31 A V H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 5,-0.3 0.935 111.0 52.6 -68.2 -45.9 6.6 135.0 32.2 31 32 A R H X S+ 0 0 75 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.917 109.0 50.7 -56.3 -43.8 10.0 136.5 31.2 32 33 A K H X S+ 0 0 149 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.876 111.0 50.2 -61.7 -36.2 9.9 138.8 34.2 33 34 A H H <>S+ 0 0 49 -4,-1.4 5,-2.5 -5,-0.2 3,-0.2 0.896 108.1 50.3 -69.2 -41.3 9.2 135.7 36.3 34 35 A V H ><5S+ 0 0 44 -4,-2.7 3,-1.6 1,-0.2 -1,-0.2 0.850 105.2 60.5 -64.6 -31.0 12.1 133.8 34.8 35 36 A A H 3<5S+ 0 0 80 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.887 103.5 49.2 -61.7 -39.6 14.1 136.9 35.7 36 37 A N T 3<5S- 0 0 121 -4,-1.3 -1,-0.3 -3,-0.2 -2,-0.2 0.155 125.6-103.4 -86.3 19.0 13.2 136.4 39.3 37 38 A G T < 5 + 0 0 56 -3,-1.6 -3,-0.2 1,-0.2 -2,-0.1 0.534 66.7 160.0 74.3 5.4 14.3 132.8 39.1 38 39 A K < - 0 0 96 -5,-2.5 2,-0.3 -6,-0.2 -1,-0.2 -0.254 22.7-156.9 -61.9 149.2 10.7 131.5 39.0 39 40 A R > - 0 0 103 1,-0.1 3,-1.3 59,-0.0 4,-0.1 -0.785 31.4-104.9-122.3 165.1 10.1 128.0 37.6 40 41 A V G > S+ 0 0 27 -2,-0.3 3,-1.5 1,-0.3 21,-0.1 0.877 119.7 58.6 -59.4 -37.0 7.0 126.4 36.1 41 42 A R G 3 S+ 0 0 188 1,-0.3 -1,-0.3 -3,-0.0 -3,-0.0 0.687 91.3 71.3 -66.9 -17.7 6.4 124.4 39.3 42 43 A D G < S+ 0 0 89 -3,-1.3 2,-0.3 0, 0.0 -1,-0.3 0.406 91.0 74.2 -80.2 3.6 6.2 127.7 41.3 43 44 A F S < S- 0 0 38 -3,-1.5 0, 0.0 1,-0.2 0, 0.0 -0.820 77.3-131.1-117.6 157.0 2.8 128.4 39.7 44 45 A K + 0 0 194 -2,-0.3 -1,-0.2 2,-0.0 10,-0.0 0.967 34.7 176.8 -63.9 -84.2 -0.7 127.0 40.2 45 46 A I - 0 0 31 9,-0.1 13,-0.1 3,-0.0 10,-0.1 0.925 32.1-118.2 73.9 93.6 -1.8 126.4 36.6 46 47 A S - 0 0 30 8,-0.3 4,-0.1 1,-0.1 8,-0.0 -0.218 11.1-131.0 -57.9 145.4 -5.2 124.8 36.4 47 48 A P S S+ 0 0 130 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.734 94.2 39.5 -71.9 -20.3 -5.2 121.3 34.8 48 49 A T S S- 0 0 87 57,-0.0 -2,-0.1 61,-0.0 10,-0.0 -0.953 101.6 -89.4-129.1 151.0 -8.1 122.5 32.6 49 50 A F + 0 0 5 -2,-0.3 2,-0.3 9,-0.0 6,-0.1 -0.260 51.4 172.3 -57.2 135.6 -8.8 125.8 30.8 50 51 A I - 0 0 42 5,-0.1 2,-0.2 4,-0.1 8,-0.1 -0.975 26.9-140.4-144.3 157.3 -10.7 128.4 32.9 51 52 A L S S+ 0 0 56 -2,-0.3 2,-0.2 -49,-0.1 -49,-0.0 -0.662 75.6 28.3-106.6 167.5 -11.7 132.0 32.7 52 53 A G