==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TOXIN 02-MAY-02 1LMM . COMPND 2 MOLECULE: PSALMOTOXIN 1; . SOURCE 2 ORGANISM_SCIENTIFIC: PSALMOPOEUS CAMBRIDGEI; . AUTHOR P.ESCOUBAS,C.BERNARD,M.LAZDUNSKI,H.DARBON . 40 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 3999.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 13 32.5 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 . 7 17.5 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 . 2 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 1 2.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), 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 . 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 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 . 1 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 0 ANTIPARALLEL 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 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 E 0 0 240 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 143.7 -6.3 0.0 15.6 2 2 A D - 0 0 147 1,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.171 360.0 -97.3 -60.3 155.9 -7.3 1.4 12.2 3 3 A a - 0 0 66 1,-0.2 -1,-0.1 14,-0.0 14,-0.1 0.005 58.0 -64.1 -66.0 178.3 -6.3 -0.5 9.1 4 4 A I - 0 0 68 12,-0.2 14,-0.3 1,-0.1 15,-0.2 -0.533 59.2-115.6 -70.1 121.1 -3.3 0.2 7.0 5 5 A P > - 0 0 66 0, 0.0 3,-0.9 0, 0.0 28,-0.2 -0.241 33.7-108.7 -57.0 141.2 -3.6 3.7 5.4 6 6 A K T 3 S+ 0 0 139 1,-0.2 28,-0.2 26,-0.1 3,-0.1 -0.340 99.0 18.6 -71.7 154.2 -3.8 3.7 1.6 7 7 A W T 3 S+ 0 0 183 26,-2.4 2,-0.3 1,-0.2 -1,-0.2 0.789 99.2 134.1 56.0 28.8 -0.9 4.9 -0.5 8 8 A K < - 0 0 121 -3,-0.9 25,-1.3 25,-0.4 -1,-0.2 -0.793 63.9 -81.8-109.8 152.6 1.3 4.4 2.6 9 9 A G B -A 32 0A 26 -2,-0.3 24,-0.3 23,-0.2 23,-0.2 0.120 29.7-129.5 -43.7 162.8 4.7 2.8 2.9 10 10 A b >> + 0 0 4 21,-0.9 4,-0.8 22,-0.1 5,-0.8 0.517 63.5 130.4 -95.2 -8.6 5.0 -1.0 3.1 11 11 A V T 45 + 0 0 98 20,-0.2 5,-0.2 3,-0.2 4,-0.2 0.109 44.1 59.2 -41.2 159.6 7.3 -0.9 6.2 12 12 A N T 45S- 0 0 102 1,-0.1 4,-0.3 2,-0.1 3,-0.2 0.965 132.8 -10.9 75.2 83.4 6.3 -3.0 9.2 13 13 A R T 45S- 0 0 193 1,-0.2 -2,-0.1 2,-0.1 -1,-0.1 0.166 101.5-113.6 83.2 -16.7 6.2 -6.7 8.0 14 14 A H T <5S+ 0 0 112 -4,-0.8 -3,-0.2 1,-0.1 -1,-0.2 0.962 101.1 32.1 51.6 87.1 6.5 -5.5 4.4 15 15 A G < + 0 0 44 -5,-0.8 -2,-0.1 -4,-0.2 -1,-0.1 0.737 69.5 134.8 108.0 34.5 3.2 -6.5 2.8 16 16 A D + 0 0 90 -6,-0.4 -12,-0.2 -4,-0.3 -2,-0.1 