==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 12-SEP-05 2AZW . COMPND 2 MOLECULE: MUTT/NUDIX FAMILY PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROCOCCUS FAECALIS; . AUTHOR R.ZHANG,M.ZHOU,S.MOY,F.COLLART,A.JOACHIMIAK,MIDWEST CENTER F . 146 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8284.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 102 69.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 9.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 35 24.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.7 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 . 17 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 27 18.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.4 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 0 0 1 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 0 0 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 PARALLEL BRIDGES PER LADDER . 0 2 1 0 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 1 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 2 A K 0 0 243 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -43.9 5.6 27.6 -3.5 2 3 A T - 0 0 58 1,-0.1 78,-0.1 78,-0.0 79,-0.0 -0.543 360.0-101.9 -63.9 125.3 8.4 28.1 -0.9 3 4 A P - 0 0 39 0, 0.0 78,-3.1 0, 0.0 2,-0.4 -0.320 50.3-170.1 -52.6 125.5 7.6 31.3 1.0 4 5 A T E +a 81 0A 74 76,-0.2 2,-0.3 92,-0.1 78,-0.2 -0.982 9.6 178.9-132.7 134.8 9.9 33.9 -0.5 5 6 A F E +a 82 0A 62 76,-2.4 78,-2.6 -2,-0.4 127,-0.0 -0.935 32.4 62.1-137.6 151.7 10.7 37.4 0.6 6 7 A G S S- 0 0 40 -2,-0.3 2,-0.5 76,-0.2 78,-0.1 0.321 75.4 -91.6 105.4 128.9 12.9 40.3 -0.3 7 8 A K - 0 0 179 76,-0.1 2,-0.3 75,-0.0 -2,-0.0 -0.608 44.8-155.0 -67.1 116.4 13.1 42.5 -3.4 8 9 A R - 0 0 120 -2,-0.5 2,-0.6 84,-0.0 -2,-0.1 -0.777 10.9-128.2 -95.6 144.8 15.6 40.9 -5.7 9 10 A E - 0 0 91 -2,-0.3 3,-0.3 1,-0.1 5,-0.1 -0.831 4.4-153.2 -95.6 122.2 17.6 42.9 -8.2 10 11 A E S S+ 0 0 167 -2,-0.6 -1,-0.1 1,-0.2 -2,-0.0 0.680 94.2 60.4 -64.4 -18.6 17.5 41.6 -11.8 11 12 A T S S+ 0 0 120 2,-0.0 -1,-0.2 -3,-0.0 2,-0.1 0.903 96.5 65.1 -74.7 -45.2 20.8 43.3 -12.4 12 13 A L S S- 0 0 60 -3,-0.3 2,-0.5 1,-0.0 -4,-0.0 -0.384 77.5-123.7 -86.6 155.1 22.9 41.5 -9.7 13 14 A T - 0 0 121 -2,-0.1 79,-0.4 79,-0.0 2,-0.4 -0.879 29.7-137.0 -95.9 126.9 24.0 37.9 -9.4 14 15 A Y - 0 0 30 -2,-0.5 2,-0.3 77,-0.1 79,-0.2 -0.681 6.5-146.2 -89.1 132.0 22.9 36.3 -6.1 15 16 A Q E -b 93 0A 106 77,-2.8 79,-3.5 -2,-0.4 2,-0.5 -0.700 21.2-124.2 -87.0 146.5 25.2 34.1 -4.0 16 17 A T E +b 94 0A 67 -2,-0.3 2,-0.3 77,-0.2 79,-0.2 -0.817 34.4 166.0 -95.8 127.1 23.6 31.3 -2.0 17 18 A R - 0 0 77 77,-2.3 2,-0.2 -2,-0.5 33,-0.1 -0.990 26.9-136.0-135.5 137.8 24.1 31.0 1.8 18 19 A Y - 0 0 122 -2,-0.3 31,-2.6 31,-0.3 2,-0.3 -0.609 22.4-171.0 -92.6 148.0 22.0 28.8 4.0 19 20 A A E -Cd 48 97A 0 77,-2.4 79,-2.2 29,-0.3 2,-0.4 -0.978 13.2-157.3-139.0 155.3 20.7 30.0 7.4 20 21 A A E +Cd 47 98A 0 27,-2.6 27,-2.7 -2,-0.3 2,-0.3 -0.997 13.6 178.7-133.8 136.1 18.9 28.5 10.4 21 22 A Y E -Cd 46 99A 13 77,-2.3 79,-2.1 -2,-0.4 2,-0.4 -0.942 8.5-157.8-135.7 157.4 16.8 30.4 13.0 22 23 A I E - d 0 100A 0 23,-2.5 2,-0.6 -2,-0.3 79,-0.2 -0.996 19.6-126.9-141.8 139.6 14.8 29.4 16.1 23 24 A I E - d 0 101A 2 77,-2.4 79,-2.8 -2,-0.4 2,-0.6 -0.780 25.9-168.7 -83.9 123.4 12.0 30.7 18.1 24 25 A V - 0 0 1 -2,-0.6 9,-2.0 9,-0.4 2,-0.3 -0.960 15.6-174.7-117.1 108.5 13.1 30.9 21.8 25 26 A S E -F 32 0B 16 -2,-0.6 7,-0.3 77,-0.3 3,-0.1 -0.770 34.6-147.9-116.3 155.5 10.1 31.6 24.0 26 27 A K E > > -F 31 0B 59 5,-3.5 5,-1.9 -2,-0.3 3,-1.0 -0.860 20.7-174.9-111.9 87.1 9.3 32.3 27.6 27 28 A P G > 5S+ 0 0 97 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 0.825 72.8 69.7 -55.8 -36.0 5.8 30.6 27.9 28 29 A E G 3 5S+ 0 0 160 1,-0.3 -2,-0.0 -3,-0.1 -3,-0.0 0.823 118.0 18.4 -56.9 -38.6 5.2 31.9 31.4 29 30 A N G < 5S- 0 0 97 -3,-1.0 -1,-0.3 2,-0.1 -3,-0.0 0.187 109.1-114.4-117.1 17.7 4.8 35.5 30.5 30 31 A N T < 5S+ 0 0 87 -3,-1.0 2,-0.3 -4,-0.5 -2,-0.1 0.906 70.4 130.9 51.1 51.9 4.1 34.9 26.8 31 32 A T E < -F 26 0B 20 -5,-1.9 -5,-3.5 91,-0.2 2,-0.3 -0.849 38.1-162.8-122.8 167.6 7.3 36.5 25.4 32 33 A M E -FG 25 121B 1 89,-2.3 89,-2.8 -2,-0.3 2,-0.4 -0.966 24.6-110.4-143.9 158.2 10.0 35.6 23.0 33 34 A V E - G 0 120B 1 -9,-2.0 -9,-0.4 -2,-0.3 2,-0.3 -0.740 25.1-170.5-101.5 138.3 13.4 37.0 22.4 34 35 A L E - G 0 119B 0 85,-2.5 85,-2.0 -2,-0.4 2,-0.6 -0.921 18.6-135.2-119.1 148.7 14.7 39.0 19.4 35 36 A V E -HG 43 118B 2 8,-3.0 8,-2.5 -2,-0.3 2,-0.6 -0.916 18.1-156.7-104.4 121.6 18.2 39.9 18.6 36 37 A Q E -HG 42 117B 43 81,-3.1 81,-1.9 -2,-0.6 6,-0.2 -0.903 11.3-138.6-105.0 119.2 18.6 43.6 17.5 37 38 