==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IRON TRANSPORT 19-JUN-93 1LCT . COMPND 2 MOLECULE: LACTOFERRIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.L.DAY,B.F.ANDERSON,E.N.BAKER . 324 1 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14159.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 208 64.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 39 12.0 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 17 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 74 22.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.5 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 2 2 0 2 1 1 1 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 2 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 PARALLEL BRIDGES PER LADDER . 0 3 2 3 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 1 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 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 4 A R 0 0 114 0, 0.0 2,-0.3 0, 0.0 30,-0.0 0.000 360.0 360.0 360.0-156.2 12.6 34.0 76.2 2 5 A S - 0 0 37 2,-0.0 2,-0.6 27,-0.0 29,-0.2 -0.834 360.0-117.8-179.0 144.4 12.9 32.6 72.7 3 6 A V E -a 31 0A 4 27,-1.8 29,-2.8 -2,-0.3 2,-0.7 -0.777 36.7-140.2 -87.2 120.9 15.4 32.0 70.1 4 7 A Q E -a 32 0A 34 -2,-0.6 48,-2.4 27,-0.2 49,-1.5 -0.818 15.9-148.5 -86.8 118.3 14.3 34.2 67.2 5 8 A W E -ab 33 53A 2 27,-5.7 29,-2.8 -2,-0.7 2,-0.6 -0.676 6.6-134.7 -86.2 141.4 14.8 32.3 63.9 6 9 A a E -a 34 0A 1 47,-2.6 2,-0.4 -2,-0.3 49,-0.3 -0.864 19.1-168.0 -97.9 113.7 15.6 34.3 60.7 7 10 A A E -a 35 0A 0 27,-2.7 29,-3.2 -2,-0.6 31,-0.2 -0.829 14.5-157.9 -99.7 139.9 13.6 33.2 57.5 8 11 A V S S+ 0 0 39 -2,-0.4 2,-0.3 27,-0.2 27,-0.1 0.154 76.1 23.0 -98.1 15.2 14.7 34.6 54.0 9 12 A S S > S- 0 0 21 1,-0.1 4,-3.0 29,-0.1 5,-0.2 -0.984 83.2-101.1-170.2 161.6 11.3 34.0 52.5 10 13 A N H > S+ 0 0 110 -2,-0.3 4,-3.5 1,-0.2 5,-0.2 0.865 120.1 49.4 -62.1 -36.2 7.6 33.7 53.2 11 14 A P H > S+ 0 0 36 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.877 111.3 49.1 -73.8 -31.1 7.6 30.0 52.9 12 15 A E H > S+ 0 0 22 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.909 112.5 48.5 -69.1 -43.8 10.5 29.8 55.2 13 16 A A H X S+ 0 0 2 -4,-3.0 4,-2.3 1,-0.2 3,-0.3 0.957 110.4 54.1 -58.5 -46.6 8.5 32.2 57.6 14 17 A T H X S+ 0 0 63 -4,-3.5 4,-1.4 1,-0.3 -1,-0.2 0.889 109.8 44.4 -54.6 -42.9 5.5 29.8 57.1 15 18 A K H X S+ 0 0 4 -4,-1.9 4,-1.6 2,-0.2 -1,-0.3 0.814 107.9 59.2 -70.3 -32.9 7.4 26.8 58.1 16 19 A b H X S+ 0 0 0 -4,-1.9 4,-2.4 -3,-0.3 -2,-0.2 0.932 105.6 50.3 -60.8 -46.7 8.9 28.8 61.1 17 20 A F H X S+ 0 0 81 -4,-2.3 4,-2.4 1,-0.3 -1,-0.2 0.849 110.8 47.9 -59.3 -41.4 5.3 29.4 62.4 18 21 A Q H X S+ 0 0 85 -4,-1.4 4,-1.7 -5,-0.2 -1,-0.3 0.827 109.8 52.9 -69.5 -35.0 4.5 25.8 62.2 19 22 A W H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.944 111.4 46.9 -61.8 -49.1 7.8 25.0 63.9 20 23 A Q H X S+ 0 0 34 -4,-2.4 4,-1.4 1,-0.2 -2,-0.2 0.875 111.0 51.8 -58.8 -45.2 6.8 27.4 66.8 21 24 A R H X S+ 0 0 145 -4,-2.4 4,-1.7 -5,-0.2 -1,-0.2 0.874 111.2 45.9 -68.2 -27.7 3.5 26.0 67.0 22 25 A N H X S+ 0 0 18 -4,-1.7 4,-1.0 2,-0.2 -2,-0.2 0.817 107.0 56.5 -81.4 -31.8 4.7 22.4 67.3 23 26 A M H <>S+ 0 0 1 -4,-2.3 5,-3.9 2,-0.2 -1,-0.2 0.870 111.3 48.2 -62.6 -34.3 7.4 23.2 69.9 24 27 A R H ><5S+ 0 0 160 -4,-1.4 3,-1.7 3,-0.2 -2,-0.2 0.938 107.1 51.5 -67.8 -53.6 4.5 24.6 71.9 25 28 A K H 3<5S+ 0 0 87 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.700 115.8 44.8 -57.9 -22.3 2.1 21.7 71.5 26 29 A V T 3<5S- 0 0 48 -4,-1.0 -1,-0.3 -5,-0.1 -2,-0.2 0.377 110.9-122.5-105.0 -3.5 5.1 19.5 72.7 27 30 A R T < 5 + 0 0 218 -3,-1.7 -3,-0.2 1,-0.2 -2,-0.1 0.894 63.0 143.3 59.5 45.2 6.0 21.8 75.5 28 31 A G < - 0 0 23 -5,-3.9 -1,-0.2 1,-0.2 239,-0.1 -0.457 58.7 -54.2-105.6-177.8 9.6 22.2 74.2 29 32 A P - 0 0 23 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.141 68.9-104.4 -54.6 135.8 12.0 25.0 74.0 30 33 A P - 0 0 73 0, 0.0 -27,-1.8 0, 0.0 2,-0.4 -0.545 33.2-171.3 -81.8 145.1 10.5 28.1 72.4 31 34 A V E -a 3 0A 3 -2,-0.3 2,-0.3 -29,-0.2 -27,-0.2 -0.979 1.6-168.0-129.2 136.1 11.2 29.4 68.9 32 35 A S E -a 4 0A 16 -29,-2.8 -27,-5.7 -2,-0.4 2,-0.4 -0.884 15.9-124.6-125.3 156.5 10.1 32.7 67.3 33 36 A b E +a 5 0A 20 -2,-0.3 2,-0.3 -29,-0.3 -27,-0.2 -0.937 19.0 179.7-118.5 122.0 10.1 34.0 63.7 34 37 A I E -a 6 0A 8 -29,-2.8 -27,-2.7 -2,-0.4 2,-0.6 -0.867 23.6-141.9-108.3 132.9 11.6 37.1 61.9 35 38 A K E +a 7 0A 56 -2,-0.3 2,-0.2 -29,-0.2 -27,-0.2 -0.932 29.6 160.5-110.7 117.2 11.1 37.5 58.0 36 39 A R - 0 0 66 -29,-3.2 -23,-0.1 -2,-0.6 4,-0.0 -0.537 38.5-128.8-114.7-177.9 13.8 38.8 56.0 37 40 A D S S+ 0 0 110 -2,-0.2 -29,-0.1 1,-0.2 -27,-0.0 0.410 78.2 13.4-119.4 -3.6 14.6 38.6 52.2 38 41 A S S > S- 0 0 34 -31,-0.2 4,-1.9 1,-0.1 5,-0.2 -0.992 79.0 -96.0-161.7 171.7 18.1 37.4 51.9 39 42 A P H > S+ 