==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 16-SEP-10 2L3M . COMPND 2 MOLECULE: COPPER-ION-BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS ANTHRACIS; . AUTHOR Y.ZHANG,J.WINSOR,I.DUBROVSKA,W.ANDERSON,I.RADHAKRISHNAN,CENT . 71 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4249.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 61 85.9 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 . 19 26.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 1.4 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 . 1 1.4 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 . 13 18.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 6 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 20 28.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 2.8 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 0 0 0 0 0 1 0 1 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 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 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 S 0 0 80 0, 0.0 3,-0.2 0, 0.0 32,-0.0 0.000 360.0 360.0 360.0 116.8 14.7 -4.8 -4.1 2 2 A N + 0 0 134 1,-0.3 2,-0.4 0, 0.0 48,-0.0 0.930 360.0 9.6 -80.7 -53.1 17.8 -3.9 -2.1 3 3 A A S S- 0 0 43 2,-0.0 48,-2.3 0, 0.0 2,-0.5 -0.854 77.3-169.1-133.3 96.3 16.1 -3.6 1.3 4 4 A M E -A 50 0A 76 -2,-0.4 2,-0.4 46,-0.3 46,-0.3 -0.766 1.0-169.3 -94.9 124.6 12.6 -4.9 1.4 5 5 A E E -A 49 0A 115 44,-2.7 44,-2.5 -2,-0.5 2,-0.9 -0.912 20.3-134.1-109.1 135.7 10.5 -4.2 4.5 6 6 A Q E +A 48 0A 116 -2,-0.4 2,-0.4 42,-0.2 42,-0.2 -0.798 32.5 179.9 -91.6 105.8 7.1 -5.9 5.0 7 7 A L E -A 47 0A 49 40,-3.2 40,-3.5 -2,-0.9 2,-0.6 -0.891 18.2-154.5-112.5 135.5 4.7 -3.2 6.1 8 8 A T E -A 46 0A 79 -2,-0.4 2,-0.5 38,-0.3 38,-0.3 -0.930 11.8-163.9-112.7 114.1 1.0 -3.6 6.9 9 9 A L E -A 45 0A 16 36,-3.1 36,-3.0 -2,-0.6 2,-0.4 -0.828 15.4-136.2 -99.2 128.4 -1.1 -0.5 6.5 10 10 A Q E -A 44 0A 113 61,-0.7 61,-1.3 -2,-0.5 2,-0.5 -0.713 26.4-152.1 -80.7 133.4 -4.6 -0.3 8.1 11 11 A V E -C 70 0B 4 32,-3.7 2,-0.7 -2,-0.4 3,-0.4 -0.932 18.4-171.7-121.2 118.3 -6.9 1.2 5.5 12 12 A E E S+C 69 0B 138 57,-3.2 57,-3.2 -2,-0.5 3,-0.1 -0.925 73.6 48.8-105.0 108.4 -10.1 3.2 6.1 13 13 A G + 0 0 38 -2,-0.7 2,-1.2 55,-0.2 3,-0.3 0.312 67.1 115.5 147.8 -6.3 -12.0 3.8 2.9 14 14 A M + 0 0 19 -3,-0.4 -1,-0.1 1,-0.2 -3,-0.1 -0.723 21.9 139.6 -93.6 90.3 -12.2 0.4 1.1 15 15 A S + 0 0 108 -2,-1.2 2,-0.3 -3,-0.1 -1,-0.2 0.583 62.2 52.9-101.2 -14.9 -16.0 -0.2 1.1 16 16 