==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 29-JAN-12 4DHK . COMPND 2 MOLECULE: DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BURKHOLDERIA THAILANDENSIS; . AUTHOR SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIOUS DISEASE (S . 330 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18095.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 222 67.3 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 . 114 34.5 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 . 2 0.6 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-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 . 35 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 22 6.7 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 2 0 0 0 0 0 0 2 0 0 0 0 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 . 2 4 4 6 3 0 1 0 2 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 . 2 0 0 2 2 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 3 A I 0 0 116 0, 0.0 158,-0.2 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 135.8 -46.1 21.6 42.7 2 4 A K - 0 0 14 156,-2.6 156,-0.4 40,-0.1 2,-0.1 -0.517 360.0-128.8 -85.3 147.9 -44.4 18.3 41.6 3 5 A S > - 0 0 31 -2,-0.2 4,-2.7 39,-0.1 39,-0.2 -0.290 25.1 -98.2 -95.5 173.3 -46.4 15.0 41.6 4 6 A D H > S+ 0 0 46 37,-2.2 4,-2.3 1,-0.2 5,-0.2 0.859 123.7 55.1 -57.4 -37.4 -45.9 11.4 42.9 5 7 A K H > S+ 0 0 143 36,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.933 110.7 45.2 -60.6 -47.6 -44.7 10.3 39.4 6 8 A W H > S+ 0 0 27 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.926 110.5 53.0 -61.8 -45.1 -42.1 13.1 39.4 7 9 A I H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.928 110.1 48.8 -57.3 -48.0 -40.9 12.3 43.0 8 10 A R H X S+ 0 0 77 -4,-2.3 4,-2.5 2,-0.2 5,-0.3 0.929 110.5 50.9 -53.6 -48.4 -40.5 8.6 42.0 9 11 A R H X S+ 0 0 112 -4,-2.1 4,-2.8 1,-0.2 5,-0.4 0.930 112.1 46.9 -57.5 -46.7 -38.5 9.7 39.0 10 12 A M H X S+ 0 0 22 -4,-2.6 6,-1.8 2,-0.2 4,-1.2 0.796 112.5 48.9 -69.8 -31.3 -36.2 11.9 41.0 11 13 A A H X S+ 0 0 10 -4,-2.0 4,-1.2 4,-0.3 -2,-0.2 0.952 119.2 36.9 -72.1 -50.2 -35.6 9.3 43.8 12 14 A E H < S+ 0 0 133 -4,-2.5 -2,-0.2 -5,-0.2 -3,-0.2 0.860 127.6 33.8 -73.6 -36.6 -34.7 6.5 41.4 13 15 A E H < S+ 0 0 129 -4,-2.8 -3,-0.2 -5,-0.3 -1,-0.2 0.753 135.3 20.0 -92.1 -29.7 -32.8 8.5 38.7 14 16 A H H < S- 0 0 116 -4,-1.2 -3,-0.2 -5,-0.4 -2,-0.2 0.252 