==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ANTIFUNGAL PROTEIN 04-NOV-00 1G6E . COMPND 2 MOLECULE: ANTIFUNGAL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES TENDAE; . AUTHOR R.CAMPOS-OLIVAS,C.BORMANN,I.HOERR,G.JUNG,A.M.GRONENBORN . 87 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5275.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 62 71.3 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 . 36 41.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 1.1 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 . 13 14.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 1 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 1 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 2.3 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 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 2 2 0 1 2 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 1 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 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 M 0 0 189 0, 0.0 29,-0.6 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 28.5 -3.3 12.4 8.7 2 2 A I + 0 0 11 27,-0.1 2,-0.3 29,-0.1 26,-0.1 -0.887 360.0 174.7-109.2 137.1 -1.4 9.1 7.8 3 3 A N - 0 0 127 24,-0.4 2,-0.7 -2,-0.4 24,-0.6 -0.978 39.4-100.3-140.3 151.9 1.4 7.7 9.9 4 4 A R E -A 26 0A 173 -2,-0.3 2,-0.3 22,-0.1 22,-0.2 -0.616 47.1-177.1 -74.9 111.3 3.5 4.6 9.9 5 5 A T E -A 25 0A 33 20,-3.9 20,-1.4 -2,-0.7 0, 0.0 -0.819 34.7-133.0-111.4 151.6 2.0 2.3 12.5 6 6 A D - 0 0 137 -2,-0.3 20,-0.1 18,-0.1 -2,-0.1 -0.088 60.6 -96.6 -91.1 34.6 3.3 -1.2 13.6 7 7 A a - 0 0 36 18,-0.2 19,-0.0 1,-0.1 -1,-0.0 0.928 44.8-172.3 48.7 94.5 -0.3 -2.5 13.4 8 8 A N + 0 0 103 17,-0.0 2,-0.2 0, 0.0 -1,-0.1 0.289 69.6 18.0 -96.9 8.0 -1.6 -2.3 16.9 9 9 A E S S- 0 0 114 0, 0.0 2,-0.2 0, 0.0 3,-0.2 -0.794 86.4 -95.0-153.9-165.3 -4.7 -4.2 15.9 10 10 A N S S+ 0 0 140 -2,-0.2 36,-0.2 1,-0.2 -3,-0.0 -0.600 96.3 67.8-127.8 70.5 -6.2 -6.5 13.2 11 11 A S S S+ 0 0 31 -2,-0.2 2,-0.3 34,-0.2 -1,-0.2 -0.001 75.5 87.8-179.8 54.1 -8.1 -4.2 10.8 12 12 A Y S S- 0 0 63 -3,-0.2 33,-1.5 15,-0.1 2,-0.4 -0.883 76.9 -82.4-148.6 177.6 -5.7 -2.0 8.9 13 13 A L E +B 26 0A 3 13,-1.1 13,-2.5 -2,-0.3 2,-0.4 -0.752 41.1 179.2 -92.0 133.5 -3.6 -1.8 5.7 14 14 A E E -B 25 0A 26 29,-0.5 29,-2.6 -2,-0.4 2,-0.5 -0.961 9.9-165.7-138.8 118.4 -0.2 -3.4 5.8 15 15 A I E -BC 24 42A 0 9,-2.0 9,-1.7 -2,-0.4 2,-0.6 -0.911 3.4-172.4-107.2 122.7 2.2 -3.6 2.9 16 16 A H E > +BC 23 41A 43 25,-2.3 24,-0.9 -2,-0.5 25,-0.8 -0.901 15.6 166.0-117.8 102.1 5.2 -5.9 3.1 17 17 A N H >> +BC 22 39A 11 5,-1.5 4,-2.4 -2,-0.6 5,-1.4 -0.326 50.5 57.9-101.9-173.3 7.7 -5.6 0.3 18 18 A N H 45S- 0 0 75 20,-1.7 -1,-0.2 19,-0.3 21,-0.1 0.786 135.5 -57.1 60.4 27.0 11.2 -6.8 -0.2 19 19 A E H 45S- 0 0 163 19,-0.6 -1,-0.2 -3,-0.2 -2,-0.2 0.990 108.0 -41.4 67.5 62.2 9.8 -10.3 0.3 20 20 A G H <5S+ 0 0 50 -4,-0.6 -2,-0.2 2,-0.1 -1,-0.2 0.883 112.9 121.5 52.7 41.3 8.2 -9.8 3.7 21 21 A R T <5S+ 0 0 176 -4,-2.4 2,-0.5 1,-0.3 -3,-0.2 0.856 74.5 19.9 -97.5 -50.5 11.3 -7.8 4.7 22 22 A D E - 0 0 75 5,-0.5 5,-0.6 3,-0.3 -1,-0.1 -0.872 63.3-159.7-112.5 144.8 