==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER UNKNOWN FUNCTION 01-MAY-12 4EYC . COMPND 2 MOLECULE: CATHELICIDIN ANTIMICROBIAL PEPTIDE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.PAZGIER,E.POZHARSKI,E.TOTH,W.LU . 202 3 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11194.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 108 53.5 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 . 52 25.7 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 . 10 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 27 13.4 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+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 2 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 . 3 0 0 0 4 0 0 2 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 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 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 -3 A G 0 0 130 0, 0.0 90,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-102.2 43.2 -8.0 12.8 2 -2 A S - 0 0 74 1,-0.1 3,-0.2 2,-0.0 0, 0.0 0.090 360.0-176.6 -52.3 142.1 43.5 -5.3 15.3 3 -1 A H S S+ 0 0 150 1,-0.3 2,-0.3 89,-0.0 -1,-0.1 0.530 83.1 33.2-108.0 -7.0 41.5 -5.3 18.5 4 0 A M + 0 0 75 87,-0.1 2,-0.5 86,-0.1 -1,-0.3 -0.795 61.4 158.4-149.4 98.6 42.8 -2.0 19.6 5 31 A Q - 0 0 98 -2,-0.3 85,-2.4 -3,-0.2 2,-0.5 -0.910 24.7-163.1-121.4 102.7 43.7 0.8 17.2 6 32 A V B -A 89 0A 76 -2,-0.5 2,-0.3 83,-0.2 83,-0.2 -0.749 7.6-170.5 -99.5 127.2 43.6 4.0 19.0 7 33 A L - 0 0 28 81,-2.2 2,-0.1 -2,-0.5 -2,-0.0 -0.738 30.7-107.0-102.0 154.1 43.5 7.4 17.2 8 34 A S > - 0 0 59 -2,-0.3 4,-2.9 1,-0.1 5,-0.2 -0.310 42.1-102.5 -64.4 162.9 43.9 10.8 18.8 9 35 A Y H > S+ 0 0 37 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.945 123.3 49.5 -61.2 -42.7 40.7 12.7 19.1 10 36 A K H > S+ 0 0 114 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.928 112.1 48.4 -62.8 -39.1 41.5 14.9 16.1 11 37 A E H > S+ 0 0 98 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.893 107.9 54.6 -65.9 -39.8 42.4 11.9 14.0 12 38 A A H X S+ 0 0 2 -4,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.911 109.2 48.8 -62.0 -39.2 39.2 10.2 15.0 13 39 A V H X S+ 0 0 0 -4,-2.3 4,-2.4 -5,-0.2 -2,-0.2 0.944 110.7 48.7 -64.8 -47.4 37.3 13.2 13.7 14 40 A L H X S+ 0 0 67 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.914 112.7 50.2 -58.4 -38.6 39.2 13.3 10.4 15 41 A R H X S+ 0 0 127 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.892 108.0 52.0 -65.2 -43.4 38.5 9.6 10.0 16 42 A A H X S+ 0 0 1 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.889 106.6 53.5 -61.5 -39.1 34.9 10.1 10.8 17 43 A I H X S+ 0 0 7 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.918 103.4 56.1 -62.8 -39.5 34.6 12.7 8.1 18 44 A D H X S+ 0 0 55 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.941 110.7 46.9 -50.2 -46.4 36.1 10.3 5.7 19 45 A G H X S+ 0 0 17 