95.2-119.4-127.5 12.1 -31.1 11.2 40.8 15 17 A K < + 0 0 32 -4,-1.2 -4,-0.3 1,-0.1 -3,-0.1 0.854 54.2 156.4 57.7 36.6 -31.1 9.8 44.4 16 18 A M + 0 0 1 -6,-1.8 82,-2.0 1,-0.2 2,-0.4 0.879 69.4 25.1 -62.7 -37.1 -33.2 12.7 45.7 17 19 A I E S-A 97 0A 3 80,-0.2 -1,-0.2 -10,-0.1 80,-0.2 -0.996 80.3-147.4-132.9 125.8 -34.5 10.6 48.6 18 20 A E E S+A 96 0A 96 78,-2.3 78,-3.0 -2,-0.4 2,-0.2 -0.973 83.6 25.2-146.5 127.2 -32.7 7.7 50.2 19 21 A P S S- 0 0 65 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 0.619 93.6-174.8 -72.9 156.6 -34.0 5.3 51.4 20 22 A F - 0 0 43 -2,-0.2 -2,-0.0 -3,-0.1 -12,-0.0 -0.954 22.2-162.9-127.0 138.7 -37.1 5.7 49.3 21 23 A V - 0 0 32 -2,-0.4 18,-1.1 1,-0.1 4,-0.1 -0.992 12.6-151.1-118.6 134.3 -40.5 4.0 49.2 22 24 A P S S+ 0 0 50 0, 0.0 2,-0.3 0, 0.0 -14,-0.1 0.552 77.3 35.9 -79.0 -9.8 -42.7 4.5 46.1 23 25 A D S S- 0 0 94 14,-0.0 16,-0.6 0, 0.0 2,-0.4 -0.821 97.4 -78.2-133.5 172.3 -46.0 4.0 47.9 24 26 A Q E -F 38 0B 82 -2,-0.3 2,-0.6 14,-0.2 14,-0.2 -0.621 37.2-153.9 -71.3 126.4 -47.6 4.8 51.3 25 27 A V E +F 37 0B 39 12,-3.3 12,-1.9 -2,-0.4 3,-0.1 -0.948 21.2 169.0-103.3 121.4 -46.5 2.3 54.0 26 28 A R E + 0 0 64 -2,-0.6 8,-1.5 10,-0.2 2,-0.3 0.360 57.6 39.2-114.9 -0.3 -49.3 2.2 56.6 27 29 A A E S-F 33 0B 44 6,-0.2 6,-0.2 8,-0.1 -1,-0.1 -0.989 74.1-116.8-151.4 154.2 -48.2 -0.8 58.7 28 30 A A > - 0 0 30 4,-2.6 3,-2.2 -2,-0.3 -2,-0.1 -0.258 48.0 -86.6 -82.3 176.7 -45.1 -2.4 60.2 29 31 A E T 3 S+ 0 0 119 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.869 130.6 51.2 -50.3 -42.2 -43.6 -5.9 59.3 30 32 A D T 3 S- 0 0 113 1,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.458 122.1-104.0 -73.0 -6.6 -45.9 -7.4 62.0 31 33 A G S < S+ 0 0 58 -3,-2.2 -2,-0.1 1,-0.3 2,-0.1 0.391 71.5 149.2 89.4 -3.6 -49.1 -5.7 60.7 32 34 A R - 0 0 123 1,-0.1 -4,-2.6 -5,-0.1 -1,-0.3 -0.431 54.0-110.4 -62.3 134.5 -49.0 -3.1 63.5 33 35 A R E -F 27 0B 84 -6,-0.2 2,-0.3 -2,-0.1 -6,-0.2 -0.461 42.7-178.1 -70.0 134.9 -50.6 0.2 62.5 34 36 A I E - 0 0 23 -8,-1.5 2,-0.5 -2,-0.2 3,-0.0 -0.865 41.3 -88.9-125.2 167.2 -48.0 3.1 62.1 35 37 A V E - 0 0 18 -2,-0.3 117,-2.7 117,-0.1 -10,-0.1 -0.662 66.7-107.2 -74.8 125.0 -48.1 6.7 61.2 36 38 A S E + 0 0 26 -2,-0.5 2,-0.3 115,-0.2 -10,-0.2 -0.132 43.0 178.2 -71.2 149.3 -47.8 6.4 57.5 37 39 A Y E +F 25 0B 36 -12,-1.9 -12,-3.3 115,-0.1 2,-0.2 -0.890 29.9 63.6-136.6 171.7 -44.8 7.3 55.4 