==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ANTIMICROBIAL PROTEIN 07-SEP-10 2L36 . COMPND 2 MOLECULE: MSI594; . SOURCE 2 SYNTHETIC: YES; . AUTHOR A.BHUNIA,S.BHATTACHARJYA . 24 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 2473.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 22 91.7 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 45.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 11 45.8 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 1 0 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 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 G > 0 0 81 0, 0.0 3,-2.1 0, 0.0 4,-0.5 0.000 360.0 360.0 360.0 72.5 2.1 0.0 -1.2 2 2 A I T >> + 0 0 137 1,-0.3 4,-2.8 2,-0.2 3,-1.0 0.767 360.0 79.3 -59.8 -25.3 5.7 0.2 -0.2 3 3 A G H 3> S+ 0 0 40 1,-0.3 4,-1.0 2,-0.2 -1,-0.3 0.696 88.3 57.8 -56.8 -17.7 6.6 -0.0 -3.9 4 4 A K H <> S+ 0 0 152 -3,-2.1 4,-1.0 2,-0.2 -1,-0.3 0.841 111.2 38.6 -81.3 -36.0 5.7 3.7 -4.0 5 5 A A H <> S+ 0 0 39 -3,-1.0 4,-2.2 -4,-0.5 -2,-0.2 0.870 116.4 50.4 -81.1 -40.3 8.2 4.7 -1.4 6 6 A L H X S+ 0 0 118 -4,-2.8 4,-0.6 2,-0.2 -3,-0.2 0.860 108.7 53.4 -65.9 -36.1 11.0 2.3 -2.6 7 7 A K H < S+ 0 0 156 -4,-1.0 3,-0.4 -5,-0.3 -1,-0.2 0.889 115.4 39.0 -66.1 -40.2 10.6 3.5 -6.2 8 8 A K H >X S+ 0 0 146 -4,-1.0 3,-1.9 1,-0.2 4,-0.6 0.770 102.1 72.0 -80.3 -27.7 11.0 7.2 -5.1 9 9 A A H >< S+ 0 0 44 -4,-2.2 3,-0.6 1,-0.3 4,-0.2 0.719 75.9 84.3 -59.9 -20.3 13.7 6.2 -2.6 10 10 A K G >< S+ 0 0 163 -4,-0.6 3,-0.7 -3,-0.4 -1,-0.3 0.826 89.9 49.8 -51.9 -33.3 15.9 5.6 -5.6 11 11 A K G X4 S+ 0 0 174 -3,-1.9 3,-0.5 1,-0.2 -1,-0.3 0.826 109.5 49.9 -75.9 -33.0 16.7 9.3 -5.6 12 12 A G G XX S+ 0 0 14 -3,-0.6 3,-2.1 -4,-0.6 4,-0.6 0.211 75.5 113.5 -90.5 16.0 17.5 9.3 -1.9 13 13 A I G X4 + 0 0 106 -3,-0.7 3,-2.2 1,-0.3 4,-0.4 0.885 67.6 64.4 -52.8 -42.2 19.9 6.3 -2.4 14 14 A G G X> S+ 0 0 45 -3,-0.5 4,-1.0 1,-0.3 3,-0.6 0.724 97.3 58.0 -55.5 -20.8 22.8 8.6 -1.5 15 15 A A H <> S+ 0 0 46 -3,-2.1 4,-1.8 1,-0.2 5,-0.5 0.694 88.2 72.9 -82.3 -20.6 21.2 8.9 1.9 16 16 A V H << S+ 0 0 90 -3,-2.2 -1,-0.2 -4,-0.6 -2,-0.2 0.629 111.6 29.9 -68.1 -12.4 21.3 5.1 2.4 17 17 A L H <> S+ 0 0 121 -3,-0.6 4,-0.7 -4,-0.4 -1,-0.2 0.596 111.1 65.2-117.2 -24.6 25.1 5.5 2.9 18 18 A K H < S+ 0 0 165 -4,-1.0 4,-0.2 1,-0.2 3,-0.2 0.923 117.4 26.7 -66.0 -45.7 25.2 9.0 4.4 19 19 A V T >< S+ 0 0 90 -4,-1.8 3,-2.1 1,-0.2 4,-0.5 0.782 107.8 74.2 -86.9 -31.0 23.4 8.0 7.6 20 20 A L G >> S+ 0 0 87 -5,-0.5 4,-1.3 1,-0.3 3,-0.8 0.746 89.6 63.8 -53.8 -22.9 24.5 4.4 7.4 21 21 A T G 3< S+ 0 0 85 -4,-0.7 -1,-0.3 1,-0.2 -2,-0.2 0.805 84.5 72.5 -72.1 -29.9 27.8 5.7 8.6 22 22 A T G <4 S+ 0 0 130 -3,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.758 117.5 20.8 -56.4 -24.5 26.3 6.9 11.9 23 23 A G T <4 0 0 78 -3,-0.8 -1,-0.2 -4,-0.5 -2,-0.2 0.508 360.0 360.0-120.0 -12.7 26.2 3.2 12.8 24 24 A L < 0 0 166 -4,-1.3 -3,-0.2 -5,-0.2 -4,-0.0 0.564 360.0 360.0-100.3 360.0 28.8 1.7 10.5