A C S >> S- 0 0 61 -3,-0.3 4,-0.6 1,-0.1 3,-0.5 -0.799 80.0-120.8-125.1 162.5 -16.0 -1.6 -2.4 17 17 A G H >> S+ 0 0 55 -2,-0.3 3,-0.9 1,-0.2 4,-0.9 0.825 109.7 61.6 -70.6 -33.5 -14.3 -4.3 -4.4 18 18 A H H 3> S+ 0 0 137 1,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.765 93.5 67.1 -65.0 -22.6 -12.9 -1.9 -7.1 19 19 A C H <> S+ 0 0 10 -3,-0.5 4,-3.2 2,-0.2 5,-0.4 0.868 92.0 62.1 -64.0 -36.5 -11.1 -0.3 -4.2 20 20 A V H < S+ 0 0 0 -4,-1.9 3,-1.2 2,-0.1 6,-0.2 0.901 121.7 52.7 -82.8 -49.3 1.1 1.1 -4.2 28 28 A K H 3< S+ 0 0 86 -4,-3.0 5,-0.2 1,-0.3 -3,-0.2 0.847 102.0 58.1 -58.1 -41.9 2.2 -1.4 -6.8 29 29 A E T 3< S+ 0 0 154 -4,-3.9 2,-0.4 -5,-0.1 -1,-0.3 0.755 85.7 97.5 -63.0 -24.4 2.6 1.2 -9.6 30 30 A L S X S- 0 0 36 -3,-1.2 3,-2.0 -5,-0.4 2,-0.2 -0.540 87.3-116.9 -69.1 120.5 5.1 3.0 -7.4 31 31 A N T 3 S+ 0 0 134 -2,-0.4 3,-0.1 1,-0.2 -1,-0.1 -0.396 101.1 38.8 -60.1 125.8 8.6 1.9 -8.4 32 32 A G T 3 S+ 0 0 14 1,-0.5 18,-3.0 -2,-0.2 2,-0.4 0.067 84.6 117.0 118.1 -22.1 10.2 0.2 -5.4 33 33 A V E < -B 49 0A 12 -3,-2.0 -1,-0.5 -6,-0.2 16,-0.2 -0.654 39.4-176.9 -80.5 130.9 7.2 -1.7 -4.3 34 34 A E E - 0 0 72 14,-2.9 2,-0.3 -2,-0.4 -1,-0.2 0.926 60.0 -9.1 -91.6 -68.7 7.6 -5.5 -4.6 35 35 A Q E -B 48 0A 112 13,-1.0 13,-2.9 2,-0.0 2,-0.4 -0.966 56.8-153.3-136.9 149.8 4.3 -7.1 -3.7 36 36 A V E -B 47 0A 23 -2,-0.3 2,-0.6 11,-0.2 11,-0.2 -0.982 4.6-165.0-127.7 132.3 1.0 -5.9 -2.2 37 37 A K E -B 46 0A 104 9,-2.4 9,-2.9 -2,-0.4 2,-0.8 -0.850 12.1-171.3-114.3 92.9 -1.5 -7.8 -0.1 38 38 A V E -B 45 0A 26 -2,-0.6 2,-1.0 7,-0.3 7,-0.2 -0.766 4.4-164.5 -87.8 111.4 -4.7 -5.8 -0.1 39 39 A Q E >> -B 44 0A 66 5,-3.3 4,-2.2 -2,-0.8 5,-1.4 -0.802 7.3-177.1-100.6 94.1 -7.1 -7.4 2.4 40 40 A L T 45S+ 0 0 67 -2,-1.0 -1,-0.2 1,-0.2 -26,-0.1 0.915 82.6 44.7 -57.2 -48.9 -10.5 -5.9 1.6 41 41 A A T 45S+ 0 0 84 1,-0.2 -1,-0.2 2,-0.1 -2,-0.1 0.747 117.3 45.3 -71.2 -24.4 -12.3 -7.7 4.4 42 42 A E T 45S- 0 0 132 -3,-0.3 -1,-0.2 2,-0.2 -2,-0.2 0.741 101.3-128.3 -92.8 -25.6 -9.6 -7.0 7.0 43 43 A G T <5S+ 0 0 17 -4,-2.2 -32,-3.7 1,-0.3 2,-0.3 0.791 70.9 109.7 80.3 27.8 -9.1 -3.3 6.2 44 44 A T E < -AB 10 39A 33 -5,-1.4 -5,-3.3 -34,-0.3 2,-0.5 -0.981 53.3-155.0-136.2 149.1 -5.3 -3.8 5.8 45 45 A V E -AB 9 38A 0 -36,-3.0 -36,-3.1 -2,-0.3 2,-0.8 -0.963 10.2-158.8-123.7 112.8 -2.8 -3.8 3.0 46 46 A E E -AB 8 37A 51 -9,-2.9 -9,-2.4 -2,-0.5 2,-0.4 -0.817 19.9-177.7 -93.4 109.6 0.4 -5.7 3.6 47 47 A V E -AB 7 36A 0 -40,-3.5 -40,-3.2 -2,-0.8 2,-0.7 -0.906 