==== 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 18-JAN-07 2OL0 . COMPND 2 MOLECULE: DEOXYURIDINE 5'-TRIPHOSPHATE NUCLEOTIDOHYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: VACCINIA VIRUS; . AUTHOR N.SCHORMANN,D.CHATTOPADHYAY . 373 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16275.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 252 67.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 3.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 120 32.2 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 . 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 . 65 17.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 9 2.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.8 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 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 RESIDUES PER ALPHA HELIX . 0 0 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 PARALLEL BRIDGES PER LADDER . 1 6 3 9 2 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 ANTIPARALLEL BRIDGES PER LADDER . 3 6 0 2 1 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 8 A S 0 0 152 0, 0.0 241,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 63.8 -19.6 -45.7 18.1 2 9 A P - 0 0 48 0, 0.0 2,-0.7 0, 0.0 241,-0.2 -0.074 360.0-113.0 -63.4 156.6 -18.6 -42.0 18.2 3 10 A V E -a 243 0A 4 239,-3.5 241,-2.5 49,-0.0 2,-0.3 -0.854 34.6-142.8 -85.1 116.7 -17.5 -39.8 15.4 4 11 A R E -aB 244 50A 84 -2,-0.7 46,-2.2 46,-0.5 2,-0.3 -0.607 23.1-177.3 -78.2 139.6 -13.8 -39.1 16.0 5 12 A F E -aB 245 49A 7 239,-2.0 241,-3.0 -2,-0.3 2,-0.4 -0.946 14.2-150.6-136.1 159.6 -12.6 -35.6 15.1 6 13 A V E - B 0 48A 16 42,-2.4 42,-1.9 -2,-0.3 2,-0.6 -0.990 14.1-135.4-130.6 138.7 -9.3 -33.7 15.1 7 14 A K E - B 0 47A 62 239,-0.4 40,-0.2 -2,-0.4 39,-0.1 -0.867 10.3-160.7 -88.6 120.0 -8.5 -30.0 15.6 8 15 A E S S+ 0 0 91 38,-2.9 2,-0.3 -2,-0.6 -1,-0.2 0.879 79.8 7.3 -68.8 -40.2 -5.9 -28.9 12.9 9 16 A T S > S- 0 0 49 37,-0.4 3,-0.9 -3,-0.1 -1,-0.0 -0.803 83.7-104.7-127.0 176.1 -5.1 -25.8 15.0 10 17 A N T 3 S+ 0 0 151 -2,-0.3 -2,-0.0 1,-0.2 36,-0.0 0.462 111.6 76.3 -79.2 -2.7 -6.1 -24.6 18.5 11 18 A R T 3 S+ 0 0 100 2,-0.1 -1,-0.2 35,-0.0 91,-0.1 0.625 73.8 102.9 -79.2 -18.6 -8.4 -22.1 16.8 12 19 A A < - 0 0 4 -3,-0.9 2,-0.5 34,-0.2 34,-0.1 -0.388 64.3-144.2 -66.9 142.4 -10.9 -24.8 16.0 13 20 A K - 0 0 86 32,-0.4 15,-0.3 15,-0.3 3,-0.1 -0.960 23.5-114.2-106.9 126.0 -14.1 -25.1 18.1 14 21 A S - 0 0 39 -2,-0.5 12,-0.1 1,-0.1 33,-0.0 -0.386 45.0-102.6 -51.0 124.3 -15.4 -28.6 18.9 15 22 A P - 0 0 13 0, 0.0 2,-0.3 0, 0.0 12,-0.2 -0.311 44.3-141.4 -55.9 138.0 -18.8 -28.7 17.1 16 23 A T B -C 26 0B 41 10,-0.8 10,-2.7 -3,-0.1 2,-0.4 -0.692 17.9-162.1-108.1 153.3 -21.6 -28.3 19.6 17 24 A R - 0 0 85 -2,-0.3 8,-0.1 8,-0.2 6,-0.0 -0.974 6.3-177.2-134.5 126.2 -25.1 -29.8 20.1 18 25 A Q + 0 0 130 -2,-0.4 -1,-0.1 1,-0.2 7,-0.1 0.770 61.4 19.1 -97.8 -30.9 -27.5 -27.9 22.3 19 26 A S S > S- 0 0 36 1,-0.0 3,-1.4 0, 0.0 -1,-0.2 -0.955 71.4-112.2-142.6 158.9 -30.7 -30.0 22.4 20 27 A P T 3 S+ 0 0 106 0, 0.0 184,-0.1 0, 0.0 -1,-0.0 0.698 117.2 45.7 -59.5 -23.6 -31.9 -33.6 21.8 21 28 A G T 3 S+ 0 0 3 184,-0.1 184,-1.5 183,-0.1 183,-1.2 0.237 79.1 123.6-110.5 11.4 -33.9 -32.5 18.8 22 29 A A < - 0 0 16 -3,-1.4 180,-0.0 181,-0.2 -5,-0.0 -0.493 63.1-132.7 -66.7 140.8 -31.4 -30.3 17.1 23 30 A A S S- 0 0 0 -2,-0.2 87,-0.4 178,-0.1 2,-0.1 0.857 72.1 -28.4 -66.5 -34.7 -30.8 -31.5 13.5 24 31 A G S S- 0 0 4 85,-0.2 2,-0.4 216,-0.1 85,-0.2 -0.462 78.2 -55.8-150.6-143.2 -27.1 -31.3 13.7 25 32 A Y E - D 0 108B 13 83,-2.0 83,-3.1 -2,-0.1 -8,-0.2 -0.985 46.8-114.5-128.3 130.8 -23.9 -29.9 15.2 26 33 A D E -CD 16 107B 5 -10,-2.7 -10,-0.8 -2,-0.4 2,-0.3 -0.401 28.1-152.7 -65.2 135.5 -22.9 -26.2 15.2 27 34 A L E - D 0 106B 2 79,-3.0 78,-2.5 -12,-0.2 79,-1.0 -0.874 9.0-158.3-109.7 149.4 -19.8 -25.3 13.1 28 35 A Y E - D 0 104B 25 -15,-0.3 -15,-0.3 -2,-0.3 76,-0.2 -0.931 21.4-108.8-130.4 144.5 -17.5 -22.3 13.9 29 36 A S - 0 0 1 74,-2.4 73,-2.9 -2,-0.3 16,-0.2 -0.489 16.6-163.8 -67.7 138.5 -15.0 -20.2 12.0 30 37 A A S S+ 0 0 0 14,-2.5 2,-0.3 71,-0.2 71,-0.2 0.476 74.0 37.2 -94.6 -8.0 -11.4 -20.8 13.0 31 38 A Y S S- 0 0 58 13,-0.5 2,-0.4 69,-0.1 71,-0.1 -0.871 85.3 -99.8-139.0 167.7 -10.4 -17.6 11.2 32 39 A D + 0 0 104 -2,-0.3 2,-0.3 68,-0.2 68,-0.2 -0.798 44.4 170.9 -90.8 131.7 -11.4 -14.0 10.5 33 40 A Y E -H 99 0C 35 66,-3.0 66,-2.8 -2,-0.4 2,-0.4 -0.924 25.8-149.9-134.7 160.6 -12.9 -13.2 7.1 34 41 A T E -H 98 0C 89 -2,-0.3 64,-0.2 64,-0.2 62,-0.0 -0.989 