==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 18-OCT-04 1XS1 . COMPND 2 MOLECULE: DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR E.JOHANSSON,M.FANO,J.H.BYNCK,J.NEUHARD,S.LARSEN, . 1158 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 38126.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 765 66.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 2.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 288 24.9 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.5 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 . 115 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 119 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 117 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 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 6 0 0 0 0 0 6 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 20 22 12 6 0 6 4 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 . 8 6 1 11 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 1 A M 0 0 82 0, 0.0 2,-0.3 0, 0.0 356,-0.2 0.000 360.0 360.0 360.0 119.1 -2.8 1.2 1.1 2 2 A R B -a 357 0A 6 354,-1.1 356,-2.2 159,-0.2 2,-0.3 -0.755 360.0-107.6 -94.8 148.7 -1.9 4.3 3.1 3 3 A L - 0 0 4 157,-2.5 157,-0.3 -2,-0.3 2,-0.1 -0.573 31.0-136.8 -68.9 127.5 -1.2 7.6 1.5 4 4 A C > - 0 0 2 -2,-0.3 4,-2.4 1,-0.1 3,-0.4 -0.324 34.4 -93.7 -73.4 169.0 2.5 8.6 1.5 5 5 A D H > S+ 0 0 0 25,-2.1 4,-2.4 1,-0.3 5,-0.2 0.869 124.7 53.3 -56.2 -43.9 3.3 12.2 2.5 6 6 A R H > S+ 0 0 164 24,-0.2 4,-1.4 1,-0.2 -1,-0.3 0.893 111.5 46.8 -62.4 -34.2 3.5 13.4 -1.2 7 7 A D H > S+ 0 0 48 -3,-0.4 4,-2.9 2,-0.2 5,-0.3 0.910 107.8 54.3 -80.0 -34.1 -0.0 12.1 -1.8 8 8 A I H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 5,-0.3 0.958 106.8 53.8 -56.9 -45.8 -1.4 13.5 1.4 9 9 A E H X S+ 0 0 28 -4,-2.4 4,-1.2 1,-0.2 -1,-0.2 0.882 110.5 46.9 -56.1 -36.1 -0.1 16.9 0.2 10 10 A A H X S+ 0 0 47 -4,-1.4 4,-3.6 2,-0.2 5,-0.3 0.902 110.1 50.2 -76.5 -40.9 -2.0 16.4 -3.1 11 11 A W H X>S+ 0 0 44 -4,-2.9 4,-1.5 2,-0.2 6,-1.0 0.919 112.2 49.1 -60.8 -40.0 -5.3 15.3 -1.5 12 12 A L H <5S+ 0 0 16 -4,-2.8 -1,-0.2 -5,-0.3 -2,-0.2 0.854 113.0 49.7 -64.4 -32.2 -5.0 18.4 0.7 13 13 A D H <5S+ 0 0 116 -4,-1.2 -2,-0.2 -5,-0.3 -1,-0.2 0.889 107.6 49.4 -76.2 -40.3 -4.3 20.3 -2.5 14 14 A E H <5S- 0 0 125 -4,-3.6 -1,-0.2 1,-0.1 -2,-0.2 0.820 107.6-138.9 -67.1 -22.0 -7.3 18.9 -4.4 15 15 A G T <5S+ 0 0 46 -4,-1.5 -3,-0.2 -5,-0.3 -4,-0.1 0.474 74.0 110.6 83.5 7.2 -9.2 19.9 -1.3 16 16 A R S - 0 0 69 0, 0.0 3,-3.0 0, 0.0 4,-0.1 -0.145 34.5 -91.1 -75.0 170.5 3.2 22.6 7.4 25 25 A V G > S+ 0 0 68 1,-0.3 3,-1.6 2,-0.2 -16,-0.0 0.806 124.7 65.8 -55.9 -29.2 5.5 20.4 5.3 26 26 A E G 3 S+ 0 0 120 1,-0.3 -1,-0.3 3,-0.0 344,-0.1 0.748 104.4 46.6 -60.0 -24.0 7.7 19.8 8.4 27 27 A R G < S+ 0 0 35 -3,-3.0 7,-2.2 1,-0.1 2,-0.4 0.040 99.6 73.8-109.6 13.2 4.7 18.0 10.0 28 28 A I E < +F 33 0C 1 -3,-1.6 2,-0.3 5,-0.2 5,-0.2 -0.934 64.0 131.6-130.4 111.4 3.8 15.8 7.0 29 29 A N E > -F 32 0C 9 3,-2.3 3,-3.0 -2,-0.4 2,-0.6 -0.985 56.2 -1.1-156.5 159.9 6.2 12.9 6.4 30 30 A G T 3 S- 0 0 3 333,-0.6 -25,-2.1 -2,-0.3 -24,-0.2 -0.410 127.5 -35.7 62.2-107.1 6.4 9.2 5.8 31 31 A A T 3 S+ 0 0 1 -2,-0.6 129,-0.4 -27,-0.3 2,-0.3 -0.038 120.9 75.7-134.6 28.5 2.7 8.3 5.8 32 32 A T E < -F 29 0C 1 -3,-3.0 -3,-2.3 127,-0.1 2,-0.4 -0.981 57.1-146.9-141.5 155.9 1.4 10.6 8.5 33 33 A V E -FG 28 158C 0 125,-2.1 125,-3.1 -2,-0.3 -5,-0.2 -0.976 32.4-127.8-108.1 129.2 0.4 14.2 9.4 34 34 A D E - G 0 157C 15 -7,-2.2 2,-0.3 -2,-0.4 123,-0.3 -0.474 22.5-157.0 -71.5 150.7 1.1 15.2 13.1 35 35 A V E - G 0 156C 1 121,-1.7 120,-2.3 -2,-0.1 121,-1.8 -0.885 3.5-140.3-126.2 159.0 -1.7 16.7 15.2 36 36 A R E - G 0 154C 85 -2,-0.3 58,-3.6 118,-0.3 59,-0.5 -0.781 21.8 -99.6-119.5 158.1 -1.6 19.0 18.2 37 37 A L B -J 93 0D 2 116,-1.9 115,-2.9 56,-0.3 56,-0.2 -0.558 30.8-151.1 -78.9 135.6 -3.5 19.3 21.4 38 38 A G - 0 0 11 54,-2.7 56,-0.2 -2,-0.2 115,-0.1 0.066 28.5-103.7 -87.3-158.4 -6.3 21.9 21.8 39 39 A N S S+ 0 0 43 54,-0.1 36,-0.9 112,-0.1 2,-0.4 0.131 83.2 101.0-124.7 21.3 -7.3 23.6 25.1 40 40 A K E +K 74 0E 73 52,-0.2 52,-0.4 34,-0.2 2,-0.3 -0.884 43.5 165.2-111.1 132.6 -10.5 21.8 25.9 41 41 A F E -K 73 0E 0 32,-1.5 32,-3.5 -2,-0.4 2,-0.4 -0.987 19.1-160.8-145.9 156.0 -10.6 19.1 28.5 42 42 A R B -C 90 0B 43 48,-1.6 48,-2.3 -2,-0.3 2,-0.2 -1.000 5.5-170.3-138.9 140.5 -13.0 17.1 30.6 43 43 A T - 0 0 16 -2,-0.4 27,-2.1 28,-0.3 2,-0.3 -0.620 23.9-112.6-116.2-177.3 -12.6 15.1 33.8 44 44 A F B -L 69 0F 20 44,-0.3 2,-0.5 25,-0.2 25,-0.2 -0.888 11.8-155.0-117.0 150.5 -14.9 12.7 35.7 45 45 A R > + 0 0 49 23,-2.4 3,-1.2 -2,-0.3 4,-0.2 -0.772 13.1 177.5-123.5 92.0 -16.6 13.0 39.1 46 46 A G G > + 0 0 14 -2,-0.5 3,-2.0 1,-0.2 -1,-0.1 0.770 64.8 80.7 -64.0 -22.5 -17.5 9.7 40.5 47 47 A H G 3 S+ 0 0 42 1,-0.3 811,-2.1 810,-0.1 -1,-0.2 0.636 87.2 61.1 -69.4 -4.0 -18.9 10.8 43.9 48 48 A T G < S+ 0 0 49 -3,-1.2 2,-0.3 809,-0.2 -1,-0.3 0.616 109.5 26.0 -92.0 -17.2 -22.2 11.6 42.2 49 49 A A < - 0 0 8 -3,-2.0 -1,-0.1 -4,-0.2 3,-0.1 -0.993 56.5-139.7-149.3 154.6 -23.1 8.1 40.9 50 