==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 25-JUN-03 1PUN . COMPND 2 MOLECULE: MUTATOR MUTT PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR M.A.MASSIAH,V.SARASWAT,H.F.AZURMENDI,A.S.MILDVAN . 129 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8118.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 83 64.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 7.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 15 11.6 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 . 1 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.8 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 . 23 17.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 17 13.2 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+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 0 1 1 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 0 0 0 0 0 0 1 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 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 0 192 0, 0.0 2,-0.4 0, 0.0 77,-0.1 0.000 360.0 360.0 360.0 172.8 -6.3 -24.5 0.5 2 2 A K E +a 78 0A 134 75,-0.8 77,-2.5 2,-0.0 2,-0.3 -0.872 360.0 179.5-110.0 140.4 -7.1 -21.0 -0.8 3 3 A K E -a 79 0A 142 -2,-0.4 2,-0.3 75,-0.3 77,-0.2 -0.941 12.5-162.8-136.2 158.1 -4.9 -17.9 -0.3 4 4 A L E -a 80 0A 53 75,-1.7 77,-2.3 -2,-0.3 2,-0.3 -0.948 9.6-159.3-146.5 120.2 -5.0 -14.2 -1.2 5 5 A Q E -a 81 0A 47 -2,-0.3 36,-0.6 75,-0.2 2,-0.3 -0.697 8.3-178.1-102.1 154.8 -2.1 -11.8 -1.2 6 6 A I E -a 82 0A 35 75,-3.3 77,-3.1 -2,-0.3 2,-0.4 -0.990 6.7-163.3-146.8 140.4 -2.1 -8.0 -1.1 7 7 A A E +a 83 0A 0 -2,-0.3 2,-0.3 30,-0.3 77,-0.2 -0.971 11.9 177.4-126.7 142.7 0.8 -5.5 -1.1 8 8 A V E -a 84 0A 2 75,-3.9 77,-3.6 -2,-0.4 2,-0.3 -0.985 7.7-165.9-144.5 154.4 0.6 -1.8 -0.1 9 9 A G E -a 85 0A 3 27,-1.4 2,-0.6 -2,-0.3 77,-0.2 -0.988 19.7-135.7-147.4 139.2 3.0 1.1 0.2 10 10 A I E -a 86 0A 13 75,-0.9 77,-1.0 -2,-0.3 2,-0.8 -0.779 30.2-132.4 -89.0 121.3 3.1 4.6 1.7 11 11 A I - 0 0 0 -2,-0.6 8,-1.5 8,-0.5 2,-0.2 -0.671 21.7-155.5 -83.4 110.3 4.6 7.0 -0.7 12 12 A R B -C 18 0B 77 -2,-0.8 2,-0.2 6,-0.3 6,-0.2 -0.533 