A A > - 0 0 18 4,-2.8 3,-1.9 -2,-0.6 79,-0.1 -0.158 29.2-103.4 -65.9 162.2 21.7 44.4 15.3 38 39 A P T 3 S+ 0 0 102 0, 0.0 -1,-0.1 0, 0.0 78,-0.0 0.876 123.6 60.2 -54.6 -36.2 23.7 47.6 15.9 39 40 A N T 3 S- 0 0 137 2,-0.1 -2,-0.0 1,-0.1 -3,-0.0 0.585 122.5-107.8 -68.8 -10.0 22.0 49.0 12.7 40 41 A G S < S+ 0 0 29 -3,-1.9 2,-0.2 1,-0.3 -1,-0.1 0.268 72.5 138.2 105.2 -10.7 18.6 48.6 14.5 41 42 A A - 0 0 7 -5,-0.1 -4,-2.8 1,-0.1 2,-0.4 -0.489 45.3-137.3 -72.7 135.4 17.2 45.6 12.6 42 43 A Y E +Hi 36 130B 41 87,-0.6 89,-2.5 -6,-0.2 90,-0.5 -0.781 26.5 174.5 -95.4 137.7 15.4 42.9 14.6 43 44 A F E -H 35 0B 46 -8,-2.5 -8,-3.0 -2,-0.4 3,-0.1 -0.950 34.6-106.9-135.7 153.4 16.0 39.2 13.9 44 45 A L - 0 0 1 -2,-0.3 -10,-0.1 -10,-0.2 -21,-0.1 -0.450 58.0 -85.8 -64.0 153.1 15.1 35.8 15.3 45 46 A P S S+ 0 0 0 0, 0.0 -23,-2.5 0, 0.0 2,-0.3 -0.379 94.4 60.0 -59.4 141.1 18.0 34.0 17.1 46 47 A G E -C 21 0A 4 -25,-0.3 2,-0.3 16,-0.1 -25,-0.3 -0.858 54.8-173.8 132.5-168.6 20.1 32.1 14.5 47 48 A G E -C 20 0A 7 -27,-2.7 -27,-2.6 -2,-0.3 2,-0.1 -0.993 39.0 -16.4 166.5-167.5 22.1 32.9 11.5 48 49 A E E -C 19 0A 32 -2,-0.3 -29,-0.3 -29,-0.2 2,-0.3 -0.374 61.2-118.0 -69.7 136.4 24.1 31.7 8.5 49 50 A I - 0 0 25 -31,-2.6 2,-0.3 -2,-0.1 -31,-0.3 -0.583 36.6-159.0 -74.9 134.0 25.4 28.2 8.5 50 51 A E > - 0 0 94 -2,-0.3 3,-2.3 4,-0.2 8,-0.0 -0.768 42.9 -20.0-116.8 159.8 29.2 28.0 8.5 51 52 A G T 3 S- 0 0 81 -2,-0.3 -2,-0.0 1,-0.3 0, 0.0 -0.166 123.1 -27.8 51.4-126.9 31.9 25.5 7.6 52 53 A T T 3 S+ 0 0 149 2,-0.0 -1,-0.3 0, 0.0 -3,-0.0 0.082 97.2 142.9-107.8 20.9 30.5 22.0 7.6 53 54 A E < - 0 0 47 -3,-2.3 2,-0.1 1,-0.1 -4,-0.0 -0.248 47.6-129.8 -59.5 143.9 27.8 22.7 10.2 54 55 A T > - 0 0 64 1,-0.1 4,-2.1 -5,-0.0 5,-0.2 -0.429 34.7-101.6 -76.1 166.4 24.3 21.1 10.0 55 56 A K H > S+ 0 0 77 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.919 125.8 48.9 -54.4 -44.8 21.3 23.5 10.4 56 57 A E H > S+ 0 0 82 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.883 107.8 53.7 -66.2 -39.0 20.9 22.4 14.0 57 58 A E H > S+ 0 0 103 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.869 106.4 52.8 -63.7 -37.7 24.7 22.9 14.8 58 59 A A H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.892 109.6 49.6 -62.7 -40.5 24.4 26.5 13.4 59 60 A I H X S+ 0 0 0 -4,-1.7 4,-2.7 2,-0.2 5,-0.3 0.944 109.1 