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.856 108.6 53.6 -58.9 -43.1 33.2 8.0 6.7 20 46 A I H X S+ 0 0 8 -4,-2.5 4,-0.7 2,-0.2 -1,-0.2 0.885 110.3 46.8 -67.9 -37.1 30.7 10.8 6.3 21 47 A N H >< S+ 0 0 6 -4,-2.6 3,-0.8 1,-0.2 -2,-0.2 0.931 110.0 54.7 -66.9 -41.9 31.9 11.5 2.8 22 48 A Q H 3< S+ 0 0 155 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.820 112.0 41.6 -59.4 -36.3 31.8 7.8 1.9 23 49 A R H 3< S+ 0 0 66 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.545 99.0 95.5 -89.8 -9.6 28.2 7.4 2.9 24 50 A S << - 0 0 9 -3,-0.8 -3,-0.0 -4,-0.7 -4,-0.0 -0.355 60.7-153.3 -80.0 160.2 27.0 10.6 1.4 25 51 A S + 0 0 87 -2,-0.1 -1,-0.1 37,-0.0 -4,-0.1 0.165 54.8 125.8-111.1 17.4 25.4 11.1 -2.0 26 52 A D - 0 0 49 -5,-0.1 36,-0.2 2,-0.1 4,-0.1 -0.274 66.8-125.7 -67.2 161.0 26.5 14.7 -2.4 27 53 A A S S+ 0 0 78 34,-0.1 35,-3.2 35,-0.1 36,-0.3 0.899 86.3 53.3 -76.6 -39.7 28.5 15.6 -5.5 28 54 A N E S-B 61 0B 26 33,-0.3 2,-0.4 34,-0.2 -2,-0.1 -0.562 85.3-106.5-104.5 158.7 31.5 17.1 -3.6 29 55 A L E - 0 0 11 31,-3.0 29,-2.6 -2,-0.2 2,-0.4 -0.639 31.6-146.1 -75.1 130.7 33.8 16.2 -0.9 30 56 A Y E -B 57 0B 8 -2,-0.4 2,-0.3 27,-0.2 27,-0.2 -0.804 16.2-164.0 -97.0 146.5 33.2 17.9 2.5 31 57 A R E -B 56 0B 43 25,-2.5 25,-2.4 -2,-0.4 -17,-0.0 -0.955 31.6 -83.8-134.3 144.6 36.1 18.8 4.6 32 58 A L E +B 55 0B 30 -2,-0.3 23,-0.3 23,-0.2 3,-0.1 -0.195 44.7 169.2 -49.2 124.2 36.6 19.8 8.3 33 59 A L E - 0 0 59 21,-2.6 2,-0.4 1,-0.2 22,-0.2 0.747 66.3 -1.0-105.0 -69.5 36.1 23.5 8.7 34 60 A D E - 0 0 99 20,-0.5 20,-2.2 2,-0.0 2,-0.5 -0.975 58.5-157.3-130.6 122.2 35.9 24.1 12.5 35 61 A L E -B 53 0B 48 -2,-0.4 18,-0.2 18,-0.2 -25,-0.0 -0.814 27.0-124.4 -88.9 123.1 36.3 21.5 15.3 36 62 A D - 0 0 44 16,-2.5 16,-0.3 -2,-0.5 2,-0.2 -0.433 27.5-118.0 -65.4 137.6 34.7 22.6 18.6 37 63 A P 0 0 122 0, 0.0 -1,-0.1 0, 0.0 14,-0.0 -0.536 360.0 360.0 -72.5 141.2 37.1 22.5 21.5 38 64 A R 0 0 117 -2,-0.2 -2,-0.0 12,-0.0 0, 0.0 -0.349 360.0 360.0-145.7 360.0 36.4 20.1 24.4 39 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 40 66 A T 0 0 157 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 135.7 38.4 17.6 28.1 41 67 A M - 0 0 85 1,-0.1 8,-0.0 8,-0.0 -3,-0.0 -0.501 360.0-134.1-107.3 168.2 38.4 13.9 28.1 42 68 A D - 0 0 112 2,-0.2 -1,-0.1 -2,-0.2 7,-0.0 0.686 45.6-115.1 -94.7 -20.9 38.5 11.1 30.7 43 69 A G S S+ 0 0 74 1,-0.3 -2,-0.0 4,-0.1 0, 0.0 0.600 72.9 118.9 102.5 14.4 41.2 8.8 29.1 44 70 A D > - 0 0 70 3,-0.1 3,-0.7 1,-0.1 -1,-0.3 -0.958 47.5-156.8-112.2 128.1 39.4 5.6 28.3 45 71 A P T 3 S+ 0 0 37 0, 0.0 44,-2.5 0, 0.0 43,-0.2 0.529 85.0 57.0 -88.7 -11.8 39.5 4.8 24.5 46 72 A D T 3 S+ 0 0 48 42,-0.2 41,-0.0 41,-0.1 3,-0.0 0.414 87.3 88.3 -99.1 -3.4 36.5 2.6 24.2 47 73 A T S < S- 0 0 46 -3,-0.7 41,-0.4 1,-0.1 39,-0.1 -0.846 89.5-100.2 -96.4 137.6 34.0 5.1 25.6 48 74 A P - 0 0 80 0, 0.0 39,-0.2 0, 0.0 -2,-0.1 -0.176 33.9-151.2 -56.2 134.4 32.2 7.5 23.1 49 75 