38 40 A G E S-FG 24 45B 0 7,-2.4 7,-2.9 -2,-0.3 -14,-0.2 -0.560 85.7 -11.4 109.0-173.5 -43.7 7.2 51.8 39 41 A T E - G 0 44B 6 -18,-1.1 5,-0.2 -16,-0.6 2,-0.2 -0.372 60.4-169.6 -66.8 138.4 -44.7 8.8 48.6 40 42 A S E > - G 0 43B 30 3,-2.9 3,-0.9 -17,-0.1 -1,-0.0 -0.686 40.8 -87.0-122.0 176.1 -47.9 10.6 48.6 41 43 A S T 3 S+ 0 0 75 1,-0.3 -37,-2.2 -2,-0.2 -36,-0.2 0.860 122.2 3.5 -57.8 -46.4 -50.0 12.1 45.7 42 44 A Y T 3 S+ 0 0 133 -39,-0.2 116,-0.3 -38,-0.1 2,-0.3 -0.208 133.3 16.2-134.8 44.0 -48.2 15.5 45.7 43 45 A G E < S-G 40 0B 0 -3,-0.9 -3,-2.9 114,-0.1 2,-0.4 -0.976 74.4 -92.3 175.4-173.9 -45.4 15.0 48.3 44 46 A Y E -GH 39 156B 0 112,-2.0 112,-3.1 -2,-0.3 2,-0.8 -0.985 22.4-140.6-134.8 124.6 -43.4 12.7 50.4 45 47 A D E -GH 38 155B 10 -7,-2.9 -7,-2.4 -2,-0.4 110,-0.2 -0.722 27.1-154.6 -84.7 109.6 -44.1 11.6 54.0 46 48 A I E - H 0 154B 0 108,-1.7 107,-2.5 -2,-0.8 108,-1.2 -0.503 5.1-128.9 -86.8 155.1 -40.8 11.5 55.9 47 49 A R E - H 0 152B 34 105,-0.3 47,-2.0 -2,-0.2 48,-0.4 -0.786 10.9-126.9-103.0 148.2 -39.9 9.4 58.9 48 50 A C B -J 93 0C 0 103,-2.0 102,-3.3 100,-0.4 103,-0.4 -0.723 26.9-138.6 -85.5 132.3 -38.4 10.4 62.3 49 51 A A - 0 0 3 43,-2.9 43,-0.1 -2,-0.4 102,-0.1 -0.347 25.9-102.8 -82.3 180.0 -35.3 8.4 63.2 50 52 A D S S+ 0 0 36 99,-0.1 28,-2.0 -2,-0.1 2,-0.6 0.282 90.3 94.3 -94.8 11.1 -34.8 7.1 66.7 51 53 A E E +B 77 0A 95 26,-0.2 41,-0.5 41,-0.2 2,-0.3 -0.892 54.5 178.1-106.0 116.9 -32.2 9.6 68.0 52 54 A F E -B 76 0A 3 24,-3.6 24,-2.4 -2,-0.6 2,-0.5 -0.823 27.6-151.1-118.3 155.4 -33.7 12.6 69.8 53 55 A K E -BC 75 90A 59 37,-2.8 37,-2.6 -2,-0.3 2,-0.5 -0.968 18.7-160.4-122.9 115.5 -32.5 15.7 71.6 54 56 A I E -BC 74 89A 25 20,-2.7 20,-2.9 -2,-0.5 35,-0.2 -0.815 22.2-118.7-100.7 125.2 -34.9 16.7 74.4 55 57 A F E -B 73 0A 35 33,-2.0 2,-0.4 -2,-0.5 18,-0.3 -0.362 30.3-170.3 -61.3 137.0 -34.6 20.3 75.5 56 58 A T - 0 0 29 16,-2.6 -1,-0.0 2,-0.1 31,-0.0 -0.999 19.9-164.6-128.1 134.3 -33.7 20.8 79.2 57 59 A N > + 0 0 120 -2,-0.4 3,-1.6 2,-0.0 2,-0.2 0.314 48.8 130.3 -92.6 9.1 -33.7 24.1 81.0 58 60 A I T 3 S+ 0 0 110 1,-0.3 -2,-0.1 14,-0.1 3,-0.1 -0.419 80.1 1.1 -72.0 133.7 -31.7 22.8 83.9 59 61 A N T 3 S+ 0 0 166 1,-0.2 2,-0.3 -2,-0.2 -1,-0.3 0.660 114.7 100.3 64.9 19.7 -28.7 24.9 84.8 60 62 A S < - 0 0 53 -3,-1.6 -1,-0.2 1,-0.1 3,-0.1 -0.890 46.6-173.5-130.8 160.7 -29.6 27.5 82.1 61 63 A T + 0 0 144 1,-0.3 