51.2 -62.4 -47.6 21.5 27.1 15.8 60 61 A H H X S+ 0 0 84 -4,-2.5 4,-1.2 1,-0.2 -2,-0.2 0.907 113.5 45.2 -58.7 -42.1 23.4 25.7 18.8 61 62 A R H X S+ 0 0 40 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.934 114.3 48.7 -65.5 -46.3 26.4 28.0 18.0 62 63 A E H X S+ 0 0 27 -4,-2.5 4,-3.5 1,-0.2 5,-0.4 0.885 108.5 50.0 -65.2 -44.3 24.2 31.1 17.4 63 64 A V H X>S+ 0 0 0 -4,-2.7 6,-1.7 2,-0.2 4,-1.7 0.828 112.8 49.0 -70.1 -27.4 22.1 30.9 20.5 64 65 A L H X5S+ 0 0 65 -4,-1.2 4,-1.2 -5,-0.3 48,-0.5 0.970 117.0 40.9 -67.4 -54.3 25.2 30.5 22.7 65 66 A E H <5S+ 0 0 83 -4,-2.4 47,-1.1 46,-0.2 -2,-0.2 0.916 128.4 30.5 -58.4 -47.7 26.9 33.5 21.0 66 67 A E H <5S+ 0 0 26 -4,-3.5 -3,-0.2 45,-0.2 -1,-0.2 0.844 136.4 18.1 -84.1 -37.7 23.8 35.7 20.9 67 68 A L H <5S- 0 0 4 -4,-1.7 -3,-0.2 -5,-0.4 -2,-0.1 0.612 89.2-123.3-115.2 -18.7 21.7 34.7 23.9 68 69 A G S <> - E 0 91A 8 5,-2.8 5,-1.4 -2,-0.5 4,-1.2 -0.832 7.7-164.0 -90.1 114.1 24.8 42.7 2.5 87 88 A N T 45S+ 0 0 125 -2,-0.7 -1,-0.2 2,-0.2 5,-0.0 0.902 89.0 43.9 -64.5 -43.9 26.4 46.2 2.7 88 89 A H T 45S+ 0 0 167 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.884 119.1 42.7 -72.9 -37.3 29.5 45.1 4.6 89 90 A R T 45S- 0 0 73 2,-0.2 -1,-0.2 1,-0.0 -2,-0.2 0.695 98.3-141.9 -71.9 -21.5 30.1 42.0 2.4 90 91 A Q T <5 + 0 0 133 -4,-1.2 2,-0.3 1,-0.2 -3,-0.2 0.881 62.3 121.1 51.9 43.8 29.2 44.1 -0.7 91 92 A T E < - E 0 86A 41 -5,-1.4 -5,-2.8 -76,-0.0 2,-0.4 -0.996 65.6-127.8-140.9 136.2 27.4 41.0 -1.9 92 93 A A E - E 0 85A 5 -79,-0.4 -77,-2.8 -2,-0.3 2,-0.4 -0.719 33.9-157.8 -81.1 131.0 23.9 40.1 -3.0 93 94 A Y E -bE 15 84A 20 -9,-3.4 -9,-2.7 -2,-0.4 2,-0.5 -0.945 24.0-157.5-121.7 132.9 22.6 37.0 -1.2 94 95 A Y E -bE 16 83A 51 -79,-3.5 -77,-2.3 -2,-0.4 -11,-0.2 -0.927 27.4-165.0 -92.3 125.2 19.9 34.4 -1.8 95 96 A N E - E 0 82A 2 -13,-3.0 -13,-1.8 -2,-0.5 2,-0.4 -0.770 15.1-165.1-126.1 83.5 19.2 33.0 1.7 96 97 A P E - E 0 81A 2 0, 0.0 -77,-2.4 0, 0.0 2,-0.4 -0.570 21.8-159.8 -62.0 122.2 17.3 29.8 2.2 97 98 A G E -dE 19 80A 1 -17,-1.6 -17,-1.9 -2,-0.4 2,-0.5 -0.891 12.6-154.5-111.9 138.9 16.3 29.9 5.9 98 99 A Y E -dE 20 79A 28 -79,-2.2 -77,-2.3 -2,-0.4 2,-0.4 -0.965 17.4-154.2-116.1 120.3 15.3 26.9 8.0 99 100 A F E +dE 21 78A 3 -21,-2.5 -22,-2.1 -2,-0.5 -21,-1.3 -0.815 17.0 170.9-110.2 133.0 13.0 27.7 10.9 100 101 A Y E -dE 22 76A 16 -79,-2.1 -77,-2.4 -2,-0.4 2,-0.4 -0.789 26.7-128.3-131.1 169.6 12.7 25.8 14.2 101 102 A V E -d 23 0A 11 -26,-1.9 -27,-3.1 -2,-0.2 2,-0.5 -0.979 22.3-129.6-120.0 135.7 11.1 26.1 17.6 102 103 A A E - E 0 73A 6 -79,-2.8 -77,-0.3 -2,-0.4 -29,-0.2 -0.750 12.4-162.1 -78.7 125.4 13.0 25.6 20.9 103 104 A N E S- 0 0 101 -31,-2.8 2,-0.3 -2,-0.5 -1,-0.2 0.923 75.4 -15.5 -69.9 -44.7 11.1 23.1 23.1 104 105 A T E - E 0 72A 74 -32,-1.0 -32,-3.1 -3,-0.1 -1,-0.3 -0.938 67.3-168.9-150.1 167.5 13.1 24.2 26.0 105 106 A W E - E 0 71A 60 -2,-0.3 2,-0.4 -34,-0.3 -34,-0.2 -0.975 10.1-142.0-157.6 167.2 16.3 26.2 26.8 106 107 A R E - E 0 70A 166 -36,-2.0 -36,-2.1 -2,-0.3 2,-0.5 -0.999 19.5-124.2-140.4 136.0 18.7 27.0 29.6 107 108 A Q E + E 0 69A 105 -2,-0.4 -38,-0.2 -38,-0.2 -39,-0.1 -0.689 37.6 161.6 -80.3 121.9 20.6 30.2 30.5 108 109 A L - 0 0 105 -40,-2.8 2,-0.3 -2,-0.5 -39,-0.2 0.708 57.2 -26.6-112.4 -34.8 24.3 29.3 30.7 109 110 A S S S- 0 0 52 -41,-2.1 -1,-0.3 -42,-0.1 3,-0.1 -0.897 76.2 -65.6-158.6-175.3 26.2 32.6 30.5 110 111 A E S S- 0 0 134 -2,-0.3 -42,-0.2 1,-0.1 -43,-0.1 -0.553 71.4 -82.4 -76.0 155.6 26.2 36.2 29.2 111 112 A P 0 0 18 0, 0.0 -45,-0.2 0, 0.0 -46,-0.2 -0.323 360.0 360.0 -62.9 144.3 26.2 36.5 25.3 112 113 A L 0 0 130 -47,-1.1 -46,-0.2 -48,-0.5 -47,-0.1 0.780 360.0 360.0 -75.7 360.0 29.6 36.2 23.6 113 ! 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 0.0 114 115 A R 0 0 174 0, 0.0 -48,-0.1 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0 37.5 27.6 41.6 22.8 115 116 A T + 0 0 113 2,-0.1 2,-0.0 0, 0.0 0, 0.0 0.771 360.0 69.2 -84.5 -32.4 27.2 44.1 20.0 116 117 A N S S- 0 0 54 -79,-0.1 2,-0.3 -78,-0.0 -79,-0.2 -0.305 78.9-135.3 -74.4 164.4 23.5 43.1 19.6 117 118 A T E -G 36 0B 71 -81,-1.9 -81,-3.1 -2,-0.0 2,-0.4 -0.943 14.0-131.8-119.4 151.0 20.8 43.8 22.2 118 119 A L E -G 35 0B 61 -2,-0.3 2,-0.4 -83,-0.2 -83,-0.2 -0.817 19.0-171.4-104.4 141.5 18.2 41.3 23.3 119 120 A H E -G 34 0B 51 -85,-2.0 -85,-2.5 -2,-0.4 2,-0.7 -0.983 13.3-155.6-136.4 120.3 14.5 42.1 23.6 120 121 A W E +G 33 0B 82 -2,-0.4 2,-0.3 -87,-0.2 -87,-0.2 -0.884 35.2 159.8 -93.6 117.4 11.8 39.9 25.1 121 122 A V E -G 32 0B 23 -89,-2.8 -89,-2.3 -2,-0.7 -2,-0.0 -0.879 46.9 -84.3-135.2 162.4 8.5 40.9 23.5 122 123 A A > - 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