==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ANTIBACTERIAL PROTEIN 16-DEC-94 1ICA . COMPND 2 MOLECULE: INSECT DEFENSIN A; . SOURCE 2 ORGANISM_SCIENTIFIC: PROTOPHORMIA TERRAENOVAE; . AUTHOR B.CORNET,J.M.BONMATIN,M.PTAK,F.VOVELLE . 40 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 3202.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 21 52.5 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 . 3 7.5 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 . 1 2.5 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 . 3 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 3 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 8 20.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 2.5 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 1 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 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 A 0 0 154 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -59.5 -7.1 11.7 -3.5 2 2 A T - 0 0 116 29,-0.0 2,-0.6 30,-0.0 29,-0.1 -0.478 360.0 -86.6-119.9-169.8 -5.6 8.2 -2.9 3 3 A a + 0 0 15 -2,-0.2 2,-0.1 27,-0.1 29,-0.0 -0.912 64.5 129.0-112.4 108.8 -2.2 6.8 -1.9 4 4 A D S S- 0 0 71 -2,-0.6 9,-0.6 25,-0.1 26,-0.1 0.173 73.7 -76.4-121.1-122.3 0.2 6.3 -4.8 5 5 A L - 0 0 92 7,-0.1 2,-2.4 6,-0.1 7,-0.4 0.631 45.4-172.6-119.2 -36.9 3.9 7.5 -5.1 6 6 A L S S+ 0 0 128 4,-0.1 2,-0.4 5,-0.1 -1,-0.1 -0.444 72.7 23.3 73.4 -68.9 3.3 11.2 -6.0 7 7 A S S > S- 0 0 79 -2,-2.4 3,-2.3 1,-0.1 5,-0.3 -0.978 94.9-102.0-128.8 140.7 7.0 11.8 -6.6 8 8 A G T 3 S+ 0 0 83 -2,-0.4 -1,-0.1 1,-0.3 2,-0.0 0.723 121.1 18.4 -21.3 -59.3 9.7 9.3 -7.6 9 9 A T T 3 S+ 0 0 143 2,-0.0 -1,-0.3 -3,-0.0 2,-0.1 -0.428 104.4 107.4-119.6 54.5 11.1 9.1 -4.1 10 10 A G S < S- 0 0 31 -3,-2.3 -4,-0.1 -5,-0.3 -2,-0.0 0.038 88.6 -10.8-104.4-147.2 8.3 10.6 -2.0 11 11 A I S S- 0 0 81 -6,-0.2 -6,-0.1 1,-0.1 -5,-0.1 0.656 75.1-168.8 -17.1 -49.6 5.8 8.8 0.4 12 12 A N > - 0 0 101 -7,-0.4 3,-0.6 -5,-0.3 -1,-0.1 0.934 13.1-179.9 47.2 62.4 7.1 5.5 -0.9 13 13 A H T >> + 0 0 37 -9,-0.6 3,-2.6 1,-0.2 4,-0.5 0.576 40.8 126.3 -65.6 -6.2 4.5 3.2 0.7 14 14 A S H 3> + 0 0 55 1,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.625 53.0 74.6 -17.7 -51.9 6.4 0.3 -1.0 15 15 A A H <> S+ 0 0 83 -3,-0.6 4,-1.9 1,-0.2 -1,-0.3 0.847 101.7 42.1 -36.3 -48.5 6.7 -1.6 2.4 16 16 A b H <> S+ 0 0 8 -3,-2.6 4,-2.7 2,-0.2 -1,-0.2 0.954 110.2 55.6 -68.7 -52.5 3.0 -2.5 2.1 17 17 A A H X S+ 