==== 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 METAL BINDING PROTEIN 13-JUL-08 3DSP . COMPND 2 MOLECULE: PUTATIVE UNCHARACTERIZED PROTEIN COPK; . SOURCE 2 ORGANISM_SCIENTIFIC: RALSTONIA METALLIDURANS; . AUTHOR M.-R.ASH,M.J.MAHER . 66 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4862.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 39 59.1 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 . 25 37.9 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 . 4 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 1.5 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 . 6 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 12.1 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+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 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 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 . 1 2 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 V 0 0 79 0, 0.0 2,-0.8 0, 0.0 28,-0.0 0.000 360.0 360.0 360.0 159.2 -23.7 14.9 -3.0 2 2 A D > - 0 0 108 1,-0.1 3,-0.7 3,-0.0 4,-0.2 -0.858 360.0-169.1 -88.1 108.0 -24.7 12.4 -5.7 3 3 A M T 3 + 0 0 102 -2,-0.8 -1,-0.1 1,-0.2 3,-0.1 0.387 62.2 97.9 -82.0 0.6 -22.8 9.3 -4.5 4 4 A S T 3 S+ 0 0 90 1,-0.2 -1,-0.2 17,-0.0 -2,-0.0 0.902 99.9 21.1 -50.3 -49.8 -23.5 7.4 -7.8 5 5 A N S < S+ 0 0 103 -3,-0.7 17,-1.6 18,-0.0 2,-0.3 0.346 90.7 127.0-107.1 1.7 -20.1 8.2 -9.2 6 6 A V E +A 21 0A 23 -4,-0.2 15,-0.3 15,-0.2 3,-0.1 -0.471 28.6 176.6 -66.7 122.5 -18.2 9.0 -6.0 7 7 A V E + 0 0 91 13,-2.8 2,-0.3 1,-0.3 14,-0.2 0.629 66.8 18.9 -99.0 -22.2 -15.0 6.9 -6.0 8 8 A K E -A 20 0A 84 12,-1.7 12,-2.8 2,-0.0 2,-0.4 -0.970 55.8-167.1-154.9 139.7 -13.7 8.4 -2.8 9 9 A T E -A 19 0A 39 -2,-0.3 2,-0.7 10,-0.2 10,-0.2 -0.985 7.3-160.0-124.4 124.6 -14.8 10.4 0.4 10 10 A Y E -A 18 0A 34 8,-3.1 8,-2.4 -2,-0.4 2,-0.7 -0.909 14.1-151.4 -98.4 117.4 -12.5 12.0 2.9 11 11 A D E -A 17 0A 49 -2,-0.7 36,-3.9 6,-0.2 37,-0.5 -0.821 17.7-150.7 -92.9 112.1 -14.4 12.6 6.1 12 12 A L B > -D 46 0B 0 4,-2.5 3,-1.6 -2,-0.7 34,-0.3 -0.486 19.0-119.0 -94.0 155.6 -12.9 15.6 7.7 13 13 A Q T 3 S+ 0 0 99 32,-2.3 33,-0.1 1,-0.3 -1,-0.1 0.661 110.0 60.2 -67.7 -24.7 -12.7 16.3 11.4 14 14 A D T 3 S- 0 0 101 31,-0.4 -1,-0.3 2,-0.1 17,-0.2 0.398 123.9 -99.6 -84.8 4.2 -14.7 19.5 11.3 15 15 A G S < S+ 0 0 28 -3,-1.6 -2,-0.1 1,-0.3 -1,-0.0 0.093 86.0 119.7 100.8 -21.1 -17.7 17.5 9.9 16 16 A S - 0 0 3 -5,-0.1 -4,-2.5 16,-0.1 2,-0.4 -0.195 50.2-142.3 -73.9 166.5 -17.2 18.4 6.2 17 