==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 01-JUL-08 3DMO . COMPND 2 MOLECULE: CYTIDINE DEAMINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BURKHOLDERIA PSEUDOMALLEI; . AUTHOR SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIOUS DISEASE . 520 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18311.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 336 64.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 6.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 90 17.3 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 . 8 1.5 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 . 27 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 124 23.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.2 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 0 0 0 0 8 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 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 PARALLEL BRIDGES PER LADDER . 4 0 0 0 8 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 ANTIPARALLEL BRIDGES PER LADDER . 0 4 0 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 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 H > 0 0 88 0, 0.0 3,-2.2 0, 0.0 36,-0.0 0.000 360.0 360.0 360.0 59.9 20.0 24.3 -44.0 2 -1 A H T 3 + 0 0 190 1,-0.3 3,-0.0 3,-0.0 0, 0.0 0.731 360.0 40.4 -48.1 -33.9 22.9 25.5 -46.2 3 0 A H T 3 S+ 0 0 191 1,-0.1 2,-0.5 2,-0.0 -1,-0.3 0.311 104.0 75.9-105.5 8.9 25.6 24.3 -43.7 4 1 A M < - 0 0 37 -3,-2.2 -1,-0.1 4,-0.0 2,-0.1 -0.945 64.7-162.6-124.5 108.1 23.9 21.0 -42.7 5 2 A T > - 0 0 84 -2,-0.5 4,-2.1 1,-0.1 5,-0.2 -0.402 33.2-113.7 -79.4 162.6 24.1 18.1 -45.1 6 3 A H H > S+ 0 0 58 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.899 120.6 54.5 -59.0 -40.1 21.8 15.1 -44.9 7 4 A H H > S+ 0 0 130 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.902 108.3 46.9 -59.7 -45.5 24.9 13.1 -44.1 8 5 A A H > S+ 0 0 40 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.876 112.2 50.0 -64.3 -40.8 25.8 15.4 -41.2 9 6 A L H X S+ 0 0 1 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.875 110.2 50.7 -66.9 -38.6 22.2 15.3 -39.8 10 7 A I H X S+ 0 0 15 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.913 107.6 53.2 -64.5 -43.0 22.2 11.5 -40.0 11 8 A E H X S+ 0 0 92 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.871 109.5 49.0 -60.2 -36.8 25.5 11.3 -38.1 12 9 A A H X S+ 0 0 20 -4,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.884 108.8 52.8 -69.0 -38.4 24.0 13.5 -35.4 13 10 A A H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.885 109.0 49.9 -63.7 -39.0 20.9 11.2 -35.2 14 11 A K H X S+ 0 0 44 -4,-2.4 4,-1.1 2,-0.2 -1,-0.2 0.876 110.0 50.0 -67.3 -37.8 23.2 8.2 -34.7 15 12 A A H < S+ 0 0 47 -4,-1.7 4,-0.4 -5,-0.2 3,-0.3 0.894 111.1 50.2 -65.0 -39.8 25.0 10.0 -31.9 16 13 A A H >< S+ 0 0 1 -4,-2.3 3,-1.9 1,-0.2 -2,-0.2 0.915 103.7 59.7 -59.2 -46.7 21.6 10.8 -30.3 17 14 A R H >< S+ 0 0 29 -4,-2.3 3,-1.8 1,-0.3 -1,-0.2 0.807 92.7 66.5 -53.7 -36.0 20.6 7.1 -30.6 18 15 A E T 3< S+ 0 0 121 -4,-1.1 -1,-0.3 1,-0.3 -2,-0.2 0.726 97.7 54.7 -61.1 -22.2 23.5 6.1 -28.4 19 16 A K T < S+ 0 0 53 -3,-1.9 -1,-0.3 -4,-0.4 181,-0.2 0.380 80.3 133.2 -94.6 3.1 21.9 7.9 -25.5 20 17 A A < - 0 0 3 -3,-1.8 2,-0.6 -4,-0.2 26,-0.2 -0.117 50.8-145.3 -54.6 146.0 18.5 6.1 -25.7 21 18 A Y B +a 46 0A 41 24,-2.3 26,-2.9 1,-0.1 3,-0.1 -0.888 46.3 138.5-112.0 93.3 16.9 4.6 -22.6 22 19 A A > + 0 0 8 -2,-0.6 4,-1.8 24,-0.2 5,-0.2 -0.389 0.9 144.2-134.9 59.1 15.3 1.5 -23.9 23 20 A P T 4 S+ 0 0 61 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.624 76.6 51.7 -75.7 -8.9 15.8 -1.4 -21.5 24 21 A Y T 4 S+ 0 0 77 -3,-0.1 -2,-0.1 3,-0.1 25,-0.0 0.915 124.5 20.4 -91.7 -51.6 12.3 -2.8 -22.3 25 22 A S T 4 S- 0 0 30 2,-0.1 3,-0.1 259,-0.0 -3,-0.0 0.743 85.5-145.5 -82.2 -26.7 12.3 -3.0 -26.1 26 23 A N < + 0 0 134 -4,-1.8 2,-0.6 1,-0.2 -4,-0.0 0.755 61.0 127.5 55.7 28.1 16.1 -3.0 -26.4 27 24 A F - 0 0 40 -5,-0.2 2,-0.3 55,-0.0 -1,-0.2 -0.906 46.9-159.6-117.9 99.5 15.4 -1.0 -29.6 28 25 A K - 0 0 84 -2,-0.6 55,-0.5 -3,-0.1 2,-0.4 -0.648 9.8-175.9 -85.8 133.7 17.3 2.2 -29.6 29 26 A V E -C 82 0B 13 -2,-0.3 16,-1.2 -12,-0.1 2,-0.3 -0.967 3.3-166.6-126.7 143.1 16.2 5.1 -31.9 30 27 A G E -CD 81 44B 0 51,-2.3 51,-2.7 -2,-0.4 2,-0.3 -0.949 4.3-175.5-126.9 153.5 17.8 8.5 -32.5 31 28 A A E -CD 80 43B 0 12,-2.5 12,-2.4 -2,-0.3 2,-0.4 -0.984 8.7-161.5-141.5 151.2 16.7 11.7 -34.0 32 29 A A E -CD 79 42B 0 47,-2.2 47,-2.7 -2,-0.3 2,-0.4 -0.978 8.0-164.6-137.8 127.7 18.4 15.0 -34.8 33 30 A L E -CD 78 41B 0 8,-2.6 8,-2.8 -2,-0.4 2,-0.5 -0.907 3.2-159.1-114.5 130.7 16.5 18.2 -35.5 34 31 A V E -CD 77 40B 1 43,-3.0 42,-2.4 -2,-0.4 43,-1.4 -0.956 15.1-146.2-115.1 131.4 18.0 21.3 -37.1 35 32 A