50 A A S S- 0 0 7 -2,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.887 83.2 -28.6 -78.9 -38.8 -22.6 4.4 41.5 51 51 A F - 0 0 56 482,-0.2 2,-0.5 421,-0.0 -1,-0.3 -0.964 56.5-107.1-163.8 172.2 -22.3 3.4 37.8 52 52 A I E -m 535 0G 1 482,-1.9 484,-2.0 -2,-0.3 2,-1.2 -0.982 24.7-143.8-115.0 127.6 -23.3 4.3 34.2 53 53 A D E > -m 536 0G 27 -2,-0.5 3,-1.2 482,-0.2 484,-0.1 -0.723 11.3-168.0 -95.2 90.4 -25.9 2.0 32.6 54 54 A L T 3 S+ 0 0 9 -2,-1.2 -1,-0.2 482,-0.6 483,-0.1 0.758 89.1 24.2 -46.4 -33.3 -24.7 1.9 29.0 55 55 A S T 3 S+ 0 0 51 481,-0.4 -1,-0.3 -3,-0.1 3,-0.2 0.407 96.6 112.5-118.5 4.4 -27.9 0.2 27.9 56 56 A G S < S- 0 0 15 -3,-1.2 5,-0.1 1,-0.2 482,-0.0 -0.006 87.4 -43.1 -63.8-178.2 -30.4 1.3 30.6 57 57 A P >> - 0 0 65 0, 0.0 4,-1.7 0, 0.0 3,-0.8 -0.210 57.2-126.7 -49.9 128.6 -33.3 3.7 29.8 58 58 A K H 3> S+ 0 0 114 1,-0.3 4,-1.9 2,-0.2 5,-0.2 0.841 107.1 54.9 -44.2 -46.5 -32.0 6.5 27.6 59 59 A D H 3> S+ 0 0 120 1,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.881 109.3 45.1 -59.5 -44.6 -33.4 9.2 30.0 60 60 A E H <> S+ 0 0 136 -3,-0.8 4,-1.6 1,-0.2 -1,-0.2 0.712 109.7 55.8 -76.2 -24.3 -31.5 7.8 33.0 61 61 A V H X S+ 0 0 4 -4,-1.7 4,-2.5 2,-0.2 5,-0.2 0.899 105.6 51.9 -73.1 -38.6 -28.3 7.4 31.0 62 62 A S H X S+ 0 0 43 -4,-1.9 4,-1.5 1,-0.2 -2,-0.2 0.868 108.5 51.2 -64.4 -37.7 -28.4 11.1 30.0 63 63 A A H X S+ 0 0 28 -4,-1.3 4,-1.7 -5,-0.2 -1,-0.2 0.951 111.1 48.0 -65.0 -45.1 -28.8 12.1 33.6 64 64 A A H X S+ 0 0 8 -4,-1.6 4,-2.5 2,-0.2 5,-0.3 0.934 107.6 52.3 -61.8 -51.8 -25.8 10.0 34.7 65 65 A L H X S+ 0 0 7 -4,-2.5 4,-2.1 1,-0.3 -1,-0.2 0.890 110.6 51.8 -54.1 -38.7 -23.4 11.2 32.1 66 66 A D H < S+ 0 0 122 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.839 108.4 49.9 -67.2 -35.4 -24.3 14.7 33.1 67 67 A R H < S+ 0 0 137 -4,-1.7 -2,-0.2 -3,-0.2 -1,-0.2 0.910 117.2 38.8 -78.2 -27.7 -23.6 14.0 36.8 68 68 A V H < S+ 0 0 0 -4,-2.5 -23,-2.4 -24,-0.1 2,-0.6 0.780 98.0 83.0 -93.4 -19.3 -20.1 12.4 36.2 69 69 A M B < S-L 44 0F 18 -4,-2.1 -25,-0.2 -5,-0.3 3,-0.1 -0.708 71.7-140.8 -85.3 125.9 -18.7 14.7 33.4 70 70 A S - 0 0 24 -27,-2.1 3,-0.1 -2,-0.6 2,-0.1 -0.134 35.5 -94.2 -61.6 171.3 -17.2 18.0 34.6 71 71 A D - 0 0 145 1,-0.1 -28,-0.3 -29,-0.1 2,-0.2 -0.365 63.2 -64.4 -83.4 177.1 -17.9 20.9 32.3 72 72 A E - 0 0 65 -30,-0.1 2,-0.5 -3,-0.1 -30,-0.2 -0.425 51.6-143.4 -67.6 130.2 -15.4 21.8 29.6 73 73 A I E -K 41 0E 30 -32,-3.5 -32,-1.5 -2,-0.2 2,-0.5 -0.811 15.4-171.3 -92.6 119.7 -12.1 22.8 31.0 74 74 A V E -K 40 0E 88 -2,-0.5 2,-0.3 -34,-0.2 -34,-0.2 -0.973 17.7-137.0-115.3 121.8 -10.3 25.6 29.1 75 75 A L - 0 0 12 -36,-0.9 3,-0.1 -2,-0.5 2,-0.1 -0.572 13.8-129.1 -83.7 135.3 -6.7 26.3 30.2 76 76 A D > - 0 0 109 -2,-0.3 3,-2.4 1,-0.2 -1,-0.1 -0.433 50.7 -65.5 -77.9 159.9 -5.5 29.9 30.5 77 77 A E T 3 S+ 0 0 194 1,-0.3 -1,-0.2 -2,-0.1 3,-0.1 -0.019 124.7 13.5 -49.4 138.5 -2.3 30.9 28.8 78 78 A G T 3 S+ 0 0 69 1,-0.3 2,-0.3 -3,-0.1 -1,-0.3 0.471 100.2 129.9 74.6 -2.2 0.8 29.2 30.2 79 79 A E < - 0 0 88 -3,-2.4 2,-0.3 -4,-0.0 -1,-0.3 -0.679 43.2-154.6 -90.1 143.9 -1.4 26.8 32.0 80 80 A A - 0 0 10 -2,-0.3 2,-0.5 70,-0.1 70,-0.2 -0.738 16.6-127.4-106.8 159.0 -1.0 23.0 31.8 81 81 A F E -O 149 0H 4 68,-3.0 68,-3.0 -2,-0.3 2,-0.9 -0.929 26.5-141.1 -95.0 121.9 -3.4 20.2 32.3 82 82 A Y E -O 148 0H 43 741,-2.6 2,-0.7 -2,-0.5 66,-0.2 -0.802 14.7-164.8 -92.3 110.9 -1.8 17.8 34.8 83 83 A L E -O 147 0H 3 64,-3.3 64,-3.4 -2,-0.9 5,-0.1 -0.861 12.3-159.3 -95.3 112.4 -2.5 14.3 33.7 84 84 A H > - 0 0 9 -2,-0.7 3,-1.5 62,-0.3 57,-0.5 -0.600 31.1 -82.7 -94.0 152.4 -1.9 12.0 36.7 85 85 A P T 3 S+ 0 0 42 0, 0.0 57,-0.2 0, 0.0 -1,-0.1 -0.211 114.9 12.0 -47.3 130.0 -1.2 8.2 36.6 86 86 A G T 3 S+ 0 0 24 55,-2.5 2,-0.5 1,-0.1 56,-0.1 0.593 95.8 116.3 83.0 12.1 -4.5 6.4 36.5 87 87 A E < - 0 0 77 -3,-1.5 -3,-0.2 54,-0.2 444,-0.1 -0.798 53.2-146.1-131.0 90.8 -6.8 9.2 35.6 88 88 A L + 0 0 4 442,-0.7 -44,-0.3 -2,-0.5 2,-0.3 -0.117 22.6 178.0 -47.3 132.3 -8.7 9.3 32.3 89 89 A A E - D 0 139B 1 50,-2.1 50,-2.8 -46,-0.1 2,-0.3 -0.992 22.7-131.1-140.2 151.2 -9.4 12.7 30.8 90 90 A L E +CD 42 138B 0 -48,-2.3 -48,-1.6 -2,-0.3 2,-0.2 -0.690 33.9 155.3 -93.9 148.8 -11.0 13.9 27.5 91 91 A A E - D 0 137B 0 46,-2.4 46,-1.8 -2,-0.3 2,-0.3 -0.811 27.7-128.2-147.0-161.9 -9.4 16.4 25.2 92 92 A V E - D 0 136B 4 -52,-0.4 -54,-2.7 44,-0.3 44,-0.2 -0.993 22.9-106.4-151.9 152.5 -9.5 17.4 21.5 93 93 A T E -J 37 0D 1 42,-1.8 -56,-0.3 -2,-0.3 -54,-0.1 -0.528 23.6-129.6 -74.0 154.7 -7.0 18.0 18.7 94 94 A L E S+ 0 0 81 -58,-3.6 -1,-0.1 -56,-0.2 -57,-0.1 0.938 90.1 76.4 -61.7 -49.6 -6.2 21.6 17.7 95 95 A E E S- 0 0 9 -59,-0.5 40,-0.7 -76,-0.1 2,-0.4 -0.255 71.9-145.9 -69.7 144.8 -6.9 20.6 14.1 96 96 A S E -BD 20 134B 29 -76,-2.5 -76,-2.2 38,-0.2 2,-0.4 -0.888 20.3-158.6 -98.7 141.3 -10.3 20.0 12.6 97 97 A V E -BD 19 133B 0 36,-3.0 36,-2.2 -2,-0.4 2,-0.4 -0.961 11.8-168.9-124.3 138.9 -10.3 17.2 10.0 98 98 A T E -BD 18 132B 37 -80,-3.1 -80,-2.1 -2,-0.4 34,-0.3 -0.979 10.2-164.2-128.5 120.6 -12.8 16.6 7.1 99 99 A L - 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