17 A K E -AB 11 29A 51 12,-2.4 12,-2.2 -6,-0.2 2,-0.5 -0.999 6.2-152.5-133.7 138.3 -16.6 15.9 3.4 18 18 A V E -AB 10 28A 0 -8,-2.4 -8,-3.1 -2,-0.4 2,-0.4 -0.955 20.2-166.6-105.8 121.3 -14.4 15.9 0.3 19 19 A H E -AB 9 27A 4 8,-3.5 8,-3.6 -2,-0.5 2,-0.4 -0.887 8.4-158.3-108.1 139.4 -15.7 13.7 -2.5 20 20 A V E -AB 8 26A 23 -12,-2.8 -13,-2.8 -2,-0.4 -12,-1.7 -0.973 14.5-147.1-115.8 132.1 -13.9 12.6 -5.6 21 21 A F E > -A 6 0A 42 4,-3.7 3,-1.9 -2,-0.4 -15,-0.2 -0.541 26.3-108.4 -98.0 163.6 -15.8 11.5 -8.6 22 22 A K T 3 S+ 0 0 163 -17,-1.6 -16,-0.1 1,-0.3 -1,-0.1 0.774 119.5 56.2 -63.7 -28.8 -15.0 8.9 -11.3 23 23 A D T 3 S- 0 0 110 -18,-0.1 -1,-0.3 2,-0.0 3,-0.1 0.317 125.0-104.3 -82.0 8.6 -14.4 11.6 -13.9 24 24 A G S < S+ 0 0 38 -3,-1.9 -2,-0.2 1,-0.3 2,-0.0 0.439 76.1 143.1 79.4 -1.1 -11.8 13.0 -11.5 25 25 A K - 0 0 133 -5,-0.1 -4,-3.7 1,-0.0 2,-0.4 -0.365 38.4-147.7 -64.2 156.2 -14.1 15.9 -10.5 26 26 A M E -B 20 0A 41 -6,-0.3 2,-0.3 -3,-0.1 -6,-0.2 -0.946 14.3-171.8-131.8 142.7 -13.9 16.8 -6.9 27 27 A G E -B 19 0A 19 -8,-3.6 -8,-3.5 -2,-0.4 2,-0.4 -0.993 8.4-163.5-138.3 145.9 -16.5 18.1 -4.5 28 28 A M E -BC 18 36A 15 8,-0.7 8,-2.3 -2,-0.3 2,-0.3 -0.987 7.5-177.7-123.2 141.2 -16.7 19.4 -1.0 29 29 A E E -BC 17 35A 29 -12,-2.2 -12,-2.4 -2,-0.4 6,-0.3 -0.953 23.9-120.5-129.4 153.9 -19.7 19.8 1.2 30 30 A N > - 0 0 52 4,-2.3 3,-2.3 -2,-0.3 -15,-0.1 -0.106 45.6 -78.8 -83.7-175.9 -20.0 21.3 4.7 31 31 A K T 3 S+ 0 0 141 1,-0.3 -1,-0.1 -17,-0.2 -16,-0.0 0.684 133.1 49.4 -60.4 -18.4 -21.1 19.6 8.0 32 32 A F T 3 S- 0 0 153 2,-0.1 -1,-0.3 0, 0.0 -16,-0.1 0.212 123.1-101.3-102.8 9.8 -24.8 20.1 6.8 33 33 A G S < S+ 0 0 36 -3,-2.3 2,-0.5 1,-0.2 -2,-0.1 0.794 72.6 145.1 76.8 28.4 -24.3 18.7 3.3 34 34 A K - 0 0 131 1,-0.0 -4,-2.3 -33,-0.0 -1,-0.2 -0.883 54.3-109.1-104.4 128.0 -24.0 22.0 1.5 35 35 A S E +C 29 0A 111 -2,-0.5 2,-0.3 -6,-0.3 -6,-0.3 -0.186 46.0 170.0 -43.0 133.1 -21.8 22.4 -1.5 36 36 A M E -C 28 0A 74 -8,-2.3 -8,-0.7 -6,-0.0 2,-0.4 -0.973 39.1 -94.1-147.5 162.4 -18.7 24.6 -0.9 37 37 A N - 0 0 156 -2,-0.3 -10,-0.1 -10,-0.1 -8,-0.0 -0.650 42.6-120.4 -79.6 131.3 -15.5 25.5 -2.6 38 38 A M - 0 0 28 -2,-0.4 2,-0.2 -12,-0.1 -1,-0.1 -0.581 28.0-117.5 -74.1 126.8 -12.6 23.3 -1.6 39 39 A P > - 0 0 35 0, 0.0 3,-0.6 0, 0.0 15,-0.5 -0.484 24.7-136.6 -67.1 130.9 -9.8 25.3 -0.1 40 40 A E T 3 S+ 0 0 118 1,-0.2 15,-0.2 -2,-0.2 3,-0.1 -0.728 81.3 2.8 -91.7 137.4 -6.5 25.1 -2.0 41 41 A G T 3 S+ 0 0 33 13,-3.5 2,-0.5 -2,-0.4 -1,-0.2 0.826 95.5 127.1 55.1 35.2 -3.2 24.6 -0.1 42 42 A K < - 0 0 128 -3,-0.6 12,-0.5 12,-0.3 2,-0.2 -0.992 61.8-127.8-115.4 127.9 -5.1 24.4 3.2 43 43 A V - 0 0 86 -2,-0.5 2,-0.4 10,-0.1 10,-0.2 -0.582 25.4-160.3 -73.9 140.1 -4.2 21.2 5.2 44 44 A M E -E 52 0C 10 8,-3.1 8,-2.8 -2,-0.2 2,-0.3 -0.995 8.9-139.9-133.6 123.4 -7.3 19.4 6.2 45 45 A E E -E 51 0C 105 -2,-0.4 -32,-2.3 6,-0.2 -31,-0.4 -0.677 20.2-141.0 -89.3 133.7 -7.3 16.9 9.0 46 46 A T B > -D 12 0B 2 4,-2.6 3,-1.3 -2,-0.3 -34,-0.3 -0.556 18.1-121.0 -96.2 158.5 -9.4 13.7 8.5 47 47 A R T 3 S+ 0 0 148 -36,-3.9 -35,-0.1 1,-0.2 -1,-0.1 0.774 112.7 58.1 -64.1 -29.1 -11.6 11.8 10.9 48 48 A D T 3 S- 0 0 130 -37,-0.5 -1,-0.2 2,-0.0 -36,-0.1 0.265 124.2 -98.1 -90.6 10.8 -9.5 8.7 10.3 49 49 A G S < S+ 0 0 59 -3,-1.3 -2,-0.1 1,-0.3 2,-0.1 0.270 87.0 100.0 105.4 -10.2 -6.3 10.4 11.5 50 50 A T - 0 0 13 -5,-0.0 -4,-2.6 12,-0.0 2,-0.3 -0.252 61.1-125.1 -99.6-176.4 -4.4 11.5 8.4 51 51 A K E -E 45 0C 88 -6,-0.2 11,-2.2 -2,-0.1 2,-0.3 -0.995 18.9-168.0-132.8 142.2 -4.2 14.9 6.6 52 52 A I E -EF 44 61C 2 -8,-2.8 -8,-3.1 -2,-0.3 2,-0.3 -0.851 4.0-170.1-122.4 158.6 -4.9 16.0 3.1 53 53 A I E - F 0 60C 49 7,-2.1 7,-3.3 -2,-0.3 2,-0.5 -0.970 14.6-142.5-142.5 140.6 -4.2 19.1 1.0 54 54 A M E + F 0 59C 17 -15,-0.5 -13,-3.5 -12,-0.5 2,-0.3 -0.943 24.4 167.1-102.6 132.0 -5.6 20.0 -2.4 55 55 A K E > - F 0 58C 115 3,-2.8 3,-0.5 -2,-0.5 -2,-0.0 -0.956 67.5 -7.3-145.3 129.2 -3.4 21.8 -5.0 56 56 A G T 3 S- 0 0 51 -2,-0.3 -1,-0.1 1,-0.2 3,-0.1 0.951 128.9 -53.1 53.2 56.3 -4.1 22.3 -8.7 57 57 A N T 3 S+ 0 0 103 1,-0.2 2,-0.4 -3,-0.0 -1,-0.2 0.748 118.4 110.4 49.3 32.0 -7.2 20.0 -8.6 58 58 A E E < -F 55 0C 125 -3,-0.5 -3,-2.8 -32,-0.0 2,-0.5 -0.983 62.6-135.2-132.5 145.9 -5.1 17.2 -7.0 59 59 A I E -F 54 0C 41 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.901 16.9-168.0-106.7 126.0 -5.3 15.8 -3.5 60 60 A F E -F 53 0C 101 -7,-3.3 -7,-2.1 -2,-0.5 2,-0.3 -0.812 7.0-164.6-105.6 144.3 -2.1 15.1 -1.7 61 61 A R E -F 52 0C 124 -2,-0.4 -9,-0.2 -9,-0.2 3,-0.1 -0.974 35.5 -79.4-133.8 151.7 -2.1 13.1 1.5 62 62 A L - 0 0 86 -11,-2.2 2,-0.6 -2,-0.3 3,-0.1 -0.159 54.4-112.2 -46.1 134.8 0.4 12.6 4.4 63 63 A D > - 0 0 103 1,-0.2 3,-1.2 2,-0.1 -1,-0.1 -0.651 24.7-164.3 -86.5 116.2 3.0 10.1 3.2 64 64 A E T 3 S+ 0 0 135 -2,-0.6 -1,-0.2 1,-0.3 -2,-0.1 0.782 84.8 75.6 -74.1 -25.8 2.7 6.9 5.2 65 65 A A T 3 0 0 91 -3,-0.1 -1,-0.3 1,-0.0 -2,-0.1 0.854 360.0 360.0 -47.0 -36.3 6.2 5.8 4.1 66 66 A L < 0 0 181 -3,-1.2 -2,-0.2 0, 0.0 -4,-0.0 0.705 360.0 360.0 -99.4 360.0 7.0 8.5 6.7