2,-0.3 -2,-0.3 -1,-0.1 0.507 69.5 33.7-126.6 -14.5 -31.3 30.9 82.1 62 64 A I - 0 0 138 2,-0.0 2,-0.6 -5,-0.0 -1,-0.3 -0.998 62.2-133.5-150.0 141.5 -31.6 31.8 78.4 63 65 A V - 0 0 97 -2,-0.3 5,-0.1 -3,-0.1 -6,-0.0 -0.916 28.2-172.2 -91.1 119.8 -32.2 30.2 75.0 64 66 A D > - 0 0 72 -2,-0.6 3,-2.4 3,-0.2 -2,-0.0 -0.887 12.1-168.7-118.5 97.3 -29.6 31.8 72.7 65 67 A P T 3 S+ 0 0 111 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.712 88.3 55.5 -62.5 -22.2 -30.2 30.8 69.1 66 68 A K T 3 S+ 0 0 191 1,-0.2 -2,-0.0 2,-0.0 0, 0.0 0.493 111.2 45.9 -84.6 -6.3 -26.8 32.3 68.0 67 69 A N S < S- 0 0 112 -3,-2.4 -3,-0.2 2,-0.0 -1,-0.2 -0.450 79.7-171.3-130.3 59.2 -25.0 30.1 70.6 68 70 A F - 0 0 121 -3,-0.5 2,-0.5 -5,-0.1 3,-0.1 -0.315 9.8-162.4 -55.7 126.6 -26.7 26.7 70.1 69 71 A D > - 0 0 92 1,-0.1 3,-2.4 -5,-0.0 -1,-0.1 -0.953 24.0-155.7-126.0 112.3 -25.4 24.5 73.0 70 72 A E G > S+ 0 0 105 -2,-0.5 3,-1.4 1,-0.3 -1,-0.1 0.743 92.7 74.2 -55.9 -24.2 -25.6 20.7 73.0 71 73 A G G 3 S+ 0 0 57 1,-0.3 -1,-0.3 -3,-0.1 -3,-0.0 0.630 85.0 62.9 -64.7 -14.0 -25.5 21.0 76.8 72 74 A S G < S+ 0 0 18 -3,-2.4 -16,-2.6 -15,-0.1 2,-0.3 0.235 97.8 71.9 -98.8 18.2 -29.1 22.3 76.8 73 75 A F E < -B 55 0A 20 -3,-1.4 2,-0.5 -18,-0.3 -18,-0.2 -0.975 69.3-143.4-129.4 144.5 -30.3 18.9 75.4 74 76 A V E -B 54 0A 81 -20,-2.9 -20,-2.7 -2,-0.3 2,-0.3 -0.937 26.1-130.7 -99.4 123.1 -30.6 15.4 76.8 75 77 A D E +B 53 0A 117 -2,-0.5 2,-0.4 -22,-0.2 -22,-0.2 -0.566 30.1 178.5 -70.8 134.4 -29.8 12.7 74.2 76 78 A F E -B 52 0A 79 -24,-2.4 -24,-3.6 -2,-0.3 2,-0.5 -0.983 12.1-171.3-140.4 127.9 -32.4 10.0 74.0 77 79 A K E +B 51 0A 124 -2,-0.4 2,-0.3 -26,-0.2 -26,-0.2 -0.984 38.2 100.8-118.8 122.8 -32.4 7.0 71.7 78 80 A G S S- 0 0 16 -28,-2.0 3,-0.1 -2,-0.5 71,-0.1 -0.984 77.5 -87.5 176.5 174.7 -35.5 4.8 71.5 79 81 A D S S+ 0 0 114 -2,-0.3 70,-2.7 1,-0.2 2,-0.4 0.786 111.8 32.2 -73.3 -30.8 -38.7 3.9 69.8 80 82 A V E S-K 148 0D 44 68,-0.2 2,-0.4 -30,-0.1 -1,-0.2 -0.976 71.4-155.7-133.8 117.3 -40.9 6.5 71.5 81 83 A C E -K 147 0D 0 66,-2.6 66,-2.1 -2,-0.4 2,-0.6 -0.764 8.8-147.4 -91.2 140.1 -39.6 9.9 72.6 82 84 A I E -K 146 0D 104 -2,-0.4 64,-0.2 64,-0.2 -2,-0.0 -0.949 9.4-158.7-107.8 117.6 -41.4 11.8 75.4 83 85 A I E -K 145 0D 0 62,-2.9 62,-2.2 -2,-0.6 3,-0.1 -0.869 24.1-118.2 -95.0 125.3 -41.4 15.6 75.0 84 86 A P > - 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