==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER UNKNOWN FUNCTION 12-NOV-09 3AA9 . COMPND 2 MOLECULE: DIVALENT-CATION TOLERANCE PROTEIN CUTA; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR Y.MATSUURA,T.TANAKA,B.BAGAUTDINOV,N.KUNISHIMA,K.YUTANI . 311 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12441.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 242 77.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 111 35.7 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 . 3 1.0 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 . 20 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 28.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 0 1 2 2 0 3 1 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 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 3 0 3 3 0 0 3 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 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 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 9 A T 0 0 130 0, 0.0 2,-0.2 0, 0.0 99,-0.1 0.000 360.0 360.0 360.0 49.7 -0.5 -17.4 -27.7 2 10 A A - 0 0 58 1,-0.1 60,-2.7 59,-0.0 61,-0.3 -0.517 360.0-128.4 -74.1 139.2 0.4 -15.0 -24.9 3 11 A S E +A 61 0A 9 85,-0.4 85,-2.0 58,-0.3 2,-0.3 -0.500 29.4 176.8 -87.4 156.6 3.3 -12.7 -25.7 4 12 A V E -AB 60 87A 3 56,-3.1 56,-2.3 83,-0.2 2,-0.4 -0.981 24.6-129.8-152.5 161.2 6.4 -12.2 -23.5 5 13 A V E -AB 59 86A 1 81,-2.6 81,-2.9 -2,-0.3 2,-0.5 -0.939 19.5-149.4-116.4 142.0 9.7 -10.4 -23.4 6 14 A V E -AB 58 85A 0 52,-3.3 52,-2.8 -2,-0.4 2,-0.5 -0.940 2.7-152.4-114.2 128.4 12.9 -12.1 -22.6 7 15 A L E +AB 57 84A 13 77,-2.9 77,-2.1 -2,-0.5 2,-0.4 -0.868 20.7 170.9 -99.5 129.8 15.8 -10.4 -20.9 8 16 A C E -AB 56 83A 0 48,-1.7 48,-3.0 -2,-0.5 2,-0.6 -0.999 24.8-141.8-139.1 137.5 19.3 -11.8 -21.7 9 17 A T E -A 55 0A 9 73,-0.8 73,-0.2 -2,-0.4 46,-0.2 -0.881 18.0-167.6-101.5 119.5 22.7 -10.3 -20.7 10 18 A A E -A 54 0A 0 44,-2.7 44,-2.6 -2,-0.6 3,-0.1 -0.828 22.5-135.8-106.1 146.7 25.4 -10.6 -23.4 11 19 A P S S+ 0 0 26 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.816 82.0 0.6 -69.2 -31.6 29.1 -9.9 -22.6 12 20 A D S > S- 0 0 66 42,-0.1 4,-2.2 1,-0.1 5,-0.1 -0.945 75.0-100.3-151.7 170.9 29.8 -7.9 -25.8 13 21 A E H > S+ 0 0 79 -2,-0.3 4,-2.5 2,-0.2 5,-0.2 0.885 115.8 53.4 -65.1 -42.8 28.1 -6.5 -28.9 14 22 A A H > S+ 0 0 63 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.923 112.4 46.6 -59.9 -42.9 29.4 -9.2 -31.4 15 23 A T H > S+ 0 0 27 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.916 110.9 51.2 -65.5 -43.5 28.0 -11.9 -29.1 16 24 A A H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.903 111.7 