A K E - C 0 86B 8 37,-2.8 37,-2.0 -4,-0.1 -8,-0.0 -0.912 22.0-111.6-103.9 131.4 33.7 11.1 23.1 50 76 A P E - C 0 85B 64 0, 0.0 2,-0.3 0, 0.0 35,-0.3 -0.327 39.1-177.9 -56.6 135.3 31.5 14.0 22.3 51 77 A V E + C 0 84B 2 33,-2.6 33,-1.9 2,-0.0 2,-0.3 -0.984 13.8 168.9-128.3 148.8 32.2 15.8 19.0 52 78 A S E + C 0 83B 1 -2,-0.3 -16,-2.5 -16,-0.3 2,-0.3 -0.937 20.0 134.5-152.8 142.1 30.8 18.8 17.3 53 79 A F E -BC 35 82B 0 29,-2.0 29,-3.5 -2,-0.3 2,-0.3 -0.971 43.2-109.7-171.3 169.1 32.3 20.5 14.2 54 80 A T E - C 0 81B 22 -20,-2.2 -21,-2.6 -2,-0.3 -20,-0.5 -0.821 20.8-162.6-116.6 152.7 31.5 22.0 10.9 55 81 A V E -BC 32 80B 1 25,-2.2 25,-2.8 -2,-0.3 2,-0.4 -0.953 7.4-153.9-124.6 152.4 32.4 20.7 7.4 56 82 A K E -BC 31 79B 50 -25,-2.4 -25,-2.5 -2,-0.3 23,-0.2 -0.965 25.0-102.2-131.8 145.3 32.4 22.6 4.2 57 83 A E E -B 30 0B 28 21,-2.3 17,-2.3 -2,-0.4 -27,-0.2 -0.340 37.9-158.9 -61.2 134.2 32.0 21.6 0.6 58 84 A T E -E 73 0C 0 -29,-2.6 15,-0.3 2,-0.3 14,-0.1 -0.574 31.6-107.3-104.8 178.9 35.2 21.5 -1.5 59 85 A V E S+ 0 0 85 13,-2.1 14,-0.1 -2,-0.2 -29,-0.1 0.478 90.5 99.6 -84.2 -5.3 35.9 21.7 -5.2 60 86 A a E S- 0 0 2 12,-0.3 -31,-3.0 -31,-0.3 -2,-0.3 -0.638 82.8-106.9 -83.7 143.7 36.7 18.0 -5.2 61 87 A P E > -B 28 0B 66 0, 0.0 3,-2.4 0, 0.0 -33,-0.3 -0.309 33.7-112.9 -55.5 144.7 34.3 15.2 -6.2 62 88 A R T 3 S+ 0 0 63 -35,-3.2 -34,-0.2 1,-0.3 -32,-0.1 0.869 117.8 45.8 -55.6 -36.8 33.0 13.2 -3.3 63 89 A T T 3 S+ 0 0 105 -36,-0.3 -1,-0.3 -34,-0.1 -35,-0.1 0.326 83.4 134.2 -92.7 9.7 34.9 10.1 -4.5 64 90 A T < - 0 0 21 -3,-2.4 -4,-0.0 1,-0.1 -36,-0.0 -0.111 50.2-149.4 -49.3 151.9 38.2 11.9 -5.2 65 91 A Q + 0 0 190 2,-0.1 -1,-0.1 3,-0.0 2,-0.0 0.492 61.4 116.9-108.7 5.5 41.2 10.2 -3.9 66 92 A Q S S- 0 0 102 1,-0.1 5,-0.1 2,-0.1 -6,-0.0 -0.364 81.6 -98.2 -49.5 137.2 43.0 13.6 -3.5 67 93 A S > - 0 0 58 1,-0.1 3,-2.9 3,-0.1 4,-0.3 -0.407 32.1-119.1 -54.6 134.4 43.9 14.2 0.2 68 94 A P G > S+ 0 0 45 0, 0.0 3,-2.8 0, 0.0 -1,-0.1 0.877 115.0 62.0 -52.9 -34.0 41.2 16.5 1.7 69 95 A E G 3 S+ 0 0 142 1,-0.3 -2,-0.0 3,-0.0 -38,-0.0 0.719 100.1 55.9 -63.2 -22.9 43.9 19.1 2.5 70 96 A D G < S+ 0 0 115 -3,-2.9 2,-0.8 1,-0.1 -1,-0.3 0.369 90.7 87.8 -86.2 3.0 44.4 19.2 -1.3 71 97 A a S < S- 0 0 0 -3,-2.8 -1,-0.1 -4,-0.3 3,-0.1 -0.859 75.0-143.2-110.6 101.7 40.7 20.0 -1.8 72 98 A D - 0 0 115 -2,-0.8 -13,-2.1 1,-0.1 -12,-0.3 -0.281 26.3-104.4 -53.5 140.2 40.1 23.7 -1.7 73 99 A F B -E 58 0C 70 -15,-0.3 -15,-0.3 -14,-0.1 2,-0.2 -0.474 42.2-110.7 -61.6 134.4 36.8 24.9 -0.1 74 100 A K > - 0 0 69 -17,-2.3 3,-2.1 -2,-0.2 2,-0.3 -0.520 31.3-105.0 -65.9 137.5 34.3 25.9 -2.7 75 101 A K T 3 S+ 0 0 174 1,-0.3 -1,-0.1 -2,-0.2 -17,-0.0 -0.517 112.2 10.7 -55.7 124.2 33.5 29.6 -2.9 76 102 A D T 3 S+ 0 0 143 -2,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.657 99.7 178.1 76.9 18.6 30.1 29.9 -1.3 77 103 A G < - 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