0.036 30.4 162.1 -99.9 24.9 0.8 -6.1 5.8 17 17 A c - 0 0 24 4,-0.1 -11,-0.0 -14,-0.1 6,-0.0 0.019 38.1-129.3 -42.9 150.5 -1.8 -4.3 3.7 18 18 A a S S+ 0 0 46 -14,-0.3 -1,-0.0 -13,-0.1 -12,-0.0 0.918 79.1 12.2 -70.1 -96.4 -5.3 -4.2 5.1 19 19 A E S S- 0 0 151 -15,-0.2 2,-0.1 1,-0.1 -15,-0.0 0.365 119.9 -55.2 -61.9-154.5 -7.9 -5.4 2.6 20 20 A G S S+ 0 0 44 2,-0.0 -1,-0.1 0, 0.0 2,-0.1 0.074 90.6 143.5 -78.5 28.5 -6.9 -7.0 -0.7 21 21 A L - 0 0 22 14,-0.1 2,-0.4 -2,-0.1 -4,-0.1 -0.400 44.2-136.2 -69.8 144.2 -4.7 -4.0 -1.4 22 22 A E E -B 34 0A 102 12,-2.1 12,-2.7 -2,-0.1 2,-0.7 -0.862 11.3-125.9-106.6 137.1 -1.4 -4.7 -3.2 23 23 A b E -B 33 0A 21 -2,-0.4 2,-0.6 10,-0.3 10,-0.3 -0.708 24.2-158.1 -83.9 112.4 1.9 -3.1 -2.2 24 24 A W E -B 32 0A 147 8,-2.4 8,-2.1 -2,-0.7 2,-0.4 -0.810 8.1-142.1 -95.1 122.1 3.4 -1.4 -5.3 25 25 A K E -B 31 0A 155 -2,-0.6 6,-0.3 6,-0.3 5,-0.1 -0.661 14.2-141.9 -84.8 133.9 7.2 -0.9 -5.1 26 26 A R - 0 0 177 4,-2.0 -1,-0.1 -2,-0.4 5,-0.0 0.191 41.2 -75.7 -74.6-159.7 8.5 2.4 -6.6 27 27 A R S S- 0 0 233 1,-0.0 -2,-0.1 3,-0.0 -1,-0.0 0.953 114.2 -23.1 -67.2 -51.5 11.8 2.8 -8.5 28 28 A R S S+ 0 0 208 2,-0.1 -2,-0.0 0, 0.0 -1,-0.0 0.600 120.0 83.6-128.5 -43.1 14.0 2.6 -5.5 29 29 A S S S- 0 0 62 1,-0.1 -3,-0.3 -4,-0.1 0, 0.0 0.095 89.3 -79.3 -57.5 177.5 11.9 3.6 -2.4 30 30 A F - 0 0 110 -5,-0.1 -4,-2.0 1,-0.1 2,-0.3 0.201 52.7 -91.5 -66.0-167.1 9.7 1.1 -0.6 31 31 A E E - B 0 25A 32 -6,-0.3 -21,-0.9 -5,-0.0 2,-0.4 -0.730 27.2-144.6-111.0 161.3 6.2 -0.0 -1.7 32 32 A V E -AB 9 24A 27 -8,-2.1 -8,-2.4 -2,-0.3 -23,-0.2 -0.990 21.8-116.6-131.7 127.7 2.8 1.4 -0.9 33 33 A c E - B 0 23A 3 -25,-1.3 -26,-2.4 -2,-0.4 -25,-0.4 -0.391 31.7-168.3 -61.7 127.4 -0.4 -0.6 -0.5 34 34 A V E - B 0 22A 14 -12,-2.7 -12,-2.1 -28,-0.2 -1,-0.0 -0.961 20.0-125.6-124.7 115.0 -3.0 0.3 -3.1 35 35 A P - 0 0 48 0, 0.0 -14,-0.1 0, 0.0 -29,-0.0 -0.303 15.0-136.9 -59.2 134.5 -6.6 -0.9 -2.8 36 36 A K S S+ 0 0 140 2,-0.0 -15,-0.1 -16,-0.0 -17,-0.0 0.984 87.3 45.9 -54.1 -78.3 -7.9 -2.8 -5.8 37 37 A T - 0 0 76 1,-0.1 -16,-0.0 2,-0.1 0, 0.0 -0.445 69.0-169.1 -70.2 139.9 -11.4 -1.3 -6.3 38 38 A P - 0 0 101 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.848 69.2 -3.1 -92.7 -88.9 -11.5 2.5 -6.1 39 39 A K 0 0 181 1,-0.3 -2,-0.1 0, 0.0 0, 0.0 0.989 360.0 360.0 -70.3 -78.6 -15.0 4.1 -5.9 40 40 A T 0 0 176 0, 0.0 -1,-0.3 0, 0.0 0, 0.0 -0.838 360.0 360.0 -95.5 360.0 -17.4 1.2 -6.1