48.1 -60.6 -41.3 24.6 -10.1 -28.7 17 25 A Q H X S+ 0 0 57 -4,-2.5 4,-3.1 2,-0.2 5,-0.2 0.911 111.5 48.9 -67.1 -43.0 24.3 -9.8 -32.4 18 26 A D H X S+ 0 0 114 -4,-2.3 4,-1.6 2,-0.2 -2,-0.2 0.913 113.0 47.4 -63.9 -42.7 25.1 -13.4 -33.1 19 27 A L H X S+ 0 0 5 -4,-2.6 4,-2.7 2,-0.2 5,-0.3 0.961 115.5 46.2 -62.3 -49.2 22.7 -14.6 -30.5 20 28 A A H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 5,-0.2 0.949 112.0 48.5 -57.0 -55.4 20.0 -12.3 -31.9 21 29 A A H X S+ 0 0 32 -4,-3.1 4,-1.1 1,-0.2 -1,-0.2 0.787 114.5 49.7 -56.8 -29.7 20.6 -13.2 -35.5 22 30 A K H X S+ 0 0 86 -4,-1.6 4,-2.5 -5,-0.2 3,-0.5 0.973 110.8 43.6 -75.1 -59.6 20.4 -16.9 -34.5 23 31 A V H <>S+ 0 0 1 -4,-2.7 5,-2.7 1,-0.3 6,-1.1 0.820 114.9 52.8 -59.0 -28.2 17.2 -17.0 -32.5 24 32 A L H <5S+ 0 0 4 -4,-2.2 3,-0.3 -5,-0.3 -1,-0.3 0.842 109.1 47.9 -73.6 -36.2 15.6 -14.8 -35.2 25 33 A A H <5S+ 0 0 56 -4,-1.1 -2,-0.2 -3,-0.5 -1,-0.2 0.888 110.6 51.4 -70.3 -39.3 16.6 -17.2 -37.9 26 34 A E T <5S- 0 0 70 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.580 111.3-128.0 -71.0 -11.7 15.3 -20.2 -35.9 27 35 A K T 5S+ 0 0 100 -3,-0.3 77,-2.9 -4,-0.3 -3,-0.2 0.866 75.4 123.5 62.9 39.4 12.1 -18.2 -35.5 28 36 A L S S-C 47 0A 127 3,-2.6 3,-1.8 -2,-0.3 -2,-0.0 -0.939 74.2 -16.0-142.7 116.4 31.1 -14.1 -7.6 45 53 A E T 3 S- 0 0 186 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.874 129.6 -53.3 57.5 38.0 33.1 -16.2 -5.1 46 54 A G T 3 S+ 0 0 69 1,-0.2 2,-0.4 0, 0.0 -1,-0.3 0.372 116.7 112.4 81.6 -5.5 32.5 -13.5 -2.5 47 55 A K E < S- C 0 44A 132 -3,-1.8 -3,-2.6 1,-0.0 2,-0.7 -0.818 70.2-120.0-106.7 142.2 33.9 -10.7 -4.7 48 56 A L E - C 0 43A 62 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.677 34.5-167.5 -80.4 114.0 32.0 -7.8 -6.2 49 57 A E E - C 0 42A 55 -7,-3.3 -7,-1.9 -2,-0.7 2,-0.4 -0.767 12.4-172.3-103.6 148.9 32.3 -7.9 -10.0 50 58 A Q E + C 0 41A 92 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.933 15.0 173.4-142.0 114.3 31.3 -5.2 -12.4 51 59 A E E - C 0 40A 60 -11,-2.2 -11,-2.5 -2,-0.4 2,-0.2 -0.906 36.1-108.7-126.9 151.4 31.4 -5.9 -16.1 52 60 A Y E + C 0 39A 110 -2,-0.3 2,-0.3 -13,-0.2 -13,-0.3 -0.509 48.6 171.5 -71.1 141.8 30.4 -4.2 -19.3 53 61 A V E - C 0 38A 2 -15,-2.5 -15,-1.4 -2,-0.2 2,-0.5 -0.955 35.2-128.7-148.4 166.8 27.3 -5.9 -20.9 54 62 A V E -A 10 0A 0 -44,-2.6 -44,-2.7 -2,-0.3 2,-0.6 -0.993 26.9-137.7-119.4 121.9 24.8 -5.5 -23.6 55 63 A Q E -AC 9 35A 1 -20,-2.6 -20,-2.8 -2,-0.5 2,-0.4 -0.725 19.2-158.9 -84.1 121.4 21.2 -5.8 -22.4 56 64 A M E -AC 8 34A 0 -48,-3.0 -48,-1.7 -2,-0.6 2,-0.4 -0.813 10.7-171.0-102.0 141.1 19.1 -7.9 -24.8 57 65 A I E -AC 7 33A 16 -24,-2.3 -24,-2.8 -2,-0.4 2,-0.3 -0.937 12.4-173.7-131.4 107.0 15.3 -7.7 -24.9 58 66 A L E -AC 6 32A 0 -52,-2.8 -52,-3.3 -2,-0.4 2,-0.5 -0.817 14.3-142.5-106.7 146.6 13.7 -10.3 -27.1 59 67 A K E +AC 5 31A 0 -28,-2.5 -29,-3.2 -2,-0.3 -28,-0.9 -0.916 40.0 124.6-110.0 128.2 10.1 -10.7 -28.1 60 68 A T E -A 4 0A 0 -56,-2.3 -56,-3.1 -2,-0.5 2,-0.3 -0.824 49.4 -93.6-156.9-166.6 8.3 -14.0 -28.3 61 69 A T E >> -A 3 0A 4 -58,-0.3 4,-1.3 -33,-0.3 3,-0.9 -0.773 36.0-103.9-120.9 167.2 5.3 -16.0 -27.0 62 70 A V H 3> S+ 0 0 69 -60,-2.7 4,-0.6 -2,-0.3 3,-0.2 0.851 117.7 61.4 -57.5 -37.3 4.8 -18.5 -24.2 63 71 A S H 34 S+ 0 0 92 -61,-0.3 4,-0.3 1,-0.2 -1,-0.2 0.806 115.1 31.9 -60.8 -31.3 4.8 -21.4 -26.6 64 72 A H H <> S+ 0 0 31 -3,-0.9 4,-3.0 2,-0.1 5,-0.2 0.534 91.2 95.2-105.8 -8.3 8.3 -20.6 -27.7 65 73 A Q H X S+ 0 0 26 -4,-1.3 4,-2.6 -3,-0.2 5,-0.2 0.903 87.4 47.1 -50.9 -50.0 9.8 -19.2 -24.5 66 74 A Q H X S+ 0 0 81 -4,-0.6 4,-2.3 1,-0.2 -1,-0.2 0.941 115.7 44.1 -59.1 -50.0 11.3 -22.5 -23.3 67 75 A A H > S+ 0 0 32 -4,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.868 112.4 53.7 -63.5 -37.6 12.9 -23.3 -26.7 68 76 A L H X S+ 0 0 0 -4,-3.0 4,-2.7 2,-0.2 5,-0.2 0.946 110.2 46.8 -62.3 -47.6 14.1 -19.7 -27.1 69 77 A L H X S+ 0 0 1 -4,-2.6 4,-3.0 -5,-0.2 -2,-0.2 0.898 111.2 52.1 -60.9 -41.2 15.9 -19.9 -23.7 70 78 A E H X S+ 0 0 104 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.922 112.2 45.6 -61.8 -44.4 17.4 -23.3 -24.6 71 79 A C H X S+ 0 0 16 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.924 114.8 46.6 -65.7 -45.9 18.8 -21.9 -27.8 72 80 A L H X S+ 0 0 1 -4,-2.7 4,-1.2 1,-0.2 -2,-0.2 0.935 112.2 51.8 -61.3 -45.5 20.1 -18.8 -26.2 73 81 A K H >< S+ 0 0 41 -4,-3.0 3,-0.6 -5,-0.2 -2,-0.2 0.934 108.2 51.3 -57.1 -49.2 21.6 -20.8 -23.4 74 82 A S H 3< S+ 0 0 96 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.916 117.3 36.4 -55.8 -50.6 23.4 -23.2 -25.8 75 83 A H H 3< S+ 0 0 102 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.510 93.0 106.5 -84.8 -3.9 25.1 -20.5 -27.9 76 84 A H << - 0 0 8 -4,-1.2 -66,-0.0 -3,-0.6 -60,-0.0 -0.623 69.3-140.0 -77.9 128.1 25.7 -18.2 -24.9 77 85 A P S S+ 0 0 84 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 0.793 80.3 83.4 -57.9 -27.9 29.4 -18.2 -24.0 78 86 A Y S S- 0 0 82 1,-0.1 -2,-0.1 -3,-0.0 -68,-0.0 -0.350 80.9-130.8 -75.4 158.2 28.5 -18.1 -20.3 79 87 A Q S S+ 0 0 158 1,-0.3 -1,-0.1 -2,-0.1 -3,-0.1 0.960 100.9 6.5 -71.3 -53.4 27.6 -21.3 -18.3 80 88 A T S S- 0 0 37 119,-0.1 -1,-0.3 120,-0.1 3,-0.1 -0.718 84.4-177.1-133.6 81.7 24.4 -19.9 -16.8 81 89 A P - 0 0 2 0, 0.0 2,-0.3 0, 0.0 119,-0.1 -0.291 42.9 -79.5 -75.6 163.8 23.6 -16.5 -18.3 