25.6-148.9-116.7 135.0 3.1 -4.4 1.3 48 48 A T E -AB 6 35A 17 -13,-2.9 -14,-2.9 -2,-0.4 -13,-1.0 -0.898 32.1-180.0 -96.8 110.1 6.7 -5.5 0.7 49 49 A I E -AB 5 33A 1 -44,-2.5 -44,-2.7 -2,-0.7 2,-1.0 -0.867 35.2-128.7-115.7 146.9 8.6 -2.3 -0.2 50 50 A D E >> -A 4 0A 7 -18,-3.0 4,-2.3 -2,-0.4 3,-2.0 -0.826 21.0-168.5 -87.4 102.6 12.2 -1.6 -1.1 51 51 A S T 34 S+ 0 0 61 -48,-2.3 -1,-0.1 -2,-1.0 -47,-0.1 0.462 82.7 70.8 -75.6 1.0 12.9 1.2 1.2 52 52 A S T 34 S+ 0 0 74 -49,-0.4 -1,-0.3 -20,-0.1 3,-0.1 0.379 118.0 17.8 -91.5 1.0 16.1 1.8 -0.7 53 53 A V T <4 S+ 0 0 75 -3,-2.0 2,-0.3 1,-0.5 -2,-0.2 0.529 127.2 37.1-131.5 -62.4 13.9 3.1 -3.6 54 54 A V S < S- 0 0 8 -4,-2.3 -1,-0.5 -22,-0.2 2,-0.2 -0.747 74.7-136.1-101.0 146.8 10.4 4.0 -2.4 55 55 A T > - 0 0 61 -2,-0.3 4,-1.4 -3,-0.1 5,-0.1 -0.508 19.3-118.6 -97.3 168.9 9.6 5.6 0.9 56 56 A L H > S+ 0 0 91 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.872 116.3 53.8 -70.8 -37.1 6.9 4.9 3.4 57 57 A K H > S+ 0 0 148 2,-0.2 4,-3.7 1,-0.2 5,-0.3 0.903 103.0 56.4 -64.4 -42.9 5.5 8.4 2.9 58 58 A D H > S+ 0 0 82 2,-0.2 4,-2.2 1,-0.2 5,-0.3 0.926 108.3 48.6 -53.2 -47.7 5.3 7.9 -0.8 59 59 A I H X S+ 0 0 4 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.962 116.6 41.1 -56.2 -55.7 3.1 4.8 -0.2 60 60 A V H X S+ 0 0 30 -4,-2.2 4,-3.0 1,-0.2 5,-0.3 0.931 112.8 53.9 -60.3 -49.4 0.8 6.6 2.3 61 61 A A H X S+ 0 0 44 -4,-3.7 4,-1.8 1,-0.2 -1,-0.2 0.899 112.9 42.3 -55.2 -48.1 0.7 9.9 0.2 62 62 A V H X S+ 0 0 41 -4,-2.2 4,-1.6 -5,-0.3 -1,-0.2 0.924 114.2 51.7 -66.6 -44.5 -0.5 8.1 -2.9 63 63 A I H <>S+ 0 0 0 -4,-2.3 5,-0.7 -5,-0.3 3,-0.4 0.933 112.7 44.0 -58.5 -48.8 -2.9 5.8 -1.1 64 64 A E H ><5S+ 0 0 80 -4,-3.0 3,-1.5 1,-0.2 4,-0.2 0.849 108.3 58.7 -68.0 -33.2 -4.6 8.7 0.7 65 65 A D H 3<5S+ 0 0 132 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.838 99.6 58.9 -62.8 -31.7 -4.7 10.8 -2.5 66 66 A Q T 3<5S- 0 0 94 -4,-1.6 -1,-0.3 -3,-0.4 -2,-0.2 0.556 134.8 -89.9 -74.6 -8.8 -6.7 7.9 -4.0 67 67 A G T < 5S+ 0 0 53 -3,-1.5 2,-0.3 1,-0.3 -3,-0.2 0.795 86.1 122.1 105.6 36.8 -9.2 8.5 -1.2 68 68 A Y < - 0 0 19 -5,-0.7 2,-0.7 -4,-0.2 -1,-0.3 -0.954 53.4-137.7-128.5 148.7 -8.2 6.3 1.6 69 69 A D E +C 12 0B 81 -57,-3.2 -57,-3.2 -2,-0.3 2,-0.4 -0.925 32.0 176.0-105.3 112.9 -7.3 7.0 5.2 70 70 A V E C 11 0B 3 -2,-0.7 -59,-0.2 -59,-0.2 -6,-0.1 -0.929 360.0 360.0-124.2 143.2 -4.2 5.0 6.3 71 71 A Q 0 0 169 -61,-1.3 -61,-0.7 -2,-0.4 -2,-0.0 -0.900 360.0 360.0-110.2 360.0 -2.3 4.9 9.5