==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-JUN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 09-JUL-10 3NW3 . COMPND 2 MOLECULE: PEPTIDOGLYCAN RECOGNITION PROTEIN 1; . SOURCE 2 ORGANISM_SCIENTIFIC: CAMELUS DROMEDARIUS; . AUTHOR P.SHARMA,D.DUBE,M.SINHA,P.KAUR,S.SHARMA,T.P.SINGH . 684 4 12 12 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30438.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 447 65.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 90 13.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 24 3.5 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 . 4 0.6 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 . 36 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 163 23.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 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 5 0 0 2 2 0 0 0 0 0 0 0 4 4 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 4 4 0 4 4 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 . 4 0 4 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 . 0 0 0 0 1 3 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 0 224 0, 0.0 134,-0.1 0, 0.0 133,-0.0 0.000 360.0 360.0 360.0 -32.1 2.0 -13.0 -41.6 2 2 A D - 0 0 85 132,-0.2 0, 0.0 1,-0.2 0, 0.0 -0.848 360.0-155.6-119.6 92.3 0.4 -16.4 -42.5 3 3 A P + 0 0 123 0, 0.0 -1,-0.2 0, 0.0 2,-0.0 0.742 60.2 76.7 -37.1 -66.8 1.8 -17.2 -46.0 4 4 A P S S- 0 0 100 0, 0.0 2,-0.1 0, 0.0 -2,-0.0 -0.287 72.9-131.2 -69.5 134.3 -0.5 -19.6 -47.9 5 5 A A - 0 0 90 1,-0.1 2,-0.3 -2,-0.0 296,-0.0 -0.374 30.7-122.0 -72.2 166.8 -3.8 -18.2 -49.4 6 6 A a - 0 0 49 -2,-0.1 3,-0.4 121,-0.0 292,-0.1 -0.793 32.0 -30.8-137.0 156.6 -7.1 -19.8 -48.8 7 7 A G S S- 0 0 19 -2,-0.3 2,-0.5 1,-0.2 291,-0.1 0.186 76.3 -68.9 50.7-169.3 -10.3 -21.5 -49.9 8 8 A S + 0 0 25 115,-0.1 73,-1.1 290,-0.1 2,-0.4 -0.737 59.9 165.9-123.1 82.1 -12.2 -20.9 -53.1 9 9 A I E -a 81 0A 34 -2,-0.5 73,-0.2 -3,-0.4 71,-0.0 -0.776 37.5-130.8 -96.4 135.1 -13.7 -17.5 -53.0 10 10 A V E -a 82 0A 4 71,-3.9 73,-2.6 -2,-0.4 5,-0.1 -0.789 35.6-138.9 -83.4 113.6 -15.1 -15.9 -56.1 11 11 A P >> - 0 0 46 0, 0.0 4,-1.0 0, 0.0 3,-0.7 -0.151 18.2-101.3 -70.4 171.6 -13.4 -12.5 -56.0 12 12 A R H >>>S+ 0 0 42 1,-0.2 3,-1.7 2,-0.2 5,-1.6 0.963 117.0 56.9 -56.0 -61.6 -15.2 -9.2 -56.8 13 13 A R H 345S+ 0 0 231 1,-0.3 -1,-0.2 3,-0.2 3,-0.2 0.722 108.0 54.8 -46.5 -22.0 -13.8 -8.6 -60.3 14 14 A E H <45S+ 0 0 56 -3,-0.7 -1,-0.3 1,-0.2 -2,-0.2 0.774 109.2 40.0 -88.1 -29.3 -15.3 -12.0 -61.2 15 15 A W H <<5S- 0 0 0 -3,-1.7 -1,-0.2 -4,-1.0 -2,-0.2 0.148 117.5-114.3-101.5 20.0 -18.9 -11.6 -60.1 16 16 A R T <5 - 0 0 192 -4,-0.5 -3,-0.2 -3,-0.2 2,-0.1 0.837 46.9-170.7 51.6 48.4 -18.5 -8.1 -61.6 17 17 A A < - 0 0 20 -5,-1.6 -1,-0.2 -6,-0.1 3,-0.1 -0.367 24.7-114.2 -70.9 140.4 -18.9 -6.2 -58.3 18 18 A L - 0 0 61 1,-0.1 -1,-0.1 36,-0.1 -5,-0.0 -0.356 49.5 -88.5 -65.2 154.1 -19.3 -2.4 -58.2 19 19 A A - 0 0 78 1,-0.1 2,-0.4 49,-0.1 -1,-0.1 -0.237 45.2-114.5 -63.0 156.7 -16.3 -0.8 -56.5 20 20 A S - 0 0 32 -3,-0.1 48,-0.2 1,-0.1 -1,-0.1 -0.780 20.9-168.7 -97.7 139.4 -16.5 -0.4 -52.8 21 21 A E + 0 0 144 46,-3.0 2,-0.4 -2,-0.4 47,-0.2 -0.074 52.8 120.3-112.2 