S > S+ 0 0 57 -2,-0.2 3,-2.4 2,-0.1 4,-0.3 -0.508 115.5 22.7 79.8-151.8 -11.6 134.2 35.7 53 54 A A T 3 S+ 0 0 102 1,-0.3 -2,-0.0 -2,-0.2 0, 0.0 -0.220 133.3 17.8 -52.8 130.4 -9.0 133.4 38.5 54 55 A G T 3> S+ 0 0 35 -9,-0.0 4,-2.0 -5,-0.0 -8,-0.3 0.275 90.5 119.4 91.0 -10.9 -6.1 131.4 37.1 55 56 A H T <4 S+ 0 0 12 -3,-2.4 4,-0.4 2,-0.2 -5,-0.1 0.911 78.7 34.3 -54.9 -53.6 -6.9 132.3 33.5 56 57 A V T >4 S+ 0 0 40 -4,-0.3 3,-1.9 1,-0.2 4,-0.3 0.938 116.6 54.5 -70.5 -44.9 -3.7 134.1 32.5 57 58 A T G >4 S+ 0 0 37 1,-0.3 3,-2.0 2,-0.2 4,-0.4 0.829 93.6 73.7 -56.3 -32.2 -1.5 131.8 34.6 58 59 A F G 3< S+ 0 0 2 -4,-2.0 3,-0.4 1,-0.3 -1,-0.3 0.783 99.9 44.4 -53.6 -29.5 -3.0 128.8 32.8 59 60 A F G X S+ 0 0 0 -3,-1.9 3,-2.7 -4,-0.4 -1,-0.3 0.467 80.3 100.7 -97.4 -0.3 -0.9 129.8 29.8 60 61 A Y T < S+ 0 0 25 -3,-2.0 3,-0.3 -4,-0.3 -1,-0.2 0.819 93.8 37.4 -54.5 -30.3 2.3 130.4 31.6 61 62 A D T 3 S+ 0 0 44 -4,-0.4 40,-1.1 -3,-0.4 -1,-0.3 0.160 109.2 67.1-106.3 20.6 3.5 127.0 30.4 62 63 A K B X> +A 100 0A 20 -3,-2.7 4,-1.7 38,-0.2 3,-0.9 -0.057 52.5 131.3-128.7 36.3 1.9 127.2 27.0 63 64 A L H 3> S+ 0 0 0 36,-2.2 4,-3.2 -3,-0.3 37,-0.2 0.762 71.6 59.1 -61.2 -28.1 3.8 129.9 25.3 64 65 A E H 3> S+ 0 0 46 37,-0.9 4,-1.8 35,-0.2 -1,-0.3 0.842 105.7 50.8 -69.9 -31.2 4.3 127.8 22.1 65 66 A F H <> S+ 0 0 25 36,-1.3 4,-1.5 -3,-0.9 -2,-0.2 0.931 113.6 45.2 -68.5 -42.9 0.6 127.7 21.9 66 67 A L H X S+ 0 0 0 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.895 108.5 55.0 -67.9 -41.2 0.4 131.4 22.2 67 68 A R H X S+ 0 0 77 -4,-3.2 4,-1.3 1,-0.2 -1,-0.2 0.936 111.3 45.8 -57.6 -45.9 3.2 132.1 19.8 68 69 A K H X S+ 0 0 86 -4,-1.8 4,-1.0 1,-0.2 -1,-0.2 0.792 111.9 50.7 -69.2 -29.0 1.4 130.2 17.1 69 70 A R H X S+ 0 0 14 -4,-1.5 4,-2.5 2,-0.2 -1,-0.2 0.870 105.8 55.7 -76.8 -34.9 -1.9 131.8 17.9 70 71 A Q H X S+ 0 0 5 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.836 101.9 57.6 -65.1 -31.4 -0.4 135.3 17.6 71 72 A I H X S+ 0 0 81 -4,-1.3 4,-2.2 -5,-0.2 -1,-0.2 0.915 110.8 43.5 -64.4 -39.5 0.9 134.5 14.1 72 73 A E H X S+ 0 0 109 -4,-1.0 4,-2.6 2,-0.2 -2,-0.2 0.887 111.7 52.6 -71.8 -40.9 -2.8 133.8 13.2 73 74 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.915 111.2 48.6 -60.7 -42.6 -4.1 136.9 15.0 74 75 A I H X S+ 0 0 9 -4,-2.6 4,-2.4 2,-0.2 