==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METALLOTHIONEIN 31-JUL-97 1AQQ . COMPND 2 MOLECULE: AG-METALLOTHIONEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR C.W.PETERSON,S.S.NARULA,I.M.ARMITAGE . 40 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 3211.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 11 27.5 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 . 0 0.0 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 . 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 . 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 . 4 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 3 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 1 2.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 2.5 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 Q 0 0 200 0, 0.0 2,-0.9 0, 0.0 25,-0.1 0.000 360.0 360.0 360.0 47.0 -2.6 9.6 -5.5 2 2 A N + 0 0 143 23,-0.4 22,-0.0 1,-0.1 21,-0.0 -0.736 360.0 155.7 -88.8 108.3 -0.3 10.7 -2.7 3 3 A E + 0 0 68 -2,-0.9 2,-1.2 20,-0.1 21,-0.1 -0.061 29.0 121.6-122.8 35.7 2.3 8.0 -2.0 4 4 A G + 0 0 90 19,-0.1 2,-0.2 21,-0.1 -1,-0.1 -0.304 63.5 83.8 -89.5 50.5 5.1 10.1 -0.5 5 5 A H S S- 0 0 40 -2,-1.2 2,-0.6 19,-0.2 19,-0.1 -0.810 92.9 -82.3-138.4-176.8 4.9 7.9 2.6 6 6 A E - 0 0 129 -2,-0.2 16,-0.1 1,-0.1 -2,-0.1 -0.807 60.5 -99.5 -91.6 126.5 6.1 4.7 4.0 7 7 A C + 0 0 28 14,-0.7 14,-0.1 -2,-0.6 -1,-0.1 -0.215 49.9 176.3 -46.6 112.8 3.9 1.9 2.7 8 8 A Q + 0 0 101 18,-0.3 -1,-0.2 2,-0.0 2,-0.1 -0.058 20.2 143.3-115.2 35.2 1.6 1.5 5.7 9 9 A C - 0 0 12 1,-0.1 22,-0.2 19,-0.1 6,-0.1 -0.478 50.0-140.0 -73.2 143.6 -0.9 -1.1 4.4 10 10 A Q S S+ 0 0 161 20,-1.5 -1,-0.1 -2,-0.1 21,-0.1 0.170 73.8 99.8 -89.5 21.7 -2.0 -3.6 7.0 11 11 A C S S- 0 0 19 19,-0.2 4,-0.4 21,-0.1 22,-0.0 -0.128 82.6-118.8 -90.5-166.3 -1.8 -6.4 4.3 12 12 A G S >>S+ 0 0 45 2,-0.1 4,-1.3 3,-0.1 5,-0.9 0.576 107.2 64.8-109.7 -17.8 1.0 -8.9 3.7 13 13 A S T 45S+ 0 0 63 3,-0.2 7,-0.3 2,-0.2 6,-0.2 0.848 113.2 33.1 -74.8 -31.8 1.8 -7.7 0.2 14 14 A C T 45S+ 0 0 4 2,-0.1 -2,-0.1 1,-0.1 -1,-0.1 0.884 112.6 60.1 -89.1 -44.8 3.0 -4.3 1.6 15 15 A K T 45S+ 0 0 155 -4,-0.4 -2,-0.2 -6,-0.1 -3,-0.1 0.886 131.8 4.0 -50.2 -41.2 4.4 -5.6 4.9 16 16 A N T <5S+ 0 0 119 -4,-1.3 2,-0.4 1,-0.1 -3,-0.2 0.772 110.5 80.2-112.1 -65.1 6.8 -7.8 3.0 17 17 A N > < - 0 0 