14.3-176.5 -81.5 148.6 7.2 9.2 1.0 13 13 A N > - 0 0 16 4,-0.9 3,-1.4 76,-0.2 78,-0.1 -0.677 43.3 -79.2-132.5-173.6 8.2 12.6 -0.2 14 14 A E T 3 S+ 0 0 167 1,-0.3 4,-0.1 -2,-0.2 -2,-0.0 0.916 124.3 55.2 -51.7 -54.6 10.5 15.5 0.4 15 15 A N T 3 S- 0 0 90 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.589 114.4-115.9 -59.6 -13.7 8.5 16.9 3.3 16 16 A N S < S+ 0 0 111 -3,-1.4 91,-0.4 1,-0.4 2,-0.3 0.523 84.1 114.2 83.8 9.3 8.7 13.5 5.0 17 17 A E - 0 0 50 89,-0.2 -4,-0.9 90,-0.1 2,-0.5 -0.823 66.8-124.8-108.7 144.6 5.0 13.2 4.7 18 18 A I E -CD 12 105B 2 87,-2.2 87,-1.1 -2,-0.3 2,-0.9 -0.852 14.9-121.4-105.3 128.2 3.6 10.5 2.4 19 19 A F E - D 0 104B 5 -8,-1.5 -8,-0.5 -2,-0.5 2,-0.5 -0.439 37.4-177.0 -61.5 97.5 1.1 11.2 -0.4 20 20 A I E - D 0 103B 1 83,-1.1 2,-0.7 -2,-0.9 83,-0.6 -0.867 30.1-118.6-103.3 131.4 -1.9 9.0 0.5 21 21 A T B +E 34 0C 6 13,-1.3 13,-1.1 -2,-0.5 2,-0.3 -0.555 53.4 149.4 -70.6 111.6 -4.9 8.9 -1.9 22 22 A R - 0 0 70 -2,-0.7 2,-1.4 11,-0.2 3,-0.2 -0.998 60.2 -29.1-146.6 147.0 -7.8 10.3 0.1 23 23 A R - 0 0 150 -2,-0.3 6,-0.2 6,-0.3 5,-0.1 -0.245 61.7-157.8 51.2 -86.3 -11.0 12.2 -0.8 24 24 A A - 0 0 38 -2,-1.4 -1,-0.2 3,-0.1 78,-0.1 0.826 62.3 -59.4 82.5 36.9 -9.6 14.0 -3.8 25 25 A A S S- 0 0 85 -3,-0.2 -2,-0.1 2,-0.0 -1,-0.0 0.981 120.2 -14.7 55.4 83.0 -12.1 16.9 -3.8 26 26 A D S S+ 0 0 162 1,-0.1 2,-0.2 2,-0.0 -2,-0.1 0.970 94.0 155.6 57.5 88.8 -15.5 15.1 -4.1 27 27 A A - 0 0 39 73,-0.0 3,-0.2 1,-0.0 -3,-0.1 -0.514 58.2 -70.8-126.4-165.5 -14.7 11.6 -5.2 28 28 A H S S- 0 0 168 1,-0.2 2,-0.3 -2,-0.2 -4,-0.1 0.963 113.5 -4.8 -56.1 -57.1 -16.3 8.1 -5.1 29 29 A M > - 0 0 124 -6,-0.2 3,-0.7 1,-0.1 -6,-0.3 -0.994 51.1-146.7-145.4 135.4 -15.8 7.6 -1.4 30 30 A A T 3 S+ 0 0 51 -2,-0.3 3,-0.3 1,-0.3 -7,-0.3 0.575 96.8 72.8 -74.4 -9.0 -14.0 9.7 1.3 31 31 A N T 3 + 0 0 72 1,-0.2 -1,-0.3 -9,-0.1 -9,-0.0 -0.047 68.5 95.9 -95.1 31.1 -13.0 6.5 3.0 32 32 A K < + 0 0 89 -3,-0.7 2,-3.5 83,-0.2 83,-0.2 0.012 37.1 138.4-108.4 26.3 -10.5 5.7 0.3 33 33 A L + 0 0 0 81,-1.9 -11,-0.2 -3,-0.3 2,-0.2 -0.256 41.0 123.8 -68.9 57.6 -7.5 7.2 2.2 34 34 A E B -E 21 0C 