12.0-165.4-129.6 124.3 -14.7 -10.4 5.3 35 42 A I E -H 97 0C 1 62,-2.9 62,-3.0 -2,-0.4 3,-0.1 -0.921 10.8-147.8-114.1 110.0 -17.2 -11.2 2.6 36 43 A P > - 0 0 59 0, 0.0 3,-1.5 0, 0.0 55,-0.3 -0.214 40.6 -79.1 -63.9 162.9 -18.3 -8.4 0.2 37 44 A P T 3 S+ 0 0 53 0, 0.0 55,-0.2 0, 0.0 57,-0.1 -0.425 117.8 17.5 -66.4 139.4 -21.8 -8.3 -1.2 38 45 A G T 3 S+ 0 0 34 53,-2.6 2,-0.2 55,-0.4 54,-0.1 0.532 108.8 100.3 77.9 7.4 -22.3 -10.7 -4.1 39 46 A E < - 0 0 85 -3,-1.5 52,-2.4 52,-0.4 -1,-0.3 -0.728 57.9-144.7-115.6 167.9 -19.2 -12.7 -3.3 40 47 A R E -I 90 0D 42 -2,-0.2 2,-0.3 50,-0.2 50,-0.2 -0.915 8.5-161.8-130.2 162.7 -18.5 -16.0 -1.5 41 48 A Q E -I 89 0D 74 48,-1.8 48,-2.0 -2,-0.3 2,-0.5 -0.985 22.3-125.2-149.5 129.8 -15.7 -17.3 0.8 42 49 A L E -I 88 0D 73 -2,-0.3 2,-0.6 46,-0.2 46,-0.2 -0.650 29.7-154.8 -70.5 120.3 -14.5 -20.7 2.0 43 50 A I E -I 87 0D 0 44,-3.1 44,-2.4 -2,-0.5 2,-0.3 -0.907 6.8-140.9-103.7 117.2 -14.5 -20.6 5.8 44 51 A K E -I 86 0D 93 -2,-0.6 -14,-2.5 42,-0.2 -13,-0.5 -0.607 18.7-177.5 -76.9 130.0 -12.0 -23.0 7.5 45 52 A T - 0 0 1 40,-1.2 -32,-0.4 -2,-0.3 -1,-0.1 0.600 32.0-137.9 -94.6 -18.9 -13.3 -24.8 10.6 46 53 A D + 0 0 2 1,-0.3 -38,-2.9 39,-0.2 -37,-0.4 0.724 64.3 124.6 59.5 24.6 -10.0 -26.5 11.2 47 54 A I E -B 7 0A 2 38,-0.3 38,-3.0 -40,-0.2 2,-0.3 -0.943 38.4-177.0-111.1 134.2 -12.0 -29.6 12.1 48 55 A S E -B 6 0A 3 -42,-1.9 -42,-2.4 -2,-0.4 2,-0.3 -0.954 8.9-167.0-124.6 150.5 -11.6 -33.0 10.4 49 56 A M E -B 5 0A 1 32,-0.4 2,-1.0 34,-0.4 -44,-0.2 -0.983 31.2-132.0-139.2 143.0 -13.7 -36.0 11.1 50 57 A S E -B 4 0A 22 -46,-2.2 -46,-0.5 -2,-0.3 30,-0.1 -0.866 49.7-142.5 -91.0 99.1 -13.8 -39.8 10.4 51 58 A M - 0 0 11 -2,-1.0 4,-0.0 28,-0.6 -47,-0.0 -0.169 12.1 -96.7 -69.1 151.9 -17.4 -39.7 9.2 52 59 A P > - 0 0 19 0, 0.0 3,-0.6 0, 0.0 2,-0.2 -0.213 45.3 -97.0 -65.4 158.6 -20.0 -42.4 9.9 53 60 A K T 3 S+ 0 0 156 1,-0.2 3,-0.1 27,-0.0 219,-0.1 -0.511 102.1 14.9 -78.3 145.6 -20.8 -45.1 7.3 54 61 A F T 3 S+ 0 0 122 1,-0.3 59,-2.0 -2,-0.2 2,-0.3 0.840 112.4 92.7 59.8 40.6 -23.7 -44.7 4.9 55 62 A C E < -E 112 0B 1 -3,-0.6 24,-0.5 57,-0.2 2,-0.3 -0.916 57.4-154.1-147.9 161.4 -24.0 -41.0 5.7 56 63 A Y E -E 111 0B 0 55,-1.4 55,-2.4 -2,-0.3 2,-0.7 -0.976 25.6-118.4-138.6 150.4 -22.8 -37.7 4.4 57 