83 -5,-0.9 3,-1.0 1,-0.2 4,-0.5 -0.234 55.3-171.8 -49.3 103.4 6.7 -7.4 -0.8 18 18 A E T 3 S+ 0 0 127 -2,-0.4 -1,-0.2 1,-0.2 -4,-0.1 0.385 70.0 86.4 -81.8 8.0 8.8 -4.2 -1.2 19 19 A Q T 3 S+ 0 0 130 -6,-0.2 -1,-0.2 1,-0.2 -2,-0.1 0.704 102.4 28.1 -80.0 -17.1 7.7 -4.1 -4.8 20 20 A C S < S+ 0 0 7 -3,-1.0 4,-0.3 -7,-0.3 20,-0.2 0.444 104.4 77.0-119.3 -6.2 4.6 -2.2 -3.9 21 21 A Q S S+ 0 0 78 -4,-0.5 -14,-0.7 -8,-0.2 -2,-0.1 0.190 80.7 81.5 -88.8 17.8 5.9 -0.5 -0.7 22 22 A K S S- 0 0 120 18,-0.1 -17,-0.2 -16,-0.1 -1,-0.1 0.945 113.6 -14.0 -86.5 -69.0 7.7 2.0 -2.9 23 23 A S S S+ 0 0 59 -19,-0.1 2,-0.4 -17,-0.1 -2,-0.1 -0.228 79.2 151.5-134.9 50.3 5.3 4.7 -4.1 24 24 A C - 0 0 1 16,-0.4 -19,-0.2 -4,-0.3 14,-0.1 -0.649 41.2-143.4 -82.4 130.5 1.8 3.5 -3.4 25 25 A S + 0 0 27 -2,-0.4 -23,-0.4 -22,-0.1 -1,-0.1 0.300 46.1 149.7 -80.1 18.0 -0.6 6.4 -2.8 26 26 A C - 0 0 14 1,-0.1 2,-1.2 -25,-0.1 -18,-0.3 -0.309 55.4-124.1 -52.3 114.3 -2.4 4.3 -0.1 27 27 A P > - 0 0 106 0, 0.0 3,-0.5 0, 0.0 2,-0.3 -0.502 39.8-100.7 -66.1 97.2 -3.7 7.0 2.2 28 28 A T T 3 S+ 0 0 91 -2,-1.2 -19,-0.1 1,-0.3 -2,-0.1 0.226 117.4 74.3 -26.6 71.7 -2.0 5.6 5.4 29 29 A G T 3 + 0 0 44 -2,-0.3 -1,-0.3 0, 0.0 2,-0.2 0.183 55.6 132.0-162.6 -17.1 -5.3 4.2 6.4 30 30 A C < + 0 0 16 -3,-0.5 -20,-1.5 1,-0.2 -19,-0.2 -0.289 16.3 148.3 -52.9 113.0 -5.5 1.2 3.9 31 31 A N + 0 0 107 -2,-0.2 2,-0.3 -22,-0.2 -1,-0.2 -0.022 42.3 82.8-138.3 31.6 -6.5 -1.7 6.2 32 32 A S - 0 0 38 3,-0.2 3,-0.5 1,-0.1 -21,-0.1 -0.956 65.5-139.5-135.9 155.7 -8.6 -3.9 3.9 33 33 A D S > S+ 0 0 124 -2,-0.3 3,-0.8 1,-0.2 -1,-0.1 0.893 106.2 45.4 -82.5 -40.0 -7.9 -6.6 1.3 34 34 A D T 3 S+ 0 0 160 1,-0.3 -1,-0.2 3,-0.1 0, 0.0 0.112 108.2 61.1 -91.5 28.4 -10.5 -5.5 -1.3 35 35 A K T 3 S+ 0 0 151 -3,-0.5 -1,-0.3 1,-0.1 -3,-0.2 -0.087 84.8 84.0-137.9 29.5 -9.5 -1.9 -0.8 36 36 A C < + 0 0 32 -3,-0.8 2,-0.3 -5,-0.1 -1,-0.1 -0.536 36.0 155.7-136.1 70.6 -5.9 -2.4 -2.0 37 37 A P + 0 0 132 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.116 35.7 143.2 -86.3 38.2 -5.9 -2.2 -5.7 38 38 A C + 0 0 35 -2,-0.3 -14,-0.1 1,-0.1 -2,-0.1 -0.604 22.4 158.3 -85.0 140.3 -2.2 -1.3 -5.3 39 39 A G 0 0 63 -2,-0.3 -1,-0.1 -19,-0.1 -15,-0.0 0.176 360.0 360.0-140.0 8.2 0.4 -2.4 -7.7 40 40 A N 0 0 89 -20,-0.2 -16,-0.4 -18,-0.0 -18,-0.1 -0.590 360.0 360.0-151.1 360.0 3.1 0.2 -7.0