==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ANTIBIOTIC 21-JUN-02 1M24 . COMPND 2 MOLECULE: TRICHOTOXIN_A50E; . SOURCE 2 ORGANISM_SCIENTIFIC: TRICHODERMA VIRIDE; . AUTHOR J.K.CHUGH,H.BRUECKNER,B.A.WALLACE . 34 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 2788.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 29 85.3 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 20.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 22 64.7 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 2 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 X > 0 0 135 0, 0.0 4,-2.5 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -46.6 5.8 5.0 29.0 2 2 A G H > + 0 0 47 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.910 360.0 54.5 -70.4 -40.1 4.7 2.0 27.0 3 3 A X H > S+ 0 0 98 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.923 113.0 44.8 -54.0 -47.4 1.5 3.7 25.7 4 4 A L H > S+ 0 0 115 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.941 109.0 55.0 -66.8 -45.6 3.6 6.5 24.4 5 5 A X H X S+ 0 0 75 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.902 112.9 44.6 -49.3 -46.9 6.2 4.2 22.9 6 6 A Q H X S+ 0 0 90 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.896 109.5 52.7 -71.3 -43.6 3.4 2.5 20.9 7 7 A X H X S+ 0 0 75 -4,-2.4 4,-0.8 1,-0.2 -2,-0.2 0.942 114.2 44.7 -54.3 -52.1 1.6 5.7 19.8 8 8 A X H >X S+ 0 0 65 -4,-2.6 3,-1.3 1,-0.2 4,-1.1 0.929 110.2 55.4 -57.1 -49.4 5.0 7.0 18.4 9 9 A X H >< S+ 0 0 42 -4,-2.2 3,-0.9 -5,-0.3 -1,-0.2 0.904 100.3 59.9 -52.4 -45.3 5.8 3.6 16.8 10 10 A A H 3< S+ 0 0 21 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.745 107.6 44.5 -59.5 -29.2 2.5 3.6 14.9 11 11 A A H XX S+ 0 0 58 -3,-1.3 3,-2.4 -4,-0.8 4,-0.7 0.644 86.9 90.3 -86.6 -22.5 3.4 6.8 13.1 12 12 A X H S+ 0 0 21 0, 0.0 4,-0.9 0, 0.0 -1,-0.3 0.746 92.8 59.1 -58.0 -23.0 6.0 4.3 8.9 14 14 A L H X4 S+ 0 0 134 -3,-2.4 3,-1.0 2,-0.2 -2,-0.2 0.968 108.4 42.5 -64.6 -54.3 5.1 7.8 7.5 15 15 A X H 3< S+ 0 0 93 -4,-0.7 -1,-0.2 1,-0.2 -3,-0.1 0.896 108.5 62.1 -54.8 -41.4 8.7 9.1 8.0 16 16 A X H 3< 0 0 106 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.793 360.0 360.0 -57.2 -32.4 10.1 5.8 6.7 17 17 A Q << 0 0 159 -3,-1.0 -1,-0.3 -4,-0.9 -2,-0.2 0.447 360.0 360.0 -79.8 360.0 8.5 6.4 3.3 18 !* 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 19 1 B X > 0 0 133 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -52.7 0.2 -0.0 -9.0 20 2 B G H > + 0 0 48 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.901 360.0 56.5 -67.7 -39.8 -0.5 3.1 -6.9 21 3 B X H > S+ 0 0 95 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.910 112.4 43.0 -54.8 -48.1 -3.8 1.7 -5.5 22 4 B L H > S+ 0 0 120 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.896 109.3 56.5 -70.9 -40.6 -2.0 -1.4 -4.2 23 5 B X H X S+ 0 0 79 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.916 112.5 43.8 -51.1 -47.3 1.0 0.6 -2.8 24 6 B Q H X S+ 0 0 139 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.898 109.4 54.1 -73.2 -39.0 -1.5 2.6 -0.8 25 7 B X H X S+ 0 0 72 -4,-2.2 4,-0.5 1,-0.2 3,-0.3 0.956 113.2 44.9 -53.6 -52.6 -3.6 -0.4 0.4 26 8 B X H >X S+ 0 0 72 -4,-2.6 3,-1.9 1,-0.2 4,-0.6 0.918 108.1 57.5 -59.6 -46.5 -0.3 -2.0 1.7 27 9 B X H >< S+ 0 0 41 -4,-2.2 3,-1.7 1,-0.3 -1,-0.2 0.870 96.7 63.4 -54.3 -41.8 0.8 1.3 3.3 28 10 B A H 3< S+ 0 0 73 -4,-1.9 -1,-0.3 -3,-0.3 -2,-0.2 0.712 101.4 52.0 -60.0 -23.8 -2.4 1.4 5.4 29 11 B A H XX S+ 0 0 51 -3,-1.9 3,-2.0 -4,-0.5 4,-0.8 0.614 82.5 92.0 -80.8 -19.2 -1.3 -1.8 7.1 30 12 B X H S+ 0 0 47 0, 0.0 4,-1.5 0, 0.0 -1,-0.3 0.763 96.6 60.1 -61.9 -21.9 1.1 0.8 11.6 32 14 B L H <4 S+ 0 0 133 -3,-2.0 3,-0.3 2,-0.2 -2,-0.2 0.969 108.9 40.7 -61.9 -56.6 0.3 -2.8 12.6 33 15 B X H < S+ 0 0 93 -4,-0.8 -1,-0.2 1,-0.2 -3,-0.1 0.909 112.1 58.1 -55.1 -45.0 3.8 -4.0 12.1 34 16 B X H < 0 0 54 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.856 360.0 360.0 -57.8 -41.5 5.2 -0.8 13.6 35 17 B Q < 0 0 106 -4,-1.5 -1,-0.2 -3,-0.3 -2,-0.2 0.799 360.0 360.0 -81.7 360.0 3.4 -1.3 16.9