64 A G E -EF 110 77B 0 20,-2.6 20,-3.0 -2,-0.3 2,-0.6 -0.795 26.8-155.2 -86.0 115.6 -22.3 -34.5 6.4 58 65 A R E -EF 109 76B 27 51,-2.8 51,-2.1 -2,-0.7 2,-1.0 -0.835 10.4-142.5 -91.0 120.7 -24.5 -31.7 5.0 59 66 A I E -E 108 0B 4 16,-2.7 49,-0.2 -2,-0.6 29,-0.1 -0.767 34.5-175.4 -76.6 106.9 -23.3 -28.2 5.6 60 67 A A E -E 107 0B 0 47,-2.7 47,-2.1 -2,-1.0 140,-0.1 -0.820 23.1-100.2-113.2 147.7 -26.7 -26.6 6.2 61 68 A P - 0 0 11 0, 0.0 2,-0.3 0, 0.0 140,-0.2 -0.238 24.4-122.4 -69.2 151.6 -27.6 -23.0 6.8 62 69 A R > - 0 0 39 43,-0.4 4,-2.3 1,-0.1 137,-0.2 -0.728 22.7-130.9 -82.4 141.6 -28.3 -21.3 10.0 63 70 A S H > S+ 0 0 71 -2,-0.3 4,-1.9 2,-0.2 5,-0.1 0.905 103.2 51.0 -63.2 -48.3 -31.7 -19.6 10.0 64 71 A G H > S+ 0 0 45 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.913 114.0 44.7 -56.1 -46.9 -30.7 -16.2 11.4 65 72 A L H >4>S+ 0 0 25 1,-0.2 5,-2.6 2,-0.2 3,-0.7 0.887 108.3 56.6 -67.0 -43.4 -27.9 -15.9 8.8 66 73 A S H ><5S+ 0 0 0 -4,-2.3 3,-1.2 1,-0.2 -1,-0.2 0.859 105.7 52.8 -53.0 -38.8 -30.1 -17.1 5.9 67 74 A L H 3<5S+ 0 0 81 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.738 103.8 56.6 -70.6 -24.4 -32.5 -14.2 6.8 68 75 A K T <<5S- 0 0 145 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.325 129.1 -98.1 -86.2 4.3 -29.5 -11.8 6.6 69 76 A G T < 5S+ 0 0 3 -3,-1.2 23,-2.6 1,-0.3 2,-0.7 0.566 80.0 139.7 90.4 11.6 -29.0 -13.0 3.0 70 77 A I E < +J 91 0D 4 -5,-2.6 -1,-0.3 21,-0.2 129,-0.2 -0.800 27.2 178.3 -94.8 114.1 -26.2 -15.5 3.9 71 78 A D E -J 90 0D 17 19,-2.9 19,-3.4 -2,-0.7 2,-0.5 -0.595 25.0-114.1-112.1 170.4 -26.6 -18.7 1.9 72 79 A I E -J 89 0D 38 17,-0.2 2,-0.2 -2,-0.2 17,-0.2 -0.922 21.4-160.9-113.4 129.3 -24.5 -21.9 1.7 73 80 A G E -J 88 0D 3 15,-2.5 15,-0.6 -2,-0.5 249,-0.1 -0.611 64.8 -11.9 -96.4 165.0 -22.5 -23.2 -1.3 74 81 A G + 0 0 11 247,-0.3 3,-0.1 239,-0.2 249,-0.1 -0.242 66.8 167.2 49.0-118.1 -21.3 -26.8 -1.9 75 82 A G + 0 0 11 1,-0.2 -16,-2.7 11,-0.2 2,-0.9 0.439 22.6 129.2 97.2 0.6 -21.9 -28.5 1.4 76 83 A V E -F 58 0B 20 236,-0.2 2,-0.9 -18,-0.2 -18,-0.2 -0.797 35.1-169.9 -91.9 105.7 -21.5 -32.2 0.7 77 84 A I E -F 57 0B 15 -20,-3.0 -20,-2.6 -2,-0.9 8,-0.0 -0.842 20.2-139.2 -95.6 106.6 -19.0 -33.7 3.2 78 85 A D > - 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