==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PLANT PROTEIN 28-JUL-04 1WN8 . COMPND 2 MOLECULE: KALATA B3/B6; . SOURCE 2 SYNTHETIC: YES; . AUTHOR J.L.DUTTON,R.F.RENDA,C.WAINE,R.J.CLARK,N.L.DALY, . 22 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 2155.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 15 68.2 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 . 1 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 3 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 11 50.0 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 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 G 0 0 68 0, 0.0 5,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-147.9 -11.1 -5.2 3.2 2 2 A V - 0 0 103 0, 0.0 2,-2.8 0, 0.0 4,-0.1 -0.246 360.0 -98.2-127.4 44.1 -13.7 -4.2 0.6 3 3 A K S >>>S+ 0 0 130 1,-0.2 4,-1.8 2,-0.1 3,-1.4 -0.274 125.7 70.1 71.8 -51.4 -11.5 -2.1 -1.7 4 4 A S T 345S+ 0 0 102 -2,-2.8 -1,-0.2 1,-0.3 0, 0.0 0.441 116.4 25.9 -71.8 1.5 -12.7 1.1 0.1 5 5 A S T 345S+ 0 0 52 3,-0.0 -1,-0.3 0, 0.0 -2,-0.1 -0.222 133.6 34.9-157.4 44.4 -10.7 -0.2 3.0 6 6 A E T <>5S+ 0 0 54 -3,-1.4 4,-2.6 -5,-0.2 5,-0.2 0.205 104.6 59.9-165.8 -46.6 -8.1 -2.3 1.3 7 7 A T H X5S+ 0 0 74 -4,-1.8 4,-1.6 2,-0.2 -3,-0.1 0.962 111.3 42.1 -63.8 -52.7 -7.1 -0.7 -2.1 8 8 A T H > S+ 0 0 72 -6,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.945 107.8 45.1 -63.5 -49.7 -4.3 0.5 2.2 10 10 A T H X S+ 0 0 78 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.779 111.7 56.2 -65.2 -26.7 -2.3 -1.5 -0.3 11 11 A M H X S+ 0 0 124 -4,-1.6 4,-1.2 2,-0.2 -1,-0.2 0.896 109.9 42.2 -73.2 -41.8 -1.4 1.8 -2.1 12 12 A F H X S+ 0 0 119 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.881 116.1 48.7 -73.0 -38.6 0.0 3.4 1.0 13 13 A L H X S+ 0 0 74 -4,-2.4 4,-3.1 1,-0.2 5,-0.3 0.860 103.7 62.5 -69.6 -33.4 1.9 0.2 2.0 14 14 A K H X S+ 0 0 97 -4,-1.7 4,-2.1 -5,-0.2 -1,-0.2 0.914 108.0 41.8 -55.6 -47.4 3.2 -0.1 -1.5 15 15 A E H X S+ 0 0 71 -4,-1.2 4,-2.3 2,-0.2 -1,-0.2 0.932 115.8 48.2 -67.4 -47.8 5.1 3.2 -1.2 16 16 A M H < S+ 0 0 134 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.895 114.4 46.6 -60.5 -42.5 6.3 2.6 2.3 17 17 A Q H >< S+ 0 0 133 -4,-3.1 3,-1.4 1,-0.2 -1,-0.2 0.900 112.1 49.9 -68.3 -40.9 7.5 -0.9 1.5 18 18 A L H >< S+ 0 0 93 -4,-2.1 3,-0.6 -5,-0.3 -2,-0.2 0.866 113.9 46.1 -65.3 -36.1 9.2 0.3 -1.7 19 19 A K T 3< S+ 0 0 149 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.236 120.5 40.6 -90.5 13.8 11.0 3.0 0.2 20 20 A G T < S+ 0 0 57 -3,-1.4 -1,-0.2 -5,-0.1 -2,-0.2 0.056 85.5 92.1-150.0 31.5 11.9 0.6 3.0 21 21 A L < 0 0 124 -3,-0.6 -2,-0.1 0, 0.0 -3,-0.1 0.809 360.0 360.0 -96.5 -38.0 13.0 -2.6 1.3 22 22 A P 0 0 167 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.531 360.0 360.0 -88.7 360.0 16.8 -2.1 1.0