0 0 26 11,-0.9 4,-3.0 -4,-0.5 -2,-0.2 0.935 108.8 49.3 -45.0 -55.9 3.2 -3.3 -1.7 18 18 A A H X S+ 0 0 49 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.955 110.2 49.8 -47.3 -63.4 6.0 -5.8 -0.9 19 19 A H H X S+ 0 0 101 -4,-1.9 4,-1.4 1,-0.2 -1,-0.2 0.901 114.1 45.5 -42.2 -54.6 4.0 -7.4 1.9 20 20 A c H X>S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 5,-0.8 0.931 109.5 54.9 -57.3 -51.3 0.9 -7.8 -0.4 21 21 A L H <5S+ 0 0 90 -4,-3.0 -2,-0.2 6,-0.3 -1,-0.2 0.921 102.3 57.2 -48.3 -54.2 2.9 -9.1 -3.3 22 22 A L H <5S+ 0 0 149 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.888 107.7 47.5 -45.0 -50.3 4.4 -11.9 -1.2 23 23 A R H <5S- 0 0 206 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.928 133.3 -92.4 -58.4 -47.5 0.8 -13.1 -0.4 24 24 A G T <5S+ 0 0 54 -4,-2.1 -3,-0.2 1,-0.1 2,-0.2 0.567 83.7 117.6 130.7 51.6 -0.0 -12.9 -4.2 25 25 A N < - 0 0 53 -5,-0.8 15,-0.2 -8,-0.2 -1,-0.1 -0.689 54.9-142.4-127.8 179.5 -1.5 -9.4 -4.8 26 26 A R S S+ 0 0 188 13,-1.6 2,-0.2 -2,-0.2 14,-0.1 -0.106 76.6 69.7-139.6 34.5 -0.5 -6.3 -6.9 27 27 A G + 0 0 14 12,-0.3 -6,-0.3 -10,-0.2 -7,-0.2 -0.671 38.2 150.5-135.8-171.8 -1.6 -3.6 -4.6 28 28 A G + 0 0 3 -2,-0.2 -11,-0.9 -8,-0.1 10,-0.2 0.432 24.0 136.8 135.3 79.5 -0.4 -2.1 -1.2 29 29 A Y E -A 37 0A 56 8,-1.7 8,-2.3 -13,-0.2 2,-0.5 -0.695 54.6 -83.3-132.7-175.0 -0.9 1.5 -0.2 30 30 A a E -A 36 0A 43 -2,-0.2 6,-0.2 6,-0.2 -27,-0.1 -0.827 43.6-147.6 -97.9 126.3 -2.0 3.8 2.7 31 31 A N - 0 0 57 4,-2.1 4,-0.2 -2,-0.5 -29,-0.0 -0.333 45.8 -59.3 -88.6 174.4 -5.8 4.3 3.1 32 32 A G S S+ 0 0 93 1,-0.2 -2,-0.0 2,-0.1 -1,-0.0 0.635 139.8 27.9 -14.2 -58.1 -7.8 7.3 4.4 33 33 A K S S- 0 0 176 2,-0.0 -1,-0.2 0, 0.0 -3,-0.1 0.946 124.7 -93.8 -78.5 -53.6 -6.0 7.3 7.8 34 34 A G S S+ 0 0 41 1,-0.1 2,-0.3 -5,-0.1 -2,-0.1 0.489 72.8 140.1 132.1 60.8 -2.7 5.8 6.7 35 35 A V - 0 0 76 -4,-0.2 -4,-2.1 -6,-0.0 2,-0.7 -0.875 58.1 -99.8-121.7 154.4 -2.9 2.0 7.2 36 36 A b E +A 30 0A 65 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.2 -0.691 48.3 166.1 -84.8 114.1 -1.6 -0.7 4.9 37 37 A V E -A 29 0A 40 -8,-2.3 -8,-1.7 -2,-0.7 2,-0.2 -0.899 24.4-135.3-122.6 152.8 -4.3 -2.2 2.7 38 38 A c - 0 0 53 -2,-0.3 2,-0.3 -10,-0.2 -21,-0.0 -0.709 17.8-161.6-110.0 161.8 -3.9 -4.4 -0.5 39 39 A R 0 0 134 -2,-0.2 -13,-1.6 1,-0.1 -12,-0.3 -0.888 360.0 360.0-139.2 169.2 -5.5 -4.3 -3.9 40 40 A N 0 0 158 -2,-0.3 -1,-0.1 -15,-0.2 -2,-0.0 0.660 360.0 360.0-121.4 360.0 -6.2 -6.2 -7.0