41 -2,-3.5 -13,-1.3 -13,-1.1 -2,-0.1 -0.547 54.1-122.3-113.5 179.4 -5.4 4.2 1.1 35 35 A F - 0 0 10 1,-0.2 -25,-0.1 -15,-0.2 -15,-0.1 -0.760 38.8 -72.1-119.9 168.2 -2.1 3.7 -0.7 36 36 A P S S+ 0 0 3 0, 0.0 -27,-1.4 0, 0.0 -1,-0.2 0.117 82.6 93.0 -47.9 168.6 -0.8 1.8 -3.8 37 37 A G + 0 0 8 -29,-0.2 2,-0.4 16,-0.2 -30,-0.3 0.858 40.3 142.6 102.8 60.5 -0.6 -2.0 -3.8 38 38 A G + 0 0 38 -32,-0.1 -1,-0.2 1,-0.1 -32,-0.1 -0.919 68.6 14.6-135.8 108.1 -3.8 -3.5 -5.1 39 39 A K S S+ 0 0 104 -2,-0.4 -1,-0.1 -34,-0.2 -33,-0.1 0.578 75.7 130.4 105.2 19.7 -3.7 -6.7 -7.3 40 40 A I > + 0 0 0 -33,-0.2 4,-0.6 1,-0.1 3,-0.4 0.875 64.0 68.3 -68.0 -36.6 -0.1 -7.7 -6.5 41 41 A E T >4 + 0 0 69 -36,-0.6 3,-1.9 1,-0.2 2,-0.6 0.944 59.5 112.5 -44.2 -84.0 -1.3 -11.2 -5.7 42 42 A M T 34 S- 0 0 109 1,-0.2 -1,-0.2 -37,-0.2 -2,-0.1 -0.171 105.4 -51.8 44.9 -91.9 -2.4 -12.4 -9.2 43 43 A G T 34 S+ 0 0 75 -2,-0.6 -1,-0.2 -3,-0.4 -2,-0.1 0.165 103.3 109.2-163.8 25.8 0.3 -15.1 -9.6 44 44 A E S << S- 0 0 77 -3,-1.9 5,-0.1 -4,-0.6 -4,-0.0 -0.138 71.0 -81.2 -94.5-166.7 3.7 -13.5 -8.9 45 45 A T > - 0 0 59 1,-0.1 4,-2.6 -2,-0.1 5,-0.4 -0.617 46.2 -96.5 -97.9 159.8 6.1 -13.8 -6.0 46 46 A P T 4 S+ 0 0 40 0, 0.0 4,-0.3 0, 0.0 -1,-0.1 0.752 129.7 26.3 -43.6 -26.7 5.9 -12.0 -2.6 47 47 A E T > S+ 0 0 107 2,-0.1 4,-2.0 3,-0.1 3,-0.3 0.813 121.9 49.6-104.3 -48.8 8.3 -9.5 -4.2 48 48 A Q H > S+ 0 0 127 1,-0.2 4,-0.5 2,-0.2 -1,-0.0 0.534 104.4 65.5 -71.2 -4.6 7.7 -9.8 -8.0 49 49 A A H X S+ 0 0 0 -4,-2.6 4,-0.7 2,-0.1 -1,-0.2 0.907 109.6 32.4 -82.7 -45.1 4.0 -9.4 -7.2 50 50 A V H > S+ 0 0 4 -5,-0.4 4,-4.4 -3,-0.3 3,-0.3 0.826 106.8 71.2 -79.3 -33.9 4.1 -5.9 -5.8 51 51 A V H X S+ 0 0 75 -4,-2.0 4,-1.0 1,-0.3 -1,-0.2 0.842 102.0 46.1 -51.0 -35.6 7.0 -4.8 -8.1 52 52 A R H X S+ 0 0 105 -4,-0.5 4,-0.9 2,-0.2 -1,-0.3 0.831 117.5 42.1 -78.1 -31.6 4.5 -4.9 -11.0 53 53 A E H X S+ 0 0 0 -4,-0.7 4,-3.3 -3,-0.3 5,-0.3 0.816 101.8 70.7 -79.3 -35.4 1.9 -3.0 -9.0 54 54 A L H < S+ 0 0 32 -4,-4.4 5,-0.3 1,-0.3 -2,-0.2 0.919 110.0 33.2 -47.9 -48.6 4.5 -0.6 -7.7 55 55 A Q H X S+ 0 0 125 -4,-1.0 4,-1.7 -5,-0.2 3,-0.3 0.770 