==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 22-JAN-00 1DVW . COMPND 2 MOLECULE: 18 RESIDUE PEPTIDE FROM MERP PROTEIN; . SOURCE 2 SYNTHETIC: YES; . AUTHOR G.VEGLIA,F.PORCELLI,T.M.DE SILVA,A.M.PRANTNER,S.J.OPELLA . 18 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 1790.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 3 16.7 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 . 1 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 1 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 1 5.6 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 . 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 T 0 0 153 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 98.7 9.3 3.3 6.8 2 2 A L + 0 0 169 2,-0.0 0, 0.0 0, 0.0 0, 0.0 -0.178 360.0 15.2 50.6-141.9 6.2 4.8 5.2 3 3 A A S S- 0 0 69 3,-0.0 0, 0.0 1,-0.0 0, 0.0 -0.181 79.8-167.5 -56.7 152.9 5.3 3.1 1.9 4 4 A V - 0 0 65 0, 0.0 2,-1.9 0, 0.0 -1,-0.0 -0.926 36.7 -82.1-140.8 166.3 7.2 -0.2 1.3 5 5 A P S S+ 0 0 140 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 -0.476 119.9 22.7 -70.3 85.3 7.9 -2.7 -1.5 6 6 A G S S+ 0 0 56 -2,-1.9 -3,-0.0 3,-0.0 10,-0.0 -0.284 75.9 177.3 154.9 -60.3 4.6 -4.6 -1.3 7 7 A M + 0 0 56 1,-0.1 3,-0.0 2,-0.1 -4,-0.0 -0.104 41.6 103.6 56.6-161.9 1.8 -2.5 0.4 8 8 A T + 0 0 85 4,-0.3 -1,-0.1 1,-0.1 0, 0.0 0.986 43.6 133.6 54.1 69.8 -1.6 -4.1 0.5 9 9 A C S S- 0 0 73 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.323 89.7 -79.1-146.6 60.8 -1.6 -5.0 4.2 10 10 A A S S+ 0 0 112 1,-0.2 -3,-0.0 -3,-0.0 -2,-0.0 0.876 133.0 67.1 46.3 28.5 -4.8 -4.0 6.0 11 11 A A S S+ 0 0 68 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.437 116.3 0.1-141.8 -55.8 -3.0 -0.7 5.9 12 12 A C S >> S+ 0 0 24 2,-0.1 4,-1.7 1,-0.1 3,-0.8 0.106 80.0 118.3-137.3 32.6 -2.6 0.5 2.3 13 13 A P T 34 S+ 0 0 50 0, 0.0 -1,-0.1 0, 0.0 -6,-0.0 0.711 86.6 55.3 -67.5 -13.8 -4.2 -2.0 -0.0 14 14 A I T 34 S+ 0 0 127 2,-0.1 3,-0.2 3,-0.1 -2,-0.1 0.703 104.5 52.2 -89.2 -20.9 -6.4 1.1 -0.7 15 15 A T T <4 S+ 0 0 100 -3,-0.8 3,-0.4 1,-0.2 -3,-0.1 0.975 128.1 18.9 -77.0 -67.1 -3.3 3.2 -1.7 16 16 A V S < S+ 0 0 52 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.1 -0.036 86.7 134.8 -90.9 33.2 -1.8 0.8 -4.2 17 17 A K 0 0 148 1,-0.3 -1,-0.2 -3,-0.2 -3,-0.1 0.710 360.0 360.0 -56.6 -15.0 -5.2 -0.9 -4.5 18 18 A K 0 0 243 -3,-0.4 -1,-0.3 -4,-0.1 -2,-0.1 0.905 360.0 360.0 -41.9 360.0 -4.6 -0.7 -8.2