==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PHEROMONE 09-NOV-00 1HD6 . COMPND 2 MOLECULE: PHEROMONE ER-22; . SOURCE 2 ORGANISM_SCIENTIFIC: EUPLOTES RAIKOVI; . AUTHOR P.LUGINBUHL,A.LIU,O.ZERBE,C.ORTENZI,P.LUPORINI,K.WUTHRICH . 37 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 2586.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 26 70.3 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 . 1 2.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 6 16.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 18 48.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 2.7 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 1 0 0 1 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 D >> 0 0 138 0, 0.0 4,-2.4 0, 0.0 3,-0.8 0.000 360.0 360.0 360.0 174.8 -8.0 -7.3 -3.7 2 2 A I H 3> + 0 0 67 1,-0.3 4,-2.9 2,-0.2 16,-0.2 0.784 360.0 56.2 -52.8 -31.8 -6.8 -6.3 -0.2 3 3 A a H 3> S+ 0 0 13 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.943 110.2 44.7 -63.4 -44.5 -3.4 -5.2 -1.6 4 4 A D H <> S+ 0 0 99 -3,-0.8 4,-2.8 2,-0.2 -2,-0.2 0.861 109.3 56.6 -68.8 -35.1 -5.3 -2.9 -3.9 5 5 A I H X S+ 0 0 76 -4,-2.4 4,-3.0 2,-0.2 5,-0.3 0.973 108.2 47.4 -53.8 -55.8 -7.4 -1.8 -0.9 6 6 A A H X>S+ 0 0 0 -4,-2.9 5,-1.9 1,-0.2 4,-1.0 0.859 111.7 51.5 -55.7 -37.5 -4.1 -0.9 0.8 7 7 A I H <5S+ 0 0 46 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.892 110.6 46.8 -68.9 -40.4 -3.1 0.9 -2.4 8 8 A A H <5S+ 0 0 81 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.955 120.8 38.8 -58.8 -48.4 -6.3 2.9 -2.4 9 9 A Q H <5S- 0 0 108 -4,-3.0 -2,-0.2 -5,-0.2 -1,-0.2 0.658 101.7-141.7 -73.7 -17.2 -5.8 3.6 1.3 10 10 A b T <5 + 0 0 9 -4,-1.0 2,-0.5 -5,-0.3 -3,-0.2 0.967 47.0 157.3 37.4 69.2 -2.1 4.1 0.6 11 11 A S >< - 0 0 29 -5,-1.9 4,-1.4 1,-0.1 -1,-0.2 -0.973 43.6-162.4-127.9 116.3 -1.6 2.3 3.9 12 12 A L H > S+ 0 0 52 -2,-0.5 4,-0.8 2,-0.2 -1,-0.1 0.881 95.0 53.6 -67.6 -36.8 1.6 0.5 5.0 13 13 A T H >4 S+ 0 0 107 1,-0.2 3,-1.9 2,-0.2 4,-0.3 0.979 109.8 47.3 -60.6 -50.1 -0.2 -1.4 7.8 14 14 A L H >> S+ 0 0 27 1,-0.3 3,-1.8 2,-0.2 4,-0.6 0.799 100.8 68.0 -61.8 -26.9 -2.9 -2.7 5.4 15 15 A c H >< S+ 0 0 0 -4,-1.4 3,-1.2 1,-0.3 -1,-0.3 0.819 85.9 69.2 -62.7 -26.6 -0.0 -3.7 3.0 16 16 A Q T << S+ 0 0 138 -3,-1.9 -1,-0.3 -4,-0.8 -2,-0.2 0.663 93.1 58.1 -67.9 -13.6 1.0 -6.3 5.6 17 17 A D T <4 S+ 0 0 102 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.749 91.1 95.7 -73.8 -30.8 -2.3 -8.1 4.6 18 18 A a S X< S- 0 0 5 -3,-1.2 3,-0.7 -4,-0.6 6,-0.1 -0.407 77.6-132.8 -73.8 140.0 -1.0 -8.2 1.0 19 19 A E T 3 S+ 0 0 170 1,-0.3 2,-1.7 -2,-0.1 -1,-0.1 0.959 106.9 42.3 -48.8 -64.0 0.8 -11.3 -0.3 20 20 A N T >> S+ 0 0 63 1,-0.2 4,-2.4 2,-0.1 3,-0.9 -0.435 80.4 175.6 -90.5 64.4 3.7 -9.4 -1.9 21 21 A T H <> S+ 0 0 35 -2,-1.7 4,-3.0 -3,-0.7 3,-0.2 0.827 72.2 43.8 -38.7 -63.3 4.1 -7.0 1.1 22 22 A P H 3> S+ 0 0 86 0, 0.0 4,-2.3 0, 0.0 -1,-0.3 0.826 114.0 52.2 -62.4 -29.0 7.2 -5.0 0.1 23 23 A I H <> S+ 0 0 99 -3,-0.9 4,-2.7 2,-0.2 -2,-0.2 0.893 111.0 47.9 -70.5 -38.4 5.9 -4.6 -3.4 24 24 A c H X S+ 0 0 1 -4,-2.4 4,-2.9 -3,-0.2 5,-0.2 0.971 112.0 49.8 -58.6 -52.1 2.7 -3.3 -1.8 25 25 A E H X S+ 0 0 72 -4,-3.0 4,-2.4 1,-0.2 -2,-0.2 0.871 112.8 47.1 -51.4 -46.4 4.8 -1.0 0.3 26 26 A L H X S+ 0 0 124 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.951 113.8 45.8 -66.3 -49.8 6.7 0.2 -2.8 27 27 A A H X S+ 0 0 36 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.863 110.3 55.6 -60.4 -37.8 3.5 0.8 -4.8 28 28 A V H X S+ 0 0 0 -4,-2.9 4,-2.5 2,-0.3 -2,-0.2 0.946 107.7 47.0 -63.7 -49.5 1.9 2.5 -1.8 29 29 A K H < S+ 0 0 117 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.877 110.3 57.1 -52.8 -38.0 4.9 4.9 -1.7 30 30 A G H < S+ 0 0 65 -4,-2.1 -2,-0.3 1,-0.2 -1,-0.2 0.954 112.6 38.6 -51.1 -50.1 4.2 5.1 -5.5 31 31 A S H < S+ 0 0 68 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.761 127.2 23.2 -83.4 -30.6 0.6 6.2 -4.8 32 32 A b S < S- 0 0 32 -4,-2.5 -1,-0.2 -5,-0.1 4,-0.1 -0.998 86.6-106.8-141.7 139.2 1.1 8.6 -1.8 33 33 A P - 0 0 111 0, 0.0 -3,-0.1 0, 0.0 4,-0.1 -0.406 56.2 -79.8 -70.6 134.7 4.2 10.5 -0.7 34 34 A P S S+ 0 0 71 0, 0.0 2,-0.2 0, 0.0 3,-0.0 -0.483 110.0 47.1 -78.8 152.8 5.9 9.0 2.5 35 35 A P S S- 0 0 119 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.699 94.7-137.5 -67.9 163.9 5.3 9.3 5.4 36 36 A W 0 0 63 -2,-0.2 -25,-0.1 1,-0.1 -26,-0.1 -0.393 360.0 360.0 -93.1 164.2 1.6 8.5 4.8 37 37 A S 0 0 157 -27,-0.2 -1,-0.1 -2,-0.1 -27,-0.1 0.928 360.0 360.0 -74.1 360.0 -1.6 10.0 6.2