0 0 18 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.845 121.3 52.0 -60.9 -31.3 21.0 35.9 53.8 40 43 A I H > S+ 0 0 58 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.898 105.4 50.5 -70.7 -48.0 22.4 39.4 54.3 41 44 A Q H > S+ 0 0 76 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.884 115.3 46.4 -58.3 -42.6 19.3 41.0 55.8 42 45 A a H X S+ 0 0 0 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.913 108.6 54.4 -68.6 -38.7 19.3 38.0 58.2 43 46 A I H X S+ 0 0 0 -4,-1.8 4,-1.4 -5,-0.2 -2,-0.2 0.883 114.2 41.6 -59.5 -40.1 23.0 38.4 58.8 44 47 A Q H X S+ 0 0 80 -4,-2.3 4,-3.1 2,-0.2 -2,-0.2 0.906 109.6 58.0 -69.4 -48.5 22.5 42.1 59.9 45 48 A A H <>S+ 0 0 1 -4,-2.7 5,-3.6 1,-0.3 6,-1.0 0.859 111.7 42.7 -48.5 -44.0 19.3 41.3 61.8 46 49 A I H ><5S+ 0 0 0 -4,-1.9 3,-1.3 3,-0.3 -1,-0.3 0.868 112.0 53.1 -72.2 -40.9 21.2 38.9 64.0 47 50 A A H 3<5S+ 0 0 33 -4,-1.4 -2,-0.2 1,-0.3 -1,-0.2 0.911 116.0 39.9 -61.5 -41.2 24.1 41.2 64.3 48 51 A E T 3<5S- 0 0 134 -4,-3.1 -1,-0.3 -5,-0.1 -2,-0.2 0.100 119.6-108.4 -97.8 20.6 21.9 43.9 65.4 49 52 A N T < 5S+ 0 0 99 -3,-1.3 -3,-0.3 2,-0.2 -4,-0.1 0.583 84.0 118.7 66.3 17.4 19.7 41.7 67.6 50 53 A R S > - 0 0 11 -2,-0.4 3,-1.9 193,-0.2 4,-1.7 -0.396 46.9 -98.8 -74.6 155.0 25.9 28.1 53.1 58 61 A G H 3> S+ 0 0 8 190,-0.3 4,-1.3 1,-0.3 5,-0.1 0.783 121.6 58.4 -48.6 -36.2 29.8 28.4 53.5 59 62 A G H 3> S+ 0 0 3 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.790 111.7 43.1 -68.5 -22.0 30.1 31.5 51.3 60 63 A F H <> S+ 0 0 23 -3,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.769 105.9 58.5 -90.9 -28.4 27.7 33.3 53.7 61 64 A I H X S+ 0 0 2 -4,-1.7 4,-1.6 1,-0.2 -2,-0.2 0.822 107.8 53.9 -64.7 -27.0 29.3 31.9 56.9 62 65 A Y H < S+ 0 0 104 -4,-1.3 4,-0.2 -5,-0.3 -2,-0.2 0.961 109.1 43.0 -70.1 -50.1 32.3 33.6 55.4 63 66 A E H >< S+ 0 0 51 -4,-1.1 3,-0.6 1,-0.2 6,-0.2 0.805 113.7 52.1 -64.9 -32.2 30.6 37.0 55.0 64 67 A A H 3< S+ 0 0 1 -4,-2.1 7,-2.3 1,-0.2 -1,-0.2 0.889 98.5 63.7 -73.1 -40.0 29.0 36.8 58.5 65 68 A G T 3< S+ 0 0 23 -4,-1.6 2,-0.2 5,-0.3 -1,-0.2 0.487 93.6 87.6 -62.9 -6.5 32.3 36.1 60.3 66 69 A L S X> S- 0 0 65 -3,-0.6 3,-2.4 -4,-0.2 4,-1.8 -0.644 85.1 -67.2 -95.6 160.2 33.5 39.5 59.1 67 70 A A T 34 S+ 0 0 84 1,-0.4 -1,-0.1 2,-0.3 -2,-0.0 -0.432 116.1 39.1 -74.2 150.7 33.1 42.8 60.7 68 71 A P T 34 S+ 0 0 110 0, 0.0 -1,-0.4 0, 0.0 -4,-0.1 -0.920 132.7 34.2 -78.9 17.9 30.8 44.5 