==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL PROTEIN 11-JUL-06 2HM3 . COMPND 2 MOLECULE: NEMATOCYST OUTER WALL ANTIGEN; . SOURCE 2 ORGANISM_SCIENTIFIC: HYDRA VULGARIS; . AUTHOR S.MEIER,P.R.JENSEN,S.GRZESIEK,S.OEZBEK . 25 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 2245.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 12 48.0 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 . 1 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 20.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 4 16.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 4.0 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 1 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 7 A T 0 0 148 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-171.2 1.1 -10.1 2.9 2 8 A a - 0 0 4 1,-0.2 3,-0.2 4,-0.1 4,-0.2 -0.540 360.0 -77.5 -86.5 149.4 -0.6 -6.8 2.1 3 9 A P > - 0 0 64 0, 0.0 3,-3.0 0, 0.0 -1,-0.2 0.036 69.3 -66.5 -53.1 160.1 -4.3 -6.7 2.2 4 10 A S T 3 S+ 0 0 129 1,-0.3 0, 0.0 -3,-0.1 0, 0.0 -0.314 126.8 15.8 -56.6 119.8 -6.3 -8.1 -0.6 5 11 A G T 3 S+ 0 0 77 1,-0.3 -1,-0.3 -3,-0.2 2,-0.2 0.414 87.1 153.1 97.2 2.0 -5.6 -6.0 -3.6 6 12 A b < - 0 0 22 -3,-3.0 -1,-0.3 -4,-0.2 13,-0.2 -0.461 51.8-110.7 -69.4 133.8 -2.5 -4.2 -2.3 7 13 A S > - 0 0 69 11,-0.5 3,-2.8 12,-0.3 4,-0.5 -0.384 20.1-131.1 -60.9 125.8 -0.1 -3.1 -4.8 8 14 A G G > S+ 0 0 53 1,-0.3 3,-0.8 2,-0.2 -1,-0.2 0.702 104.9 70.8 -54.7 -18.5 3.0 -5.2 -4.6 9 15 A D G 3 S+ 0 0 143 1,-0.3 -1,-0.3 9,-0.1 4,-0.1 0.749 92.2 55.5 -71.1 -21.8 4.9 -1.9 -4.6 10 16 A c G X>>S+ 0 0 3 -3,-2.8 4,-2.5 8,-0.1 3,-0.8 0.603 98.0 142.7 -82.2 -11.5 3.6 -1.2 -1.1 11 17 A Y T <45 + 0 0 123 -3,-0.8 -4,-0.0 -4,-0.5 -3,-0.0 -0.422 53.0 15.1 -72.4 147.1 5.1 -4.5 -0.3 12 18 A P T 345S+ 0 0 103 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 -0.956 127.1 53.5 -92.9 10.9 6.6 -5.7 2.0 13 19 A E T <45S- 0 0 135 -3,-0.8 -2,-0.3 -4,-0.1 -3,-0.1 0.926 80.1-166.6 -68.3 -38.7 5.4 -2.8 4.2 14 20 A a T <5 - 0 0 19 -4,-2.5 -3,-0.2 1,-0.2 -1,-0.1 0.871 8.2-173.7 57.6 38.7 1.9 -3.6 3.2 15 21 A K >>< - 0 0 116 -5,-0.5 4,-3.4 1,-0.2 3,-1.8 -0.538 25.8-136.8 -68.5 113.8 0.6 -0.3 4.5 16 22 A P H 3>>S+ 0 0 93 0, 0.0 4,-3.8 0, 0.0 5,-0.8 0.778 104.1 60.5 -41.4 -32.8 -3.2 -0.4 4.2 17 23 A G H 3>5S+ 0 0 37 2,-0.2 4,-0.9 3,-0.2 6,-0.1 0.911 115.0 31.0 -66.6 -39.4 -3.0 3.1 2.9 18 24 A c H <45S+ 0 0 55 -3,-1.8 -11,-0.5 2,-0.2 -1,-0.2 0.820 123.0 53.7 -83.4 -32.7 -0.9 2.2 -0.0 19 25 A b H <5S+ 0 0 8 -4,-3.4 -12,-0.3 -13,-0.2 -2,-0.2 0.929 130.7 5.8 -65.4 -54.0 -2.6 -1.2 -0.1 20 26 A G H <5S+ 0 0 67 -4,-3.8 2,-0.3 1,-0.2 -3,-0.2 0.569 130.1 27.4-110.7 -15.6 -6.2 -0.1 -0.3 21 27 A Q << - 0 0 144 -4,-0.9 2,-0.8 -5,-0.8 -1,-0.2 -0.811 50.0-161.6-159.9 118.5 -6.2 3.6 -0.6 22 28 A V + 0 0 131 -2,-0.3 -4,-0.1 -4,-0.1 -5,-0.0 -0.839 48.0 115.6 -99.1 106.6 -3.9 6.3 -2.0 23 29 A N + 0 0 120 -2,-0.8 -1,-0.1 -6,-0.1 -5,-0.0 -0.351 10.7 147.6-173.0 82.4 -4.9 9.7 -0.7 24 30 A L 0 0 173 -2,-0.0 -2,-0.0 -7,-0.0 -1,-0.0 -0.004 360.0 360.0-107.2 25.7 -2.5 11.6 1.6 25 31 A N 0 0 209 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.804 360.0 360.0-145.6 360.0 -3.6 15.0 0.3