==== 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 13-SEP-07 2R9Q . COMPND 2 MOLECULE: 2'-DEOXYCYTIDINE 5'-TRIPHOSPHATE DEAMINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: AGROBACTERIUM TUMEFACIENS STR.; . AUTHOR R.ZHANG,A.DONG,X.XU,A.SAVCHENKO,A.M.EDWARDS,A.JOACHIMIAK,MID . 1346 20 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 50539.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 872 64.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 446 33.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 5 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 5 0.4 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 . 105 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 110 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 99 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 0.9 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 1 4 1 2 0 3 5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 9 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 PARALLEL BRIDGES PER LADDER . 23 19 12 19 4 4 16 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 8 0 1 9 6 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 9 A R 0 0 158 0, 0.0 3,-0.1 0, 0.0 326,-0.0 0.000 360.0 360.0 360.0 131.3 8.5 73.1 -19.4 2 10 A T + 0 0 124 1,-0.1 2,-0.3 161,-0.0 325,-0.1 0.561 360.0 52.2-108.4 -22.0 6.0 71.4 -17.1 3 11 A T S S+ 0 0 51 323,-0.1 2,-0.3 324,-0.1 161,-0.2 -0.938 79.5 75.1-117.0 147.9 8.4 69.0 -15.3 4 12 A G E S-A 163 0A 0 159,-2.4 159,-2.7 -2,-0.3 2,-0.3 -0.907 77.3 -42.1 141.5-172.4 11.6 70.1 -13.5 5 13 A I E -Ab 162 326A 0 320,-1.7 322,-2.3 -2,-0.3 323,-0.6 -0.725 50.4-116.3-102.6 135.1 12.9 71.9 -10.4 6 14 A L - 0 0 7 155,-1.5 155,-0.2 -2,-0.3 2,-0.2 -0.436 29.4-142.6 -68.2 138.0 11.5 75.1 -8.7 7 15 A A >> - 0 0 7 -2,-0.1 4,-2.2 322,-0.1 3,-0.5 -0.493 35.0 -87.5 -96.6 167.8 13.7 78.1 -8.7 8 16 A D H 3> S+ 0 0 17 25,-1.5 4,-2.1 1,-0.2 5,-0.1 0.760 128.6 52.5 -42.7 -38.9 14.1 80.7 -5.9 9 17 A G H 3> S+ 0 0 14 2,-0.2 4,-1.9 24,-0.2 -1,-0.2 0.936 110.6 46.0 -65.9 -49.2 11.2 82.7 -7.4 10 18 A A H <> S+ 0 0 33 -3,-0.5 4,-1.9 2,-0.2 -2,-0.2 0.807 113.3 50.1 -62.6 -36.6 8.8 79.7 -7.4 11 19 A I H X S+ 0 0 0 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.865 110.7 49.0 -68.7 -41.0 9.9 78.8 -3.8 12 20 A R H X S+ 0 0 99 -4,-2.1 4,-1.7 -5,-0.3 -2,-0.2 0.842 109.4 54.2 -66.1 -31.9 9.3 82.4 -2.7 13 21 A A H X S+ 0 0 53 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.902 104.2 54.1 -62.9 -45.2 5.9 82.0 -4.5 14 22 A L H X>S+ 0 0 4 -4,-1.9 5,-2.5 1,-0.2 6,-1.3 0.879 108.8 48.8 -56.0 -41.1 5.2 78.8 -2.4 15 23 A F H <5S+ 0 0 63 -4,-1.6 