==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ANTIMICROBIAL PROTEIN, ANTIBIOTIC 23-MAY-05 1ZRW . COMPND 2 MOLECULE: SPINIGERIN; . SOURCE 2 SYNTHETIC: YES; . AUTHOR C.LANDON,H.MEUDAL,N.BOULANGER,P.BULET,F.VOVELLE . 25 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 2965.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 16 64.0 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 . 2 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 2 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 12 48.0 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 1 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 H 0 0 199 0, 0.0 2,-1.9 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 46.6 19.0 1.8 -0.2 2 2 A V + 0 0 113 1,-0.2 3,-0.1 3,-0.0 4,-0.0 -0.536 360.0 164.7 -79.1 77.4 17.0 -1.3 -1.0 3 3 A D - 0 0 98 -2,-1.9 2,-0.2 1,-0.2 -1,-0.2 0.991 59.2 -64.4 -55.4 -69.7 16.3 -2.5 2.5 4 4 A K S S+ 0 0 153 -3,-0.2 -1,-0.2 0, 0.0 3,-0.1 -0.850 114.8 24.6 178.5 146.2 13.5 -4.9 1.7 5 5 A K S > S+ 0 0 152 -2,-0.2 2,-2.9 1,-0.2 4,-0.8 0.853 70.1 171.9 56.2 33.0 10.0 -4.7 0.4 6 6 A V T 4 + 0 0 82 1,-0.2 -1,-0.2 2,-0.1 -4,-0.0 -0.259 69.0 39.3 -72.2 54.7 11.1 -1.5 -1.2 7 7 A A T >> S+ 0 0 44 -2,-2.9 4,-1.9 -3,-0.1 3,-1.4 0.233 88.6 80.5-165.0 -43.6 7.8 -1.2 -3.1 8 8 A D H 3> S+ 0 0 77 -3,-0.5 4,-3.2 1,-0.3 5,-0.4 0.884 90.7 60.6 -44.5 -46.9 4.9 -2.3 -0.9 9 9 A K H 3X S+ 0 0 147 -4,-0.8 4,-2.3 1,-0.3 -1,-0.3 0.889 106.0 47.3 -49.7 -42.1 5.0 1.1 0.7 10 10 A V H <> S+ 0 0 86 -3,-1.4 4,-3.3 2,-0.2 5,-0.4 0.912 110.8 51.8 -66.8 -42.5 4.3 2.5 -2.7 11 11 A L H X S+ 0 0 74 -4,-1.9 4,-3.3 2,-0.2 5,-0.4 0.946 113.3 42.8 -60.0 -50.5 1.5 0.0 -3.3 12 12 A L H X S+ 0 0 92 -4,-3.2 4,-1.1 3,-0.2 -1,-0.2 0.882 116.3 49.7 -64.7 -37.1 -0.3 0.8 -0.1 13 13 A L H < S+ 0 0 106 -4,-2.3 4,-0.2 -5,-0.4 -2,-0.2 0.926 122.9 30.7 -66.8 -45.8 0.3 4.5 -0.6 14 14 A K H >< S+ 0 0 169 -4,-3.3 3,-0.6 1,-0.2 4,-0.3 0.949 125.9 42.4 -77.2 -53.5 -1.1 4.5 -4.2 15 15 A Q H 3X S+ 0 0 75 -4,-3.3 4,-2.8 -5,-0.4 3,-0.3 0.698 81.6 118.1 -66.0 -20.3 -3.6 1.6 -3.8 16 16 A L H 3X S+ 0 0 110 -4,-1.1 4,-2.9 -5,-0.4 5,-0.2 0.657 80.6 38.7 -11.7 -65.5 -4.6 3.2 -0.4 17 17 A R H <> S+ 0 0 182 -3,-0.6 4,-3.1 -4,-0.2 5,-0.3 0.985 118.0 47.3 -58.0 -60.5 -8.1 3.7 -1.7 18 18 A I H > S+ 0 0 113 -4,-0.3 4,-3.0 -3,-0.3 -2,-0.2 0.854 113.4 53.5 -47.9 -38.2 -8.3 0.5 -3.6 19 19 A M H X S+ 0 0 81 -4,-2.8 4,-3.3 2,-0.2 -1,-0.2 0.966 109.9 42.3 -64.3 -56.6 -6.9 -1.1 -0.4 20 20 A R H < S+ 0 0 147 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.893 117.7 49.2 -60.5 -37.5 -9.5 0.2 2.1 21 21 A L H < S+ 0 0 104 -4,-3.1 -2,-0.2 -5,-0.2 -1,-0.2 0.953 117.7 39.6 -65.1 -48.9 -12.2 -0.5 -0.5 22 22 A L H < S+ 0 0 139 -4,-3.0 -2,-0.2 -5,-0.3 -3,-0.2 0.992 134.1 17.0 -62.7 -62.7 -10.9 -4.1 -1.0 23 23 A T S < S- 0 0 43 -4,-3.3 -3,-0.1 -5,-0.2 -4,-0.0 0.549 82.2-130.4 -79.1-128.0 -10.1 -4.8 2.6 24 24 A R 0 0 165 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.282 360.0 360.0-158.2 -46.5 -11.5 -2.6 5.4 25 25 A L 0 0 214 -6,-0.1 -5,-0.1 -4,-0.0 -4,-0.0 0.356 360.0 360.0-159.4 360.0 -8.6 -1.5 7.7