==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 18-SEP-09 2WTP . COMPND 2 MOLECULE: ORF131 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: RALSTONIA METALLIDURANS CH34; . AUTHOR I.HAERTLEIN,E.GIRARD,G.SARRET,J.HAZEMANN,P.GOURHANT,R.KAHN,J . 182 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10802.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 129 70.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 12.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 34 18.7 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 . 2 1.1 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-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 . 19 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 22 12.1 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 2 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 2 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 PARALLEL BRIDGES PER LADDER . 0 0 0 4 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 ANTIPARALLEL BRIDGES PER LADDER . 0 2 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 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 13 A S > 0 0 137 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -33.6 13.6 18.6 9.4 2 14 A T H > + 0 0 106 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.847 360.0 51.5 -63.9 -35.3 16.8 18.9 11.5 3 15 A A H > S+ 0 0 71 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.952 110.4 47.6 -67.1 -47.2 16.5 22.7 11.4 4 16 A T H > S+ 0 0 100 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.874 111.1 50.7 -61.8 -37.6 12.9 22.6 12.7 5 17 A A H X S+ 0 0 61 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.904 106.5 55.4 -68.5 -36.6 13.7 20.1 15.4 6 18 A Q H X S+ 0 0 131 -4,-1.8 4,-1.5 1,-0.2 -1,-0.2 0.850 107.9 50.8 -61.3 -35.0 16.6 22.3 16.6 7 19 A A H X S+ 0 0 54 -4,-1.5 4,-2.0 1,-0.2 -2,-0.2 0.908 110.6 46.0 -75.2 -38.2 14.1 25.2 16.9 8 20 A M H X S+ 0 0 112 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.781 109.2 56.1 -72.4 -32.7 11.6 23.3 19.0 9 21 A A H X S+ 0 0 23 -4,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.871 106.9 50.6 -62.7 -39.2 14.4 22.0 21.2 10 22 A K H X S+ 0 0 145 -4,-1.5 4,-1.8 2,-0.2 -2,-0.2 0.905 109.8 50.1 -70.2 -37.1 15.4 25.6 21.9 11 23 A R H X S+ 0 0 170 -4,-2.0 4,-0.9 2,-0.2 -2,-0.2 0.949 111.8 48.1 -61.1 -45.6 11.8 26.4 22.8 12 24 A H H >< S+ 0 0 72 -4,-2.3 3,-1.2 1,-0.2 4,-0.3 0.940 110.2 51.5 -59.4 -47.5 11.7 23.5 25.2 13 25 A A H >< S+ 0 0 4 -4,-2.6 3,-2.2 59,-0.3 -1,-0.2 0.846 99.1 64.6 -58.7 -36.3 14.9 24.5 26.7 14 26 A T H >< S+ 0 0 75 -4,-1.8 3,-1.0 1,-0.3 -1,-0.3 0.749 91.8 65.4 -61.3 -23.0 13.7 28.1 27.3 15 27 A L T << S+ 0 0 122 -3,-1.2 -1,-0.3 -4,-0.9 -2,-0.2 0.637 104.5 46.6 -69.7 -10.6 11.0 26.6 29.7 16 28 A Y T < S- 0 0 38 -3,-2.2 44,-1.8 -4,-0.3 2,-0.3 0.271 122.6 -72.9-114.7 3.4 13.9 25.6 32.0 17 29 A G E < -A 59 0A 2 -3,-1.0 -1,-0.3 42,-0.3 42,-0.2 -0.942 52.8 -68.4 139.7-157.8 16.1 28.7 32.1 18 30 A D E -A 58 0A 97 40,-2.3 40,-2.9 -2,-0.3 -4,-0.0 -0.984 43.3 -93.6-139.3 144.8 18.4 30.8 30.1 19 31 A P E -A 57 0A 106 0, 0.0 2,-0.3 0, 0.0 38,-0.3 -0.225 48.3-170.0 -54.5 143.8 21.9 30.7 28.7 20 32 A A E -A 56 0A 28 36,-1.9 36,-0.8 26,-0.1 2,-0.3 -0.904 23.0-104.5-133.7 165.5 24.5 32.2 31.0 21 33 A G > - 0 0 42 -2,-0.3 3,-2.0 1,-0.1 4,-0.3 -0.731 25.5-126.4 -90.4 143.5 28.2 33.2 31.0 22 34 A Q G > S+ 