3,-0.3 2,-0.2 -1,-0.2 0.849 109.4 51.9 -67.3 -40.2 5.8 80.9 0.8 16 24 A A H <5S+ 0 0 84 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.858 115.3 42.4 -60.6 -40.2 3.5 83.7 -0.5 17 25 A G H <5S- 0 0 47 -4,-2.1 -2,-0.2 -5,-0.1 -1,-0.2 0.465 112.4-119.7 -86.9 -5.2 0.7 81.0 -1.1 18 26 A D T <5S+ 0 0 85 -4,-0.5 -3,-0.2 -3,-0.3 3,-0.1 0.728 81.2 120.6 68.6 25.6 1.4 79.1 2.2 19 27 A K S - 0 0 59 1,-0.1 3,-1.5 -3,-0.1 4,-0.5 -0.341 35.1-112.3 -55.6 151.3 16.3 84.6 6.4 28 36 A V T 3 S+ 0 0 153 1,-0.3 3,-0.2 2,-0.1 -1,-0.1 0.877 119.3 33.7 -60.1 -38.2 17.5 87.1 3.7 29 37 A D T 3 S+ 0 0 98 1,-0.2 -1,-0.3 3,-0.0 8,-0.1 0.136 91.3 103.0-100.3 17.6 19.9 84.4 2.3 30 38 A Q < + 0 0 0 -3,-1.5 7,-2.2 6,-0.1 2,-0.4 0.899 65.6 71.8 -69.2 -40.7 17.6 81.4 3.1 31 39 A V B S-C 36 0A 23 -4,-0.5 5,-0.2 -3,-0.2 -23,-0.1 -0.654 70.3-163.3 -82.9 123.3 16.3 80.9 -0.5 32 40 A Q - 0 0 42 3,-3.1 3,-0.4 -2,-0.4 -2,-0.0 -0.598 36.3 -96.9 -97.8 165.1 18.9 79.4 -2.9 33 41 A P S S+ 0 0 37 0, 0.0 -25,-1.5 0, 0.0 -24,-0.2 0.837 120.8 4.8 -44.9 -46.4 18.8 79.4 -6.7 34 42 A A S S+ 0 0 0 -27,-0.2 2,-0.3 -26,-0.1 -28,-0.1 0.053 131.8 35.8-134.0 25.3 17.4 75.9 -6.8 35 43 A S - 0 0 0 -3,-0.4 -3,-3.1 125,-0.1 2,-0.4 -0.976 64.2-122.2-164.9 170.9 16.8 75.0 -3.1 36 44 A L E -CD 31 159A 0 123,-2.0 123,-2.8 -2,-0.3 2,-0.2 -0.996 23.3-129.7-126.5 131.2 15.8 76.2 0.4 37 45 A D E - D 0 158A 0 -7,-2.2 2,-0.3 -2,-0.4 121,-0.3 -0.534 23.2-137.8 -73.5 142.6 17.8 76.1 3.6 38 46 A L E - D 0 157A 2 119,-2.9 118,-0.6 -2,-0.2 119,-0.6 -0.786 13.7-146.4-104.8 143.3 16.0 74.5 6.6 39 47 A R E - D 0 155A 6 -2,-0.3 51,-2.5 116,-0.2 52,-0.5 -0.906 14.9-115.6-116.8 142.5 16.3 76.0 10.1 40 48 A L B -L 89 0C 0 114,-2.0 113,-2.8 -2,-0.4 49,-0.2 -0.453 27.2-139.9 -72.7 136.6 16.3 74.4 13.4 41 49 A G - 0 0 2 47,-1.7 113,-0.2 2,-0.2 -1,-0.1 0.009 38.0 -81.9 -75.4-164.8 13.5 75.0 15.8 42 50 A S S S+ 0 0 34 110,-0.1 31,-2.6 47,-0.1 32,-0.5 0.516 102.8 61.5 -83.6 -8.4 13.8 75.6 19.6 43 51 A K E -H 72 0B 96 45,-0.3 2,-0.4 29,-0.2 -2,-0.2 -0.961 50.9-171.6-128.9 138.0 13.9 71.8 20.7 44 52 A A E -H 71 0B 0 27,-2.3 27,-3.3 -2,-0.4 2,-0.6 -0.964 15.9-147.6-115.4 141.0 16.2 68.8 20.2 45 53 A Y E -HI 70 86B 36 41,-2.3 41,-2.1 -2,-0.4 2,-0.6 -0.945 10.0-144.0-108.1 112.6 15.3 65.3 21.3 46 54 A R E +HI 69 85B 24 23,-3.1 23,-1.4 -2,-0.6 2,-0.3 -0.686 28.8 179.3 -70.1 117.8 18.2 63.2 22.4 47 55 A V E - I 0 84B 6 37,-2.4 37,-0.8 -2,-0.6 3,-0.1 -0.828 34.9-131.9-119.1 155.9 17.2 59.7 21.3 48 56 A R S S+ 0 0 96 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.767 85.7 14.6 -83.1 -19.8 19.2 56.4 21.6 49 57 A A S S- 0 0 3 35,-0.1 943,-0.2 941,-0.1 -1,-0.2 -0.991 74.1-109.6-149.0 153.7 18.7 55.3 17.9 50 58 A S B -m 992 0D 2 941,-3.0 943,-2.6 -2,-0.3 2,-0.3 -0.452 42.2-178.7 -69.2 155.4 17.7 56.5 14.5 51 59 A F - 0 0 0 941,-0.2 943,-0.1 -2,-0.1 11,-0.0 -0.970 31.0-120.3-154.4 165.9 14.4 55.1 13.1 52 60 A M - 0 0 8 941,-0.4 72,-0.1 -2,-0.3 74,-0.0 -0.972 21.3-143.6-112.1 119.9 11.9 55.1 10.2 53 61 A P - 0 0 1 0, 0.0 -1,-0.1 0, 0.0 71,-0.1 0.925 35.2-155.4 -45.1 -57.2 8.3 56.4 11.0 54 62 A G > - 0 0 13 69,-2.2 3,-1.3 3,-0.1 68,-0.3 -0.133 33.9 -32.4 92.1 167.8 6.5 54.0 8.7 55 63 A P T 3 S+ 0 0 91 0, 0.0 3,-0.1 0, 0.0 68,-0.1 -0.186 127.4 4.1 -60.7 138.7 3.1 54.1 7.0 56 64 A G T 3 S+ 0 0 75 1,-0.2 2,-0.4 66,-0.1 65,-0.0 0.760 103.7 121.7 59.2 28.3 0.3 56.0 8.8 57 65 A T < - 0 0 38 -3,-1.3 65,-2.9 4,-0.0 2,-0.3 -0.984 54.9-144.1-124.8 130.3 2.7 57.0 11.6 58 66 A R > - 0 0 130 -2,-0.4 4,-1.6 63,-0.2 3,-0.4 -0.728 21.7-126.2 -86.8 140.6 3.6 60.5 12.6 59 67 A V H > S+ 0 0 0 -2,-0.3 4,-2.7 1,-0.2 3,-0.2 0.927 110.3 57.5 -50.3 -45.9 7.2 61.2 13.7 60 68 A I H > S+ 0 0 54 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.878 105.4 48.8 -57.6 -38.6 5.9 62.7 16.9 61 69 A D H > S+ 0 0 88 -3,-0.4 4,-0.7 2,-0.2 -1,-0.2 0.862 115.2 43.0 -68.5 -40.2 4.0 59.4 18.0 62 70 A K H >X S+ 0 0 17 -4,-1.6 4,-1.0 -3,-0.2 3,-0.6 0.899 109.0 59.9 -72.6 -39.3 6.9 57.1 17.3 63 71 A L H 3< S+ 0 0 5 -4,-2.7 3,-0.4 1,-0.3 -2,-0.2 0.834 106.0 47.6 -52.8 -40.6 9.2 59.7 19.0 64 72 A N H 3< S+ 0 0 128 -4,-1.5 -1,-0.3 2,-0.2 -2,-0.2 0.687 97.6 69.3 -79.4 -20.9 7.2 59.3 22.2 65 73 A R H << 0 0 125 -4,-0.7 -1,-0.2 -3,-0.6 -2,-0.2 0.814 360.0 360.0 -63.6 -32.0 7.3 55.5 22.0 66 74 A F < 0 0 63 -4,-1.0 -2,-0.2 -3,-0.4 -3,-0.2 0.611 360.0 360.0-109.8 360.0 11.0 55.9 22.7 67 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 68 76 A L 0 0 87 0, 0.0 2,-0.4 0, 0.0 -21,-0.2 0.000 360.0 360.0 360.0 -43.2 13.3 60.9 25.1 69 77 A H E -H 46 0B 43 -23,-1.4 -23,-3.1 2,-0.0 2,-0.4 -0.992 360.0-142.0-123.0 128.1 15.4 63.8 26.6 70 78 A E E -H 45 0B 110 -2,-0.4 2,-0.4 -25,-0.2 -25,-0.2 -0.694 13.5-163.6 -93.0 130.1 14.5 67.3 25.5 71 79 A V E -H 44 0B 31 -27,-3.3 -27,-2.3 -2,-0.4 2,-0.4 -0.947 17.0-130.0-116.0 130.6 17.3 69.8 24.8 72 80 A D E +H 43 0B 99 -2,-0.4 4,-0.2 -29,-0.2 -29,-0.2 -0.702 23.1 178.9 -85.4 129.5 16.7 73.6 24.6 73 81 A L + 0 0 0 -31,-2.6 79,-2.0 -2,-0.4 4,-0.2 0.314 52.3 104.0-109.8 3.2 18.2 75.2 21.5 74 82 A S S S+ 0 0 58 -32,-0.5 -1,-0.1 77,-0.2 3,-0.1 0.878 101.1 17.2 -57.9 -42.5 17.1 78.8 22.1 75 83 A Q S S- 0 0 171 1,-0.2 -1,-0.2 -33,-0.1 2,-0.1 0.654 129.5 -75.2-102.7 -23.4 20.6 79.9 23.3 76 84 A G - 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