7.2 0.9 -13.9 57 57 A L T 5S+ 0 0 109 -2,-0.4 -1,-0.2 3,-0.1 -2,-0.1 0.939 92.6 52.2 -84.2 -56.2 9.7 3.6 -12.9 58 58 A S T 5S+ 0 0 130 2,-0.1 -1,-0.1 3,-0.0 -2,-0.0 0.891 116.5 46.2 -46.3 -45.9 11.1 4.5 -16.3 59 59 A D T 5S- 0 0 87 2,-0.1 2,-2.7 1,-0.0 -3,-0.3 -0.811 92.4-119.2-104.1 143.7 7.6 4.9 -17.6 60 60 A P T 5 + 0 0 94 0, 0.0 2,-2.0 0, 0.0 -3,-0.1 -0.213 50.9 162.2 -72.4 48.3 4.9 6.8 -15.7 61 61 A R < - 0 0 132 -2,-2.7 -6,-1.9 -5,-0.6 -5,-0.5 -0.516 19.1-170.6 -74.7 81.5 2.9 3.6 -15.5 62 62 A L E -F 54 0B 66 -2,-2.0 2,-0.4 -8,-0.2 -8,-0.2 -0.545 3.7-172.6 -76.9 138.6 0.5 4.7 -12.7 63 63 A E E -F 53 0B 61 -10,-2.0 -10,-1.7 -2,-0.2 2,-0.4 -0.997 10.3-155.7-135.9 138.7 -1.7 2.0 -11.3 64 64 A T E -F 52 0B 103 -2,-0.4 2,-0.4 -12,-0.2 -12,-0.2 -0.930 10.2-177.8-116.4 138.1 -4.5 2.2 -8.7 65 65 A I E -F 51 0B 37 -14,-1.7 -14,-3.0 -2,-0.4 2,-0.6 -0.987 12.1-154.9-137.9 125.5 -5.7 -0.6 -6.5 66 66 A T E -F 50 0B 73 -2,-0.4 2,-0.5 -16,-0.2 -16,-0.2 -0.885 10.1-151.9-103.6 122.7 -8.6 -0.5 -4.1 67 67 A L E -F 49 0B 7 -18,-2.5 -18,-1.3 -2,-0.6 3,-0.1 -0.820 11.8-152.1 -96.1 125.7 -8.5 -2.9 -1.1 68 68 A Q > - 0 0 85 -2,-0.5 3,-2.3 1,-0.2 -21,-0.3 -0.183 46.7 -50.6 -84.3-178.4 -11.9 -4.0 0.3 69 69 A K T 3 S- 0 0 100 1,-0.3 -23,-0.4 -23,-0.2 -24,-0.2 -0.327 131.8 -0.7 -56.4 126.8 -12.7 -5.1 3.8 70 70 A W T 3 S+ 0 0 161 -25,-1.5 -1,-0.3 -26,-0.9 -25,-0.3 0.813 102.4 155.8 60.5 29.8 -10.1 -7.8 4.9 71 71 A G E < -D 44 0A 16 -3,-2.3 -27,-0.8 -27,-2.1 2,-0.3 -0.568 23.4-167.3 -88.5 153.3 -8.6 -7.4 1.4 72 72 A S E -D 43 0A 47 -29,-0.2 2,-0.4 -2,-0.2 -29,-0.3 -0.938 12.2-141.0-137.8 159.5 -5.0 -8.3 0.6 73 73 A W E +D 42 0A 28 -31,-2.6 -31,-1.9 -2,-0.3 -33,-0.1 -0.986 19.5 169.4-126.7 131.8 -2.6 -7.7 -2.3 74 74 A N + 0 0 100 -2,-0.4 -33,-0.2 -33,-0.3 -34,-0.1 -0.580 19.3 144.9-141.5 74.4 -0.1 -10.2 -3.6 75 75 A P - 0 0 49 0, 0.0 -35,-0.2 0, 0.0 -1,-0.1 0.965 63.3 -95.3 -72.4 -87.8 1.4 -9.0 -6.9 76 76 A G S S- 0 0 58 -37,-1.4 -36,-0.3 -35,-0.0 -37,-0.1 0.149 77.8 -36.8 161.1 65.4 5.0 -10.1 -7.1 77 77 A H - 0 0 110 -38,-1.5 2,-0.2 -39,-0.2 -37,-0.2 0.919 69.0-143.8 66.8 98.0 7.6 -7.5 -5.9 78 78 A I - 0 0 9 1,-0.1 -40,-9.9 -41,-0.0 -60,-0.2 -0.639 14.3-121.6 -92.8 151.2 6.5 -4.0 -7.0 79 79 A H S S- 0 0 45 -24,-0.6 2,-0.3 -42,-0.3 -1,-0.1 0.978 76.4 -42.7 -51.6 -75.5 8.9 -1.3 -8.1 80 80 A E E - G 0 54B 21 -26,-0.8 -26,-1.4 -43,-0.3 -43,-0.4 -0.979 54.9-106.7-160.1 149.2 8.1 1.3 -5.5 81 81 A I E - G 0 53B 0 -2,-0.3 -28,-0.2 -28,-0.2 3,-0.1 -0.603 23.4-168.8 -81.0 138.0 5.0 2.8 -3.8 82 82 A L E - 0 0 48 -30,-1.4 2,-0.3 1,-0.4 -29,-0.2 0.935 61.1 -26.4 -88.4 -66.4 4.0 6.4 -4.9 83 83 A S E - G 0 52B 28 -31,-2.5 -31,-1.9 -50,-0.4 2,-0.4 -0.914 52.7-131.0-145.3 170.1 1.4 7.5 -2.4 84 84 A I E -EG 32 51B 0 -52,-3.4 -52,-1.5 -2,-0.3 2,-0.4 -0.995 16.4-170.4-131.8 129.4 -1.3 6.0 -0.1 85 85 A R E -EG 31 50B 123 -35,-2.4 -35,-2.2 -2,-0.4 2,-0.4 -0.976 3.6-164.6-122.5 130.2 -4.9 7.2 0.1 86 86 A I E G 0 49B 16 -57,-0.9 -37,-0.2 -56,-0.6 -57,-0.0 -0.929 360.0 360.0-115.6 137.4 -7.3 6.0 2.8 87 87 A Y 0 0 161 -39,-1.5 -58,-0.2 -2,-0.4 -38,-0.1 0.773 360.0 360.0 -84.4 360.0 -11.1 6.5 2.6