118.1 55.7 -78.4 -27.6 4.8 0.9 -11.2 56 56 A E H < S+ 0 0 82 -4,-0.9 -2,-0.2 1,-0.2 -1,-0.2 0.720 114.3 39.4 -75.7 -23.7 1.2 0.2 -11.9 57 57 A E T < S+ 0 0 11 -4,-3.3 41,-0.4 39,-0.4 -1,-0.2 0.319 133.7 23.0-108.0 5.4 0.2 2.2 -8.8 58 58 A V T 4 S- 0 0 1 -3,-0.3 37,-3.2 -5,-0.3 2,-2.1 0.529 70.6-173.5-134.3 -43.9 2.8 4.9 -9.2 59 59 A G < + 0 0 9 -4,-1.7 -4,-0.1 36,-0.3 -3,-0.1 -0.074 60.8 87.7 70.7 -40.7 3.7 4.9 -12.9 60 60 A I S S- 0 0 26 -2,-2.1 -1,-0.2 33,-0.1 -2,-0.1 -0.031 93.1 -96.9 -77.5-174.8 6.5 7.4 -12.1 61 61 A T + 0 0 107 30,-0.2 30,-0.8 -3,-0.1 2,-0.3 -0.828 55.6 164.8-110.8 89.0 10.0 6.7 -11.1 62 62 A P - 0 0 26 0, 0.0 2,-2.6 0, 0.0 28,-0.3 -0.834 50.8-113.0-109.2 148.5 10.2 7.0 -7.3 63 63 A Q + 0 0 114 -2,-0.3 26,-2.9 -51,-0.1 25,-1.6 -0.508 66.4 150.4 -74.8 80.1 12.7 5.9 -4.7 64 64 A H + 0 0 13 -2,-2.6 2,-0.3 24,-0.2 23,-0.2 -0.978 10.6 94.1-123.7 128.9 10.2 3.5 -3.4 65 65 A F + 0 0 117 -2,-0.4 -2,-0.0 21,-0.4 0, 0.0 -0.971 29.5 88.8 176.4-172.8 10.9 0.1 -1.7 66 66 A S - 0 0 56 -2,-0.3 2,-0.5 19,-0.2 20,-0.4 0.246 65.4-100.8 76.9 154.8 11.5 -1.7 1.6 67 67 A L - 0 0 75 18,-0.4 18,-0.3 1,-0.2 3,-0.1 -0.946 28.0-178.5-117.3 113.6 8.8 -3.3 3.7 68 68 A F S S- 0 0 64 -2,-0.5 2,-0.3 16,-0.5 17,-0.2 0.883 71.9 -28.9 -75.2 -39.4 7.6 -1.4 6.8 69 69 A E E -B 84 0A 62 15,-1.0 15,-3.3 2,-0.0 2,-0.3 -0.964 51.8-152.4-171.6 158.2 5.2 -4.2 7.9 70 70 A K E -B 83 0A 65 -2,-0.3 2,-0.7 13,-0.3 13,-0.3 -0.993 15.6-137.6-143.4 132.8 3.1 -7.1 6.6 71 71 A L E -B 82 0A 35 11,-2.7 11,-2.9 -2,-0.3 2,-0.6 -0.822 20.4-174.3 -98.2 115.7 -0.0 -8.6 8.0 72 72 A E E +B 81 0A 126 -2,-0.7 2,-0.3 9,-0.2 9,-0.2 -0.911 19.3 144.9-114.3 108.6 -0.1 -12.4 7.9 73 73 A Y E -B 80 0A 135 7,-1.6 7,-2.6 -2,-0.6 2,-0.5 -0.999 31.0-150.8-142.3 137.1 -3.3 -14.1 9.0 74 74 A E E -B 79 0A 134 -2,-0.3 5,-0.3 5,-0.3 4,-0.1 -0.944 11.0-161.3-116.7 123.2 -5.0 -17.3 7.8 75 75 A F - 0 0 108 3,-1.4 2,-0.6 -2,-0.5 -2,-0.0 -0.527 55.8 -50.2 -94.8 163.2 -8.7 -17.8 7.9 76 76 A P S S- 0 0 115 0, 0.0 2,-0.9 0, 0.0 -1,-0.1 0.006 119.1 -39.9 -34.9 80.3 -10.6 -21.1 7.7 77 77 A D S S+ 0 0 93 -2,-0.6 2,-1.0 