T E > -C 75 0B 3 4,-2.6 3,-1.9 -2,-0.5 40,-0.3 -0.264 32.0 -92.5 -90.2 174.7 16.3 24.6 -36.6 36 33 A N T 3 S+ 0 0 91 38,-2.8 39,-0.1 1,-0.3 -1,-0.1 0.790 127.7 45.8 -53.0 -33.5 15.9 27.7 -38.8 37 34 A D T 3 S- 0 0 108 37,-0.3 -1,-0.3 2,-0.1 38,-0.1 0.208 124.2-101.5-100.0 14.1 19.1 29.2 -37.2 38 35 A G S < S+ 0 0 45 -3,-1.9 2,-0.2 1,-0.3 -2,-0.1 0.497 70.8 145.9 86.7 5.2 21.1 26.0 -37.6 39 36 A K - 0 0 108 -5,-0.0 -4,-2.6 1,-0.0 2,-0.4 -0.541 38.2-142.2 -75.2 141.1 20.9 24.7 -34.0 40 37 A V E -D 34 0B 48 -6,-0.2 2,-0.4 -2,-0.2 -6,-0.2 -0.888 12.1-165.1-110.7 132.8 20.8 20.9 -33.7 41 38 A F E -D 33 0B 22 -8,-2.8 -8,-2.6 -2,-0.4 2,-0.3 -0.983 11.2-144.0-118.3 128.5 18.7 19.0 -31.1 42 39 A H E -D 32 0B 53 -2,-0.4 2,-0.3 -10,-0.2 -10,-0.2 -0.634 18.1-176.5 -83.0 144.9 19.3 15.3 -30.2 43 40 A G E +D 31 0B 0 -12,-2.4 -12,-2.5 -2,-0.3 2,-0.3 -0.987 5.2 174.0-137.0 149.5 16.4 13.1 -29.4 44 41 A C E -D 30 0B 0 -2,-0.3 -14,-0.2 -14,-0.2 16,-0.1 -0.959 40.4 -89.8-143.1 161.2 16.2 9.5 -28.3 45 42 A N - 0 0 13 -16,-1.2 -24,-2.3 -2,-0.3 2,-0.4 -0.459 35.1-161.4 -70.6 146.2 13.5 7.1 -27.1 46 43 A V B -aB 21 55A 2 9,-2.7 9,-2.4 -26,-0.2 -24,-0.2 -0.939 12.2-158.2-134.8 109.0 12.9 7.1 -23.4 47 44 A E - 0 0 9 -26,-2.9 2,-0.3 -2,-0.4 4,-0.1 -0.319 7.7-160.3 -91.6 167.6 11.1 4.0 -22.1 48 45 A N - 0 0 2 -2,-0.1 6,-0.2 3,-0.1 5,-0.1 -0.977 33.4-116.2-143.9 150.7 9.0 3.3 -18.9 49 46 A A S S+ 0 0 28 -2,-0.3 2,-0.9 178,-0.2 3,-0.1 0.817 114.7 63.1 -59.6 -32.5 8.0 0.1 -17.2 50 47 A S S > S- 0 0 8 1,-0.1 3,-2.4 211,-0.1 4,-0.2 -0.866 88.6-152.0 -89.6 103.7 4.4 1.2 -18.0 51 48 A Y G > S+ 0 0 34 -2,-0.9 3,-2.1 1,-0.3 262,-0.2 0.748 85.7 70.1 -54.3 -33.5 4.8 1.0 -21.8 52 49 A G G 3 S+ 0 0 20 1,-0.3 -1,-0.3 260,-0.1 -3,-0.1 0.647 95.0 57.6 -61.7 -12.5 2.2 3.7 -22.5 53 50 A L G < S+ 0 0 11 -3,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.398 77.4 120.0-100.0 2.4 4.6 6.3 -21.0 54 51 A C < - 0 0 11 -3,-2.1 2,-0.4 -6,-0.2 -7,-0.2 -0.370 51.4-150.4 -60.9 142.8 7.4 5.6 -23.5 55 52 A N B -B 46 0A 7 -9,-2.4 -9,-2.7 255,-0.1 2,-0.1 -0.966 9.7-126.4-119.4 141.0 8.4 8.6 -25.6 56 53 A C > - 0 0 26 -2,-0.4 4,-2.5 -11,-0.2 -12,-0.2 -0.454 19.8-116.0 -83.5 155.1 9.9 8.4 -29.1 57 54 A A H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -26,-0.2 0.878 113.4 53.9 -51.5 -48.2 13.2 10.0 -30.3 58 55 A E H > S+ 0 0 9 