0 0 102 -2,-0.3 3,-1.7 1,-0.3 -1,-0.1 0.802 106.3 69.9 -53.2 -27.9 30.8 31.0 32.7 23 35 A S G 3 S+ 0 0 111 1,-0.3 -1,-0.3 33,-0.0 24,-0.0 0.641 101.2 45.8 -69.6 -11.1 31.9 34.0 34.7 24 36 A Q G < S+ 0 0 147 -3,-2.0 -1,-0.3 22,-0.0 2,-0.2 0.396 87.7 112.3-104.9 -0.8 28.6 33.9 36.7 25 37 A A < - 0 0 25 -3,-1.7 21,-0.2 -4,-0.3 3,-0.1 -0.541 56.2-152.8 -78.6 147.0 28.6 30.2 37.4 26 38 A S S S+ 0 0 54 19,-2.5 2,-0.3 -2,-0.2 20,-0.2 0.574 78.8 5.1 -94.3 -10.4 29.1 29.0 40.9 27 39 A R - 0 0 18 18,-0.5 20,-2.6 100,-0.1 2,-0.5 -0.965 64.3-129.3-159.8 163.7 30.6 25.6 39.8 28 40 A I E -b 47 0A 54 -2,-0.3 2,-0.6 98,-0.2 20,-0.2 -0.984 21.1-156.0-119.7 124.6 31.7 23.7 36.7 29 41 A I E -b 48 0A 19 18,-3.4 20,-2.9 -2,-0.5 2,-0.4 -0.896 14.5-134.3-102.2 124.4 30.3 20.2 36.3 30 42 A D E -b 49 0A 46 -2,-0.6 2,-0.8 18,-0.2 20,-0.2 -0.641 11.9-144.5 -75.3 127.9 32.4 17.8 34.1 31 43 A V + 0 0 10 18,-3.2 20,-0.2 -2,-0.4 49,-0.1 -0.856 29.3 176.5 -97.3 101.2 30.2 15.9 31.6 32 44 A K > - 0 0 116 -2,-0.8 3,-1.9 18,-0.1 18,-0.0 -0.846 39.9 -86.7-107.6 150.8 31.8 12.5 31.3 33 45 A P T 3 S+ 0 0 132 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.326 115.0 28.3 -53.0 133.1 30.6 9.5 29.4 34 46 A G T 3 S+ 0 0 73 1,-0.4 -3,-0.0 2,-0.0 48,-0.0 0.069 82.1 141.5 103.6 -22.4 28.2 7.4 31.4 35 47 A M < + 0 0 50 -3,-1.9 -1,-0.4 1,-0.1 3,-0.1 -0.279 24.6 179.6 -57.8 137.9 26.9 10.3 33.5 36 48 A R - 0 0 199 1,-0.4 48,-2.7 47,-0.1 2,-0.3 0.786 53.3 -7.2-113.1 -42.0 23.2 10.0 34.2 37 49 A Y E -d 84 0B 50 46,-0.2 -1,-0.4 32,-0.0 2,-0.3 -0.991 43.7-164.1-152.9 163.2 22.1 12.9 36.3 38 50 A V E -d 85 0B 10 46,-1.6 48,-3.0 -2,-0.3 2,-0.5 -0.940 23.7-127.5-135.2 156.8 23.1 16.0 38.3 39 51 A N E +d 86 0B 17 91,-0.3 2,-0.3 -2,-0.3 91,-0.3 -0.945 29.6 172.5-106.2 130.2 21.1 18.0 40.8 40 52 A V E -d 87 0B 1 46,-2.8 48,-2.8 -2,-0.5 2,-0.3 -0.898 27.3-118.9-129.3 159.0 20.7 21.8 40.5 41 53 A D E > -d 88 0B 61 -2,-0.3 3,-2.2 46,-0.2 18,-0.3 -0.701 38.4 -92.9 -89.6 151.7 18.7 24.4 42.3 42 54 A S T 3 S+ 0 0 17 46,-0.8 19,-0.2 -2,-0.3 18,-0.2 -0.398 117.1 17.5 -51.9 135.0 16.1 26.6 40.8 43 55 A G T 3 S+ 0 0 28 16,-0.9 -1,-0.2 17,-0.8 2,-0.1 0.405 92.0 139.6 81.6 -9.6 18.0 29.8 39.9 44 56 A E < - 0 0 15 -3,-2.2 15,-2.7 16,-0.2 2,-0.6 -0.492 46.3-143.4 -71.2 143.8 21.5 28.2 40.1 45 57 A T E + C 0 58A 24 13,-0.2 -19,-2.5 -21,-0.2 -18,-0.5 -0.945 29.0 174.9-108.6 118.7 24.0 29.2 37.4 46 58 A V E - C 0 57A 0 11,-2.6 11,-2.3 -2,-0.6 2,-0.4 -0.966 22.8-145.2-128.2 137.1 26.1 26.2 36.5 47 59 A A E -bC 28 56A 0 -20,-2.6 -18,-3.4 -2,-0.4 2,-0.5 -0.809 12.4-153.1-103.6 141.2 28.7 25.7 33.9 48 60 A F E -bC 29 55A 1 7,-2.6 7,-2.6 -2,-0.4 2,-0.4 -0.980 9.7-156.8-116.6 134.8 29.1 22.4 32.1 49 61 A R E +bC 30 54A 53 -20,-2.9 -18,-3.2 -2,-0.5 2,-0.4 -0.926 19.9 176.8-117.0 132.4 32.4 21.2 30.7 50 62 A A E > S- C 0 53A 18 3,-2.8 3,-2.4 -2,-0.4 2,-0.3 -0.970 79.5 -46.8-127.5 112.3 33.2 18.7 28.0 51 63 A G T 3 S- 0 0 53 -2,-0.4 -20,-0.1 1,-0.3 -19,-0.0 -0.464 122.6 -29.1 60.3-115.8 37.0 18.8 27.5 52 64 A E T 3 S+ 0 0 158 -2,-0.3 2,-0.5 -3,-0.1 -1,-0.3 0.398 114.6 106.4-111.9 8.7 37.8 22.5 27.4 53 65 A K E < - C 0 50A 94 -3,-2.4 -3,-2.8 25,-0.1 2,-0.4 -0.731 51.3-172.6 -85.8 126.9 34.4 23.5 25.9 54 66 A I E + C 0 49A 35 -2,-0.5 2,-0.4 -5,-0.2 -5,-0.2 -0.984 10.8 178.0-123.2 129.9 32.3 25.2 28.7 55 67 A V E - 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