1,-0.1 -75,-0.8 -0.283 130.1 90.1 87.5 -47.8 -8.9 -22.3 4.5 78 78 A R E -a 2 0A 149 -2,-0.9 -3,-1.4 -77,-0.1 -75,-0.3 -0.715 63.0-171.6 -86.1 101.7 -8.9 -18.8 3.0 79 79 A H E -aB 3 74A 28 -77,-2.5 -75,-1.7 -2,-1.0 2,-0.4 -0.609 7.7-153.4 -93.2 154.2 -5.7 -17.1 4.1 80 80 A I E -aB 4 73A 36 -7,-2.6 -7,-1.6 -2,-0.2 2,-0.4 -0.967 5.9-166.8-128.3 143.4 -4.8 -13.4 3.5 81 81 A T E -aB 5 72A 10 -77,-2.3 -75,-3.3 -2,-0.4 2,-0.6 -0.965 2.6-174.3-134.8 118.4 -1.4 -11.8 3.2 82 82 A L E -aB 6 71A 1 -11,-2.9 -11,-2.7 -2,-0.4 2,-0.5 -0.936 4.6-170.9-116.1 114.3 -0.8 -8.0 3.4 83 83 A W E -aB 7 70A 37 -77,-3.1 -75,-3.9 -2,-0.6 2,-0.5 -0.904 6.5-158.0-107.4 122.9 2.7 -6.7 2.7 84 84 A F E -aB 8 69A 5 -15,-3.3 -15,-1.0 -2,-0.5 2,-0.6 -0.843 4.9-154.0-100.6 130.3 3.4 -3.0 3.3 85 85 A W E -a 9 0A 14 -77,-3.6 2,-1.2 -2,-0.5 -75,-0.9 -0.904 14.2-134.6-106.8 120.0 6.4 -1.5 1.5 86 86 A L E -a 10 0A 41 -2,-0.6 -21,-0.4 -20,-0.4 -75,-0.1 -0.604 26.0-157.0 -79.0 98.4 8.1 1.5 3.2 87 87 A V - 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0 0 91 0, 0.0 2,-0.2 0, 0.0 -79,-0.1 -0.096 44.5-162.7 -43.4 125.9 -4.9 11.5 -6.3 102 102 A G - 0 0 16 -81,-0.1 2,-0.3 -83,-0.1 -81,-0.2 -0.507 14.0-109.6-108.0 177.8 -4.1 12.4 -2.7 103 103 A E E -D 20 0B 143 -83,-0.6 -83,-1.1 -2,-0.2 2,-0.7 -0.748 42.1 -86.9-108.7 157.2 -2.0 15.1 -1.0 104 104 A W E +D 19 0B 146 -2,-0.3 2,-0.3 -85,-0.2 -85,-0.2 -0.469 59.0 174.9 -64.0 106.7 1.3 14.9 0.8 105 105 A M E -D 18 0B 34 -87,-1.1 -87,-2.2 -2,-0.7 2,-0.4 -0.903 37.5-101.6-120.1 147.4 0.2 14.0 4.4 106 106 A S > - 0 0 42 -2,-0.3 3,-1.2 -89,-0.3 -89,-0.2 -0.508 21.7-158.6 -68.4 118.0 2.2 13.2 7.5 107 107 A L G > S+ 0 0 34 -2,-0.4 3,-1.7 -91,-0.4 -1,-0.2 0.680 76.0 94.5 -69.3 -18.0 2.1 9.4 8.1 108 108 A V G 3 S+ 0 0 125 1,-0.3 -1,-0.3 -3,-0.0 -2,-0.1 0.707 102.2 22.8 -47.5 -21.5 3.0 10.1 11.8 109 109 A G G < S+ 0 0 47 -3,-1.2 -1,-0.3 2,-0.0 -2,-0.1 -0.266 82.9 174.2-146.1 55.8 -0.7 10.0 12.4 110 110 A L < - 0 0 15 -3,-1.7 2,-0.6 1,-0.1 3,-0.1 -0.244 27.8-128.9 -62.7 150.5 -2.4 8.0 9.6 111 111 A N > - 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