61.3 69 72 A Y T <4 - 0 0 58 -3,-2.4 187,-0.4 -6,-0.2 -2,-0.3 0.838 63.9-173.6-101.1 -38.8 29.0 41.2 62.1 70 73 A K < + 0 0 30 -4,-1.8 186,-0.3 -7,-0.2 -5,-0.3 0.794 25.6 171.1 45.9 36.3 31.6 38.9 63.6 71 74 A L - 0 0 4 -7,-2.3 242,-0.4 -5,-0.4 184,-0.2 -0.297 17.4-150.9 -70.0 159.0 28.9 36.0 63.5 72 75 A R E -D 254 0B 6 182,-2.4 182,-1.8 240,-0.1 2,-0.2 -0.994 18.8-109.6-138.6 138.5 30.1 32.5 64.4 73 76 A P E +D 253 0B 1 0, 0.0 180,-0.3 0, 0.0 238,-0.1 -0.547 34.3 175.3 -65.7 134.9 28.9 29.0 63.3 74 77 A V E + 0 0 7 178,-3.3 233,-2.8 1,-0.3 2,-0.3 0.752 63.9 12.2-106.8 -37.6 27.2 27.2 66.3 75 78 A A E -DE 252 306B 0 177,-0.7 177,-2.3 231,-0.3 2,-0.3 -0.993 68.5-142.1-142.3 137.3 25.8 23.8 64.9 76 79 A A E -DE 251 305B 4 229,-3.3 229,-2.1 -2,-0.3 175,-0.2 -0.787 23.8-114.1-101.0 150.7 26.6 22.2 61.7 77 80 A E E - E 0 304B 1 173,-2.6 2,-0.4 -2,-0.3 227,-0.2 -0.548 30.1-133.6 -77.6 157.2 24.1 20.4 59.7 78 81 A V E - E 0 303B 17 225,-2.4 224,-2.4 -2,-0.2 225,-0.9 -0.926 24.3-176.4-113.2 130.8 24.7 16.7 59.4 79 82 A Y E +F 86 0C 4 7,-3.1 7,-3.5 -2,-0.4 2,-0.3 -0.663 42.6 45.9-116.4 175.5 24.4 14.8 56.0 80 83 A G E S-F 85 0C 32 5,-0.2 2,-0.3 -2,-0.2 -2,-0.1 -0.684 95.8 -40.7 94.9-152.7 24.7 11.4 55.0 81 84 A T - 0 0 66 3,-2.1 -2,-0.1 -2,-0.3 221,-0.1 -0.701 44.0-115.6-112.4 163.2 23.1 8.5 56.8 82 85 A E S S+ 0 0 92 -2,-0.3 -1,-0.1 1,-0.2 -3,-0.0 0.809 124.7 50.1 -64.1 -28.9 22.7 7.8 60.4 83 86 A R S S+ 0 0 109 1,-0.3 -1,-0.2 0, 0.0 -3,-0.0 0.867 129.3 17.5 -79.0 -38.0 24.9 4.9 59.5 84 87 A Q S S+ 0 0 120 2,-0.0 -3,-2.1 0, 0.0 -1,-0.3 -0.732 86.5 178.2-139.5 82.0 27.5 7.0 57.8 85 88 A P E -F 80 0C 72 0, 0.0 2,-0.3 0, 0.0 -5,-0.2 -0.614 1.9-177.9 -89.7 146.9 26.9 10.6 58.9 86 89 A R E -F 79 0C 46 -7,-3.5 -7,-3.1 -2,-0.3 -2,-0.0 -0.989 32.2-152.3-149.4 150.0 29.0 13.5 57.9 87 90 A T S S+ 0 0 62 -2,-0.3 162,-2.5 -9,-0.2 2,-0.3 -0.027 81.6 58.1-111.4 39.9 29.4 17.2 58.4 88 91 A H E -G 248 0D 38 160,-0.3 2,-0.3 -9,-0.1 -9,-0.1 -0.949 63.1-159.9-149.6 166.1 30.9 18.0 55.0 89 92 A Y E -G 247 0D 0 158,-3.1 158,-3.0 -2,-0.3 2,-0.5 -0.894 22.5-101.3-143.3 176.4 29.8 17.6 51.4 90 93 A Y E -G 246 0D 20 -2,-0.3 118,-1.4 156,-0.2 2,-0.6 -0.910 16.2-145.4-113.0 129.9 31.3 17.5 47.9 91 94 A A E +GH 245 207D 0 154,-2.0 153,-2.4 -2,-0.5 154,-1.0 -0.821 35.9 175.3 -85.0 116.1 31.3 20.3 45.3 92 95 A V E - 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