82 90 A E + 0 0 8 -73,-0.2 -73,-0.8 118,-0.1 2,-0.4 -0.496 54.0 169.7 -67.7 123.3 20.7 -14.3 -17.3 83 91 A L E +B 8 0A 0 -2,-0.3 114,-1.9 -75,-0.2 2,-0.4 -0.880 7.0 164.6-138.7 100.7 17.6 -15.6 -18.9 84 92 A L E -BF 7 196A 1 -77,-2.1 -77,-2.9 -2,-0.4 2,-0.5 -0.962 23.5-151.6-125.5 138.3 14.3 -14.1 -17.6 85 93 A V E -BF 6 195A 0 110,-3.2 109,-1.5 -2,-0.4 110,-1.1 -0.919 11.2-171.0-110.9 128.1 10.8 -14.1 -19.0 86 94 A L E -B 5 0A 5 -81,-2.9 -81,-2.6 -2,-0.5 107,-0.2 -0.950 25.7-113.8-117.7 139.7 8.4 -11.3 -18.3 87 95 A P E -B 4 0A 24 0, 0.0 2,-0.7 0, 0.0 -83,-0.2 -0.431 12.3-145.9 -74.8 140.2 4.7 -11.3 -19.3 88 96 A V - 0 0 16 -85,-2.0 -85,-0.4 208,-0.2 208,-0.2 -0.924 14.4-175.0-104.6 108.0 3.1 -9.0 -21.8 89 97 A T - 0 0 80 206,-1.5 2,-0.3 -2,-0.7 207,-0.2 0.472 66.8 -10.8 -83.6 -1.5 -0.4 -8.3 -20.5 90 98 A H E +G 295 0A 66 205,-0.9 205,-3.0 -87,-0.0 2,-0.3 -0.924 63.1 163.4 176.3 160.6 -1.4 -6.3 -23.6 91 99 A G E -G 294 0A 5 -2,-0.3 2,-0.3 203,-0.2 203,-0.2 -0.966 50.8 -53.3-175.2 176.7 -0.1 -4.7 -26.7 92 100 A D > - 0 0 17 201,-1.8 4,-2.8 -2,-0.3 3,-0.3 -0.532 46.4-133.3 -69.8 129.9 -1.0 -3.2 -30.1 93 101 A T H > S+ 0 0 110 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.881 103.9 48.7 -50.5 -48.0 -3.0 -5.7 -32.2 94 102 A D H > S+ 0 0 72 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.881 113.3 46.7 -63.3 -39.3 -1.0 -5.2 -35.4 95 103 A Y H > S+ 0 0 8 -3,-0.3 4,-3.0 2,-0.2 -2,-0.2 0.946 114.5 47.0 -67.5 -47.5 2.3 -5.6 -33.6 96 104 A L H X S+ 0 0 39 -4,-2.8 4,-3.0 2,-0.2 5,-0.3 0.897 111.8 50.2 -60.4 -43.5 1.2 -8.7 -31.7 97 105 A S H X S+ 0 0 63 -4,-2.8 4,-2.7 -5,-0.3 -1,-0.2 0.941 113.9 46.3 -62.1 -42.9 -0.3 -10.2 -34.9 98 106 A W H X S+ 0 0 47 -4,-2.1 4,-0.8 -5,-0.2 -2,-0.2 0.895 112.7 50.0 -63.5 -42.9 3.1 -9.5 -36.6 99 107 A L H >X S+ 0 0 0 -4,-3.0 3,-1.2 2,-0.2 4,-0.6 0.969 113.9 44.4 -59.9 -53.9 5.0 -10.9 -33.7 100 108 A N H >< S+ 0 0 55 -4,-3.0 3,-1.3 1,-0.3 -2,-0.2 0.905 111.0 54.3 -57.1 -45.7 3.0 -14.1 -33.6 101 109 A A H 3< S+ 0 0 81 -4,-2.7 -1,-0.3 -5,-0.3 -2,-0.2 0.636 102.8 59.6 -65.6 -14.6 3.1 -14.5 -37.4 102 110 A S H << S+ 0 0 26 -3,-1.2 -1,-0.3 -4,-0.8 -2,-0.2 0.632 89.0 94.4 -88.9 -15.4 6.9 -14.2 -37.2 103 111 A L << 0 0 14 -3,-1.3 -75,-0.2 -4,-0.6 -76,-0.1 -0.415 360.0 360.0 -83.3 155.6 7.4 -17.3 -34.9 104 112 A R 0 0 172 -77,-2.9 -1,-0.1 -78,-0.1 -77,-0.1 -0.085 360.0 360.0 -49.6 360.0 8.1 -20.9 -35.9 105 !* 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 0.0 106 9 B T 0 0 93 0, 0.0 99,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 140.9 10.6 -18.4 -4.6 107 10 B A - 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