5,-0.2 0.961 111.4 47.7 -62.2 -51.8 -1.6 139.0 13.1 75 76 A A H X S+ 0 0 50 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.889 113.0 49.6 -57.9 -40.9 -2.4 137.5 9.7 76 77 A E H X S+ 0 0 9 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.938 107.9 53.6 -64.5 -46.8 -6.2 138.0 10.4 77 78 A C H <>S+ 0 0 0 -4,-2.7 5,-2.5 1,-0.2 4,-0.3 0.912 112.4 44.3 -53.7 -44.9 -5.6 141.6 11.5 78 79 A L H ><5S+ 0 0 87 -4,-2.4 3,-1.1 1,-0.2 -1,-0.2 0.882 108.5 57.8 -69.8 -35.8 -3.8 142.3 8.2 79 80 A K H 3<5S+ 0 0 130 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.888 108.1 46.6 -60.0 -39.3 -6.5 140.4 6.1 80 81 A R T 3<5S- 0 0 26 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.489 122.0-105.9 -83.8 -2.2 -9.2 142.7 7.5 81 82 A G T < 5 + 0 0 61 -3,-1.1 -3,-0.2 -4,-0.3 2,-0.1 0.595 59.8 161.7 91.7 9.6 -7.2 145.8 6.8 82 83 A F < - 0 0 47 -5,-2.5 2,-1.2 -6,-0.2 -1,-0.3 -0.447 40.9-134.0 -64.3 137.2 -6.2 146.7 10.4 83 84 A N + 0 0 132 -2,-0.1 -1,-0.1 2,-0.0 2,-0.1 -0.380 42.6 167.2 -89.8 56.4 -3.2 149.1 10.3 84 85 A I - 0 0 18 -2,-1.2 3,-0.1 1,-0.1 -3,-0.0 -0.389 29.5-154.8 -73.7 149.3 -1.2 147.2 13.0 85 86 A K S S+ 0 0 164 1,-0.2 2,-1.1 -2,-0.1 -1,-0.1 0.880 79.3 62.9 -91.8 -44.6 2.4 148.0 13.6 86 87 A D + 0 0 115 1,-0.2 -1,-0.2 -12,-0.0 -2,-0.1 -0.742 54.8 165.8 -87.1 100.9 3.8 144.8 15.1 87 88 A T + 0 0 72 -2,-1.1 2,-0.3 -3,-0.1 -1,-0.2 0.280 58.4 61.0 -98.0 9.1 3.4 142.2 12.3 88 89 A T S S- 0 0 104 -14,-0.0 2,-0.3 3,-0.0 3,-0.1 -0.951 82.7-116.4-132.6 154.1 5.7 139.6 13.9 89 90 A V - 0 0 29 -2,-0.3 3,-0.1 1,-0.1 -2,-0.1 -0.666 42.4-103.5 -85.5 145.1 5.6 137.7 17.2 90 91 A Q - 0 0 71 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 -0.291 41.3 -98.9 -63.9 154.5 8.5 138.4 19.5 91 92 A D + 0 0 108 1,-0.1 -1,-0.1 -3,-0.1 3,-0.1 -0.590 39.5 179.5 -73.8 135.3 11.2 135.7 19.6 92 93 A I > + 0 0 6 -2,-0.3 3,-1.9 1,-0.1 -1,-0.1 0.251 50.4 107.2-120.7 9.7 10.7 133.6 22.7 93 94 A S T 3 S+ 0 0 76 1,-0.3 4,-0.1 4,-0.0 -1,-0.1 0.553 72.1 67.0 -66.2 -5.8 13.6 131.2 22.2 94 95 A D T 3 S+ 0 0 92 -3,-0.1 -1,-0.3 2,-0.1 -2,-0.1 0.646 84.9 88.3 -87.3 -15.8 15.3 132.9 25.1 95 96 A I S < S- 0 0 4 -3,-1.9 5,-0.1 1,-0.1 -3,-0.1 -0.640 96.3 -90.6 -85.6 138.9 12.7 131.6 27.5 96 97 A P >> - 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