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.919 112.9 43.6 -57.4 -47.0 11.4 12.3 -32.8 59 56 A R H > S+ 0 0 18 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.885 110.3 55.1 -70.1 -38.3 9.2 13.7 -30.1 60 57 A T H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.927 110.1 47.3 -56.6 -48.2 12.1 14.0 -27.6 61 58 A A H X S+ 0 0 0 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.930 115.3 44.8 -59.4 -47.5 14.0 16.1 -30.1 62 59 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.904 112.6 49.6 -66.7 -43.0 11.0 18.4 -30.8 63 60 A F H X S+ 0 0 3 -4,-3.0 4,-2.4 2,-0.2 -1,-0.2 0.880 110.8 52.0 -63.8 -36.5 10.0 18.8 -27.2 64 61 A S H X S+ 0 0 15 -4,-2.1 4,-1.1 -5,-0.2 -2,-0.2 0.914 110.4 47.2 -64.1 -45.2 13.6 19.7 -26.3 65 62 A A H <>S+ 0 0 0 -4,-2.1 5,-2.2 2,-0.2 3,-0.4 0.905 111.2 51.6 -63.1 -43.0 13.7 22.3 -29.1 66 63 A L H ><5S+ 0 0 2 -4,-2.5 3,-1.9 1,-0.2 -2,-0.2 0.922 107.0 53.2 -58.3 -45.4 10.4 23.8 -27.9 67 64 A A H 3<5S+ 0 0 3 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.751 104.5 57.1 -60.6 -25.4 11.7 24.0 -24.3 68 65 A A T 3<5S- 0 0 46 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.399 130.1 -95.0 -86.4 1.1 14.6 26.0 -25.8 69 66 A G T < 5S+ 0 0 26 -3,-1.9 2,-0.3 1,-0.4 -3,-0.2 0.572 78.4 138.8 98.2 11.1 12.2 28.5 -27.3 70 67 A Y < - 0 0 26 -5,-2.2 -1,-0.4 -6,-0.1 -2,-0.1 -0.670 37.0-154.6 -85.3 146.7 11.8 27.3 -30.8 71 68 A R > - 0 0 156 -2,-0.3 3,-2.2 1,-0.1 4,-0.1 -0.726 33.0 -63.2-121.5 163.2 8.2 27.4 -32.0 72 69 A P T 3 S+ 0 0 31 0, 0.0 30,-0.2 0, 0.0 29,-0.1 -0.221 122.9 23.5 -48.4 132.8 6.1 25.6 -34.6 73 70 A G T 3 S+ 0 0 42 28,-2.5 29,-0.1 -3,-0.1 28,-0.1 0.372 91.1 105.7 92.3 -2.6 7.5 26.1 -38.1 74 71 A E < + 0 0 34 -3,-2.2 -38,-2.8 27,-0.4 2,-0.4 0.188 56.5 98.2 -94.4 17.5 11.0 27.0 -36.9 75 72 A F E -C 35 0B 15 -40,-0.3 -40,-0.3 26,-0.2 32,-0.1 -0.894 46.2-174.2-112.7 133.9 12.5 23.6 -38.0 76 73 A A E - 0 0 32 -42,-2.4 31,-1.2 -2,-0.4 2,-0.3 0.866 68.2 -15.5 -86.7 -44.9 14.4 22.9 -41.2 77 74 A A E -Ce 34 107B 0 -43,-1.4 -43,-3.0 29,-0.2 2,-0.4 -0.993 47.4-152.2-160.4 153.5 14.8 19.1 -41.1 78 75 A I E -Ce 33 108B 0 29,-2.1 31,-3.1 -2,-0.3 2,-0.4 -0.999 10.1-158.6-131.7 133.1 14.7 16.1 -38.8 79 76 A A E -Ce 32 109B 0 -47,-2.7 -47,-2.2 -2,-0.4 2,-0.4 -0.923 9.4-168.7-105.6 140.2 16.8 12.9 -39.3 80 77 A V E -Ce 31 110B 0 29,-2.4 31,-2.3 -2,-0.4 2,-0.4 -0.994 