==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TOXIN 27-AUG-07 2JUI . COMPND 2 MOLECULE: PLNE; . SOURCE 2 ORGANISM_SCIENTIFIC: LACTOBACILLUS PLANTARUM; . AUTHOR N.FIMLAND,P.ROGNE,G.FIMLAND,J.NISSEN-MEYER,P.KRISTIANSEN . 33 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 3326.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 21 63.6 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 . 7 21.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 13 39.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 3.0 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 0 0 0 0 0 1 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 F 0 0 211 0, 0.0 4,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-172.7 2.1 0.0 -1.2 2 2 A N + 0 0 141 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.381 360.0 35.3-141.6 -68.0 5.2 -1.9 -2.3 3 3 A R S S- 0 0 120 1,-0.1 3,-0.3 2,-0.0 7,-0.0 0.819 91.4-140.4 -65.8 -32.0 7.3 -0.1 -4.9 4 4 A G - 0 0 44 1,-0.2 -1,-0.1 2,-0.1 0, 0.0 -0.144 37.5 -97.9 97.1 -36.5 6.4 3.2 -3.2 5 5 A G S S+ 0 0 47 -4,-0.0 -1,-0.2 0, 0.0 -2,-0.0 -0.003 112.0 91.5 110.9 -25.6 6.1 5.0 -6.5 6 6 A Y + 0 0 190 -3,-0.3 -2,-0.1 2,-0.0 -3,-0.0 0.295 63.1 121.4 -82.5 9.6 9.6 6.5 -6.4 7 7 A N - 0 0 22 1,-0.1 -3,-0.0 2,-0.0 -4,-0.0 0.127 46.0-167.1 -60.2-175.9 10.8 3.5 -8.3 8 8 A F S S+ 0 0 164 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.072 75.1 40.5-169.3 34.4 12.5 3.7 -11.6 9 9 A G S > S+ 0 0 30 0, 0.0 4,-1.0 0, 0.0 -2,-0.0 0.363 109.7 44.7-149.4 -54.5 12.6 0.2 -13.1 10 10 A K H >> S+ 0 0 105 2,-0.2 3,-1.5 1,-0.2 4,-1.3 0.968 115.1 48.6 -65.7 -55.3 9.4 -1.7 -12.5 11 11 A S H 3> S+ 0 0 55 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.822 105.6 61.1 -53.6 -33.1 7.2 1.1 -13.4 12 12 A V H 3> S+ 0 0 68 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.840 100.1 54.4 -62.8 -33.9 9.3 1.5 -16.5 13 13 A R H X S+ 0 0 123 -4,-1.0 4,-1.9 1,-0.2 3,-0.8 0.756 104.3 64.4 -70.4 -25.2 4.2 -1.5 -22.6 18 18 A A H 3X S+ 0 0 32 -4,-0.9 4,-1.2 1,-0.3 -1,-0.2 0.846 89.9 65.2 -65.6 -34.7 2.3 1.8 -22.6 19 19 A I H 3< S+ 0 0 129 -4,-1.6 -1,-0.3 -3,-0.4 -2,-0.2 0.807 116.5 29.1 -56.8 -30.2 4.5 2.9 -25.5 20 20 A G H X4 S+ 0 0 51 -3,-0.8 3,-1.2 -4,-0.5 -2,-0.2 0.616 109.2 69.7-102.6 -20.2 2.8 0.1 -27.4 21 21 A S H >< S+ 0 0 50 -4,-1.9 3,-1.4 1,-0.3 5,-0.2 0.621 79.0 82.5 -72.1 -13.1 -0.4 0.2 -25.5 22 22 A V G >X>S+ 0 0 72 -4,-1.2 5,-2.2 1,-0.3 4,-1.6 0.833 86.6 55.2 -59.2 -33.2 -1.0 3.5 -27.2 23 23 A A G <45S+ 0 0 83 -3,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.671 113.8 41.6 -72.9 -17.4 -2.3 1.6 -30.2 24 24 A G G <45S+ 0 0 43 -3,-1.4 -1,-0.3 -4,-0.2 -2,-0.2 0.107 132.7 21.5-114.5 17.8 -4.7 -0.1 -27.8 25 25 A I T <>5S+ 0 0 91 -3,-1.2 4,-0.9 -7,-0.1 -3,-0.2 0.394 127.9 38.7-144.3 -57.8 -5.6 3.1 -25.9 26 26 A R H X5S+ 0 0 175 -4,-1.6 4,-0.6 -5,-0.2 -3,-0.2 0.873 120.9 47.3 -70.4 -39.1 -4.8 6.2 -28.0 27 27 A G H >44 S+ 0 0 82 -6,-0.3 3,-2.2 1,-0.2 4,-0.4 0.656 98.5 77.8 -77.8 -17.0 -9.2 3.2 -29.5 29 29 A L H >X S+ 0 0 71 -4,-0.9 4,-3.2 1,-0.3 3,-1.6 0.817 81.8 66.0 -60.3 -31.2 -9.5 6.6 -27.8 30 30 A K T << S+ 0 0 156 -3,-0.7 -1,-0.3 -4,-0.6 -2,-0.2 0.623 100.4 51.9 -65.4 -11.9 -10.8 7.9 -31.2 31 31 A S T <4 S+ 0 0 101 -3,-2.2 -1,-0.3 1,-0.1 -2,-0.2 0.524 112.8 43.4 -99.0 -11.2 -13.7 5.6 -30.4 32 32 A I T <4 0 0 117 -3,-1.6 -2,-0.2 -4,-0.4 -3,-0.1 0.786 360.0 360.0 -99.7 -40.1 -14.2 7.1 -27.0 33 33 A R < 0 0 264 -4,-3.2 -3,-0.1 -5,-0.1 -4,-0.1 0.277 360.0 360.0 64.7 360.0 -13.9 10.7 -27.9