==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ANTIBIOTIC 21-OCT-04 1XT7 . COMPND 2 MOLECULE: DAPTOMYCIN; . SOURCE 2 SYNTHETIC: YES; . AUTHOR L.-J.BALL,C.M.GOULT,J.A.DONARSKI,J.MICKLEFIELD,V.RAMESH . 13 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 1444.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 4 30.8 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 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 2 15.4 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 . 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 2 A W 0 0 249 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 144.1 -0.7 -10.4 4.2 2 3 A X + 0 0 67 11,-0.2 11,-0.1 1,-0.1 0, 0.0 0.957 360.0 164.9 50.2 65.3 -2.4 -11.8 1.1 3 4 A D S S+ 0 0 163 10,-0.2 2,-0.1 2,-0.0 10,-0.1 0.944 71.9 58.6 -72.4 -38.8 0.5 -13.7 -0.6 4 5 A T S S- 0 0 61 8,-0.2 2,-1.3 9,-0.1 3,-0.2 -0.484 126.1 -27.6 -68.6 154.4 -2.2 -15.4 -2.6 5 6 A G - 0 0 44 6,-0.7 7,-0.1 1,-0.2 3,-0.1 -0.206 58.3-137.5 57.3 -88.3 -4.5 -13.2 -4.7 6 7 A X S S+ 0 0 138 -2,-1.3 2,-0.3 1,-0.2 -1,-0.2 0.843 77.1 91.2 78.0 44.6 -4.8 -9.7 -3.1 7 8 A D S > S- 0 0 102 -3,-0.2 3,-1.0 3,-0.2 6,-0.2 -0.891 83.5-121.7-166.5 133.4 -8.6 -9.7 -3.8 8 9 A X T 3 S+ 0 0 54 1,-0.3 2,-0.2 -2,-0.3 -1,-0.1 0.840 111.2 13.2 -50.2 -41.5 -11.6 -10.9 -1.7 9 10 A D T 3 S+ 0 0 143 -3,-0.1 -1,-0.3 1,-0.1 2,-0.2 -0.582 108.6 89.3-134.5 72.7 -12.7 -13.4 -4.3 10 11 A G S X S- 0 0 30 -3,-1.0 3,-0.5 -2,-0.2 -3,-0.2 -0.641 92.6 -2.7-168.7 108.9 -9.8 -13.8 -6.9 11 12 A X T 3 S- 0 0 93 1,-0.2 -6,-0.7 -2,-0.2 -5,-0.0 0.796 108.5 -80.5 79.1 30.3 -6.8 -16.2 -6.9 12 13 A X T 3 0 0 151 1,-0.2 -1,-0.2 -8,-0.1 -8,-0.2 0.506 360.0 360.0 50.2 20.9 -7.6 -17.9 -3.5 13 14 A X < 0 0 149 -3,-0.5 -1,-0.2 -6,-0.2 -11,-0.2 0.771 360.0 360.0 35.0 360.0 -6.0 -15.1 -1.4