6.2-178.7-130.3 136.7 15.6 9.6 -37.6 81 78 A V E +Ce 30 111B 0 -51,-2.7 -51,-2.3 -2,-0.4 2,-0.3 -0.997 9.9 151.6-139.6 138.4 17.6 6.4 -37.4 82 79 A G E -C 29 0B 0 29,-0.9 2,-1.7 -2,-0.4 31,-0.5 -0.942 56.7 -86.2-149.9 175.3 17.1 2.8 -36.0 83 80 A E S S+ 0 0 103 -55,-0.5 2,-0.3 -2,-0.3 29,-0.1 -0.565 77.2 136.0 -85.1 75.4 18.3 -0.7 -36.5 84 81 A T - 0 0 31 -2,-1.7 29,-0.3 2,-0.2 30,-0.2 -0.791 66.0-117.0-123.2 162.7 15.7 -1.5 -39.2 85 82 A H S S+ 0 0 170 -2,-0.3 -1,-0.1 2,-0.1 31,-0.1 0.959 101.4 16.5 -63.7 -56.0 15.7 -3.3 -42.6 86 83 A G S S- 0 0 28 1,-0.2 -2,-0.2 25,-0.1 25,-0.1 -0.352 120.1 -50.4 -97.2-173.4 14.7 -0.2 -44.6 87 84 A P S S- 0 0 36 0, 0.0 -1,-0.2 0, 0.0 25,-0.2 -0.431 78.0 -93.8 -56.3 136.3 14.9 3.5 -43.5 88 85 A I - 0 0 5 23,-1.8 -8,-0.1 -8,-0.3 432,-0.1 -0.257 36.2-135.6 -58.9 137.9 13.1 3.7 -40.1 89 86 A A - 0 0 19 432,-0.1 -1,-0.1 430,-0.1 2,-0.1 -0.869 16.9-127.2 -97.0 119.2 9.4 4.5 -40.3 90 87 A P - 0 0 0 0, 0.0 430,-0.4 0, 0.0 20,-0.0 -0.413 30.0-112.6 -59.4 140.5 8.2 7.1 -37.8 91 88 A C > - 0 0 5 428,-0.1 4,-2.1 1,-0.1 5,-0.1 -0.269 27.6-105.2 -69.1 163.3 5.2 6.0 -35.8 92 89 A G H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 391,-0.4 0.826 119.7 54.9 -59.7 -38.8 1.8 7.7 -36.2 93 90 A A H > S+ 0 0 0 389,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.941 109.7 47.5 -59.2 -49.0 2.0 9.6 -32.9 94 91 A C H > S+ 0 0 0 1,-0.2 4,-3.0 2,-0.2 -2,-0.2 0.868 109.3 54.3 -59.3 -39.2 5.4 11.0 -34.0 95 92 A R H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.877 107.5 50.4 -61.6 -39.5 3.9 11.9 -37.4 96 93 A Q H X S+ 0 0 0 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.897 114.5 43.3 -67.0 -40.1 1.0 13.9 -35.7 97 94 A V H X S+ 0 0 2 -4,-2.0 4,-2.8 2,-0.2 5,-0.4 0.912 112.8 52.9 -72.3 -42.3 3.5 15.8 -33.5 98 95 A M H X S+ 0 0 0 -4,-3.0 4,-2.4 1,-0.2 5,-0.5 0.883 109.1 49.6 -58.3 -39.8 5.9 16.4 -36.5 99 96 A I H X S+ 0 0 3 -4,-2.1 4,-1.1 3,-0.2 -1,-0.2 0.907 115.1 42.7 -71.4 -38.4 3.1 17.8 -38.6 100 97 A E H < S+ 0 0 13 -4,-1.6 -2,-0.2 2,-0.2 -1,-0.2 0.936 125.9 32.0 -69.6 -47.3 1.9 20.2 -35.8 101 98 A L H < S+ 0 0 1 -4,-2.8 -28,-2.5 -29,-0.1 -27,-0.4 0.834 132.9 29.7 -82.8 -32.8 5.4 21.4 -34.7 102 99 A G H < S- 0 0 4 -4,-2.4 -3,-0.2 -5,-0.4 -2,-0.2 0.633 102.8-131.0-100.4 -15.9 7.2 21.2 -38.0 103 100 A K >< - 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