==== 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 PEPTIDE/ANTIBIOTIC 24-MAY-95 1GAC . COMPND 2 MOLECULE: CELL WALL PENTAPEPTIDE; . SOURCE 2 SYNTHETIC: YES; . AUTHOR A.D.KLINE,W.G.PROWSE,M.A.SKELTON,R.J.LONCHARICH . 24 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 2499.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 9 37.5 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 . 4 16.7 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 . 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 . 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+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 . 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 A 0 0 146 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 99.8 -9.8 6.2 1.6 2 2 A X 0 0 97 3,-0.0 3,-0.0 24,-0.0 19,-0.0 -0.654 360.0 360.0 87.0 360.0 -7.2 3.7 2.4 3 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 4 3 A K 0 0 138 0, 0.0 17,-2.8 0, 0.0 16,-0.7 0.000 360.0 360.0 360.0 141.0 -8.4 -1.3 -1.2 5 4 A X B A 19 0A 34 15,-0.2 14,-0.2 14,-0.2 -3,-0.0 -0.918 360.0 360.0 156.0 178.5 -5.4 -3.6 -1.3 6 5 A X 0 0 20 12,-1.9 12,-1.7 -2,-0.3 11,-0.0 -0.704 360.0 360.0-179.3 360.0 -3.5 -6.5 0.2 7 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 8 1 B A 0 0 129 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 57.1 7.8 -5.3 4.2 9 2 B X 0 0 88 3,-0.0 9,-0.0 17,-0.0 18,-0.0 0.097 360.0 360.0 69.7 360.0 6.5 -2.0 3.0 10 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 11 3 B K 0 0 152 0, 0.0 18,-2.6 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 103.8 9.1 1.4 -1.4 12 4 B X 0 0 34 16,-0.2 15,-0.2 17,-0.2 -3,-0.0 -0.948 360.0 360.0-177.3-169.7 5.9 3.4 -1.6 13 5 B X 0 0 20 13,-2.0 12,-1.1 -2,-0.3 14,-0.1 -0.410 360.0 360.0 167.4 360.0 3.9 6.0 0.1 14 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 15 1 C X 0 0 214 0, 0.0 -9,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-116.7 -2.8 -10.7 -0.8 16 2 C X + 0 0 138 2,-0.0 0, 0.0 0, 0.0 0, 0.0 0.748 360.0 65.1 100.8 29.5 0.9 -10.1 -0.3 17 3 C N S S- 0 0 97 1,-0.1 2,-0.3 10,-0.0 -12,-0.0 0.439 75.4-133.2-141.8 -73.5 1.2 -6.8 -2.2 18 4 C X + 0 0 44 -12,-1.7 -12,-1.9 8,-0.1 10,-0.3 -1.000 27.7 154.0 146.3-144.1 -0.4 -3.5 -1.2 19 5 C X B -AB 5 27A 93 8,-0.9 8,-1.1 -2,-0.3 -14,-0.2 -0.855 46.4-127.3 173.5-141.2 -2.3 -0.8 -2.9 20 6 C X 0 0 65 -16,-0.7 -15,-0.2 6,-0.3 -1,-0.2 0.390 360.0 360.0-101.6 129.0 -4.3 1.4 -2.5 21 7 C X 0 0 171 -17,-2.8 -16,-0.1 -3,-0.2 -2,-0.1 0.766 360.0 360.0 -79.3 360.0 -6.8 0.5 -5.1 22 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 23 1 D X 0 0 215 0, 0.0 -10,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-127.7 3.1 10.4 -0.6 24 2 D X + 0 0 134 2,-0.0 0, 0.0 -11,-0.0 0, 0.0 0.632 360.0 64.6 118.2 27.8 -0.6 9.7 -0.5 25 3 D N S S- 0 0 97 -12,-1.1 2,-0.3 1,-0.1 -13,-0.0 0.476 74.1-132.5-138.9 -74.5 -0.8 6.4 -2.5 26 4 D X + 0 0 44 -8,-0.1 -13,-2.0 -5,-0.0 -6,-0.3 -0.999 27.5 152.3 148.0-149.5 0.7 3.1 -1.5 27 5 D X B -B 19 0A 90 -8,-1.1 -8,-0.9 -2,-0.3 -15,-0.1 -0.841 45.4-128.8 174.6-141.1 2.8 0.3 -2.9 28 6 D X 0 0 63 -10,-0.3 -16,-0.2 -2,-0.2 -1,-0.2 0.398 360.0 360.0 -99.5 130.0 4.8 -1.9 -2.3 29 7 D X 0 0 176 -18,-2.6 -17,-0.2 -3,-0.2 -2,-0.1 0.879 360.0 360.0 -84.1 360.0 7.4 -1.1 -4.9