==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER UNKNOWN FUNCTION 18-MAY-13 2M8F . COMPND 2 MOLECULE: ASTEXIN3; . SOURCE 2 ORGANISM_SCIENTIFIC: ASTICCACAULIS EXCENTRICUS; . AUTHOR M.O.MAKSIMOV,A.LINK . 24 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 2062.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 12 50.0 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 . 4 16.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 2 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 2 8.3 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 . 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 12 0, 0.0 14,-1.6 0, 0.0 16,-0.2 0.000 360.0 360.0 360.0-159.5 1.9 0.4 -1.2 2 2 A P + 0 0 107 0, 0.0 15,-0.1 0, 0.0 22,-0.1 0.644 360.0 101.5 -80.9 -18.0 4.0 -1.7 -3.7 3 3 A T S S- 0 0 5 13,-0.7 2,-1.5 20,-0.2 12,-0.1 -0.235 80.4-108.9 -70.8 152.8 6.6 -3.5 -1.5 4 4 A P S S+ 0 0 125 0, 0.0 12,-0.1 0, 0.0 -1,-0.1 -0.443 90.1 77.0 -83.2 65.9 6.3 -7.3 -0.4 5 5 A M S S- 0 0 95 10,-1.9 2,-0.3 -2,-1.5 11,-0.2 -0.120 80.1 -95.5-132.4-127.8 5.6 -6.7 3.4 6 6 A V + 0 0 108 -2,-0.1 9,-0.2 1,-0.1 11,-0.1 -0.898 60.7 4.6-162.0 144.5 2.2 -5.7 5.1 7 7 A G S S+ 0 0 32 7,-0.7 2,-2.4 -2,-0.3 9,-0.3 -0.240 75.0 80.4 89.7-173.1 0.3 -2.6 6.5 8 8 A L S S+ 0 0 113 1,-0.2 2,-2.6 8,-0.1 7,-0.1 -0.316 71.0 101.1 70.2 -50.6 0.8 1.3 6.6 9 9 A D >>> + 0 0 5 -2,-2.4 3,-2.6 5,-0.2 4,-2.6 -0.043 35.1 145.4 -56.8 30.7 -0.5 1.6 2.9 10 10 A S T 345 + 0 0 115 -2,-2.6 -1,-0.2 1,-0.3 -2,-0.1 0.465 63.2 68.3 -61.0 -0.9 -4.1 2.8 4.0 11 11 A V T 345S+ 0 0 136 -3,-0.1 -1,-0.3 1,-0.0 -2,-0.1 0.547 123.5 10.7 -91.2 -12.1 -4.2 5.1 0.9 12 12 A S T <45S- 0 0 99 -3,-2.6 -2,-0.2 2,-0.1 -3,-0.1 0.434 97.8-119.6-141.7 -5.6 -4.4 1.9 -1.4 13 13 A G T <5 + 0 0 71 -4,-2.6 -3,-0.2 1,-0.1 -5,-0.0 0.723 69.7 128.6 80.0 22.4 -4.9 -1.1 1.0 14 14 A Q < - 0 0 89 -5,-0.8 -7,-0.7 -7,-0.1 -5,-0.2 0.039 68.9 -69.8-114.1-160.4 -1.7 -2.8 -0.1 15 15 A Y S S- 0 0 131 -14,-1.6 -10,-1.9 1,-0.2 2,-0.1 0.056 90.2 -35.8-107.4 27.9 1.6 -4.4 1.3 16 16 A W - 0 0 61 -9,-0.3 -13,-0.7 -11,-0.2 -1,-0.2 -0.425 36.8-159.4 127.3 165.1 3.8 -1.5 2.8 17 17 A D + 0 0 72 -16,-0.2 2,-0.7 -2,-0.1 7,-0.1 0.193 46.6 116.3-152.0 2.6 4.8 2.1 2.2 18 18 A Q - 0 0 102 5,-0.1 6,-0.3 4,-0.1 4,-0.1 -0.648 61.5-120.5-117.7 83.6 8.1 3.1 3.9 19 19 A H + 0 0 141 -2,-0.7 5,-0.1 4,-0.3 -2,-0.1 0.373 64.9 101.4 -18.2 134.6 11.0 4.2 1.6 20 20 A A S >> S- 0 0 50 0, 0.0 3,-3.0 0, 0.0 4,-2.2 -0.464 91.8 -73.6 135.7 147.2 14.4 2.3 1.7 21 21 A P T 34 S+ 0 0 126 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 0.066 133.9 36.1 -72.8 31.8 15.4 -0.4 -1.0 22 22 A L T 34 S+ 0 0 130 -2,-1.8 -4,-0.1 -4,-0.1 -3,-0.1 0.152 123.9 42.8-136.5 1.9 12.9 -3.1 0.2 23 23 A A T <4 0 0 10 -3,-3.0 -4,-0.3 -20,-0.1 -20,-0.2 0.418 360.0 360.0-150.2 -12.8 10.1 -0.8 1.2 24 24 A D < 0 0 127 -4,-2.2 -7,-0.1 -6,-0.3 -1,-0.1 -0.858 360.0 360.0 -64.5 360.0 10.1 1.6 -1.6