28.7 -16.7 3.0 -51.1 22 22 A b + 0 0 9 45,-0.3 -2,-0.1 1,-0.1 69,-0.0 -0.778 24.4 157.5 -96.8 140.0 -16.1 1.5 -47.7 23 23 A R + 0 0 197 -2,-0.4 2,-0.3 2,-0.1 -1,-0.1 0.600 36.5 106.9-132.7 -27.1 -13.1 2.5 -45.6 24 24 A E - 0 0 149 66,-0.1 66,-2.5 65,-0.1 2,-0.1 -0.455 61.2-148.0 -63.1 119.0 -13.8 1.7 -41.9 25 25 A R B -G 89 0B 176 -2,-0.3 2,-0.4 64,-0.2 64,-0.3 -0.325 5.6-119.8 -89.2 167.4 -11.6 -1.4 -41.0 26 26 A L - 0 0 11 62,-2.9 2,-0.6 -2,-0.1 75,-0.1 -0.847 24.9-118.3-106.4 142.6 -12.0 -4.3 -38.7 27 27 A T - 0 0 123 73,-0.5 61,-0.0 -2,-0.4 0, 0.0 -0.712 48.6-106.8 -79.7 121.5 -9.6 -5.2 -35.9 28 28 A R S S+ 0 0 104 -2,-0.6 108,-0.1 1,-0.1 109,-0.1 -0.748 98.2 46.7 -92.2 143.1 -8.1 -8.6 -36.7 29 29 A P S S- 0 0 51 0, 0.0 108,-0.3 0, 0.0 2,-0.2 0.524 81.5-154.1 -85.3 144.7 -8.7 -11.2 -35.4 30 30 A V E -b 137 0A 6 106,-3.5 108,-2.5 1,-0.1 72,-0.1 -0.565 4.3-156.2 -81.3 144.7 -12.4 -10.9 -35.4 31 31 A R E + 0 0 5 70,-0.6 111,-2.5 -2,-0.2 2,-0.3 0.814 64.3 50.7 -93.4 -33.9 -14.3 -12.8 -32.7 32 32 A Y E -bc 142 102A 5 69,-1.4 71,-1.5 109,-0.2 2,-0.4 -0.734 50.2-166.2-113.9 158.6 -17.8 -13.3 -34.1 33 33 A V E -bc 143 103A 0 109,-1.9 111,-3.2 -2,-0.3 2,-0.6 -0.989 12.2-159.0-136.8 123.6 -19.5 -14.5 -37.2 34 34 A V E -bc 144 104A 2 69,-2.4 71,-1.7 -2,-0.4 2,-0.5 -0.938 9.0-147.9-112.1 122.4 -23.2 -13.8 -37.8 35 35 A V E +bc 145 105A 0 109,-2.6 111,-1.6 -2,-0.6 2,-0.2 -0.761 26.5 162.6 -92.9 125.5 -25.0 -16.1 -40.2 36 36 A S E - c 0 106A 4 69,-2.3 71,-2.7 -2,-0.5 2,-0.4 -0.784 30.4-133.7-131.5 172.1 -27.8 -14.6 -42.2 37 37 A H E - c 0 107A 17 69,-0.3 71,-0.2 -2,-0.2 73,-0.1 -0.960 17.6-133.5-128.1 146.5 -29.8 -15.3 -45.4 38 38 A T - 0 0 24 69,-1.9 72,-0.2 -2,-0.4 70,-0.1 0.793 25.7-144.9 -67.6 -31.1 -30.6 -12.7 -48.0 39 39 A A + 0 0 49 70,-3.6 71,-0.3 68,-0.5 69,-0.1 0.646 69.3 101.0 71.3 15.1 -34.2 -13.8 -48.1 40 40 A G S S- 0 0 40 69,-0.5 -1,-0.2 1,-0.2 2,-0.2 -0.028 84.2 -36.0-104.1-148.3 -34.0 -13.1 -51.8 41 41 A S - 0 0 77 68,-0.2 -1,-0.2 -3,-0.1 2,-0.2 -0.467 52.7-137.1 -80.2 146.0 -33.6 -15.5 -54.7 42 42 A H - 0 0 85 -2,-0.2 2,-0.3 -3,-0.1 67,-0.2 -0.594 18.5-166.2 -95.2 163.4 -31.5 -18.6 -54.6 43 43 A c - 0 0 7 65,-0.5 34,-1.4 -2,-0.2 35,-0.2 -0.989 16.5-169.0-148.7 143.5 -29.2 -19.7 -57.4 44 44 A D + 0 0 78 -2,-0.3 175,-0.3 33,-0.2 3,-0.1 0.022 65.5 67.0-128.9 31.5 -27.4 -22.9 -58.2 45 45 A T S > S- 0 0 35 172,-0.1 4,-2.7 1,-0.1 3,-0.5 -0.985 83.6-115.9-146.4 141.4 -25.0 -22.2 -61.0 46 46 A P H > S+ 0 0 9 0, 0.0 4,-1.9 0, 0.0 5,-0.2 0.861 116.0 49.0 -43.6 -43.2 -21.9 -19.9 -61.0 47 47 A A H > S+ 0 0 79 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.878 113.1 43.4 -69.1 -41.2 -23.6 -17.6 -63.5 48 48 A S H > S+ 0 0 42 -3,-0.5 4,-2.0 1,-0.2 -1,-0.2 0.823 117.0 48.5 -73.6 -30.6 -26.9 -17.2 -61.8 49 49 A c H X S+ 0 0 0 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.787 106.0 54.9 -79.1 -29.7 -25.1 -16.8 -58.4 50 50 A A H X S+ 0 0 23 -4,-1.9 4,-2.0 -5,-0.3 -2,-0.2 0.904 111.1 49.2 -67.0 -38.4 -22.7 -14.2 -59.7 51 51 A Q H X S+ 0 0 95 -4,-1.4 4,-2.8 1,-0.2 -2,-0.2 0.942 107.6 51.6 -63.0 -51.1 -25.8 -12.4 -60.8 52 52 A Q H X S+ 0 0 26 -4,-2.0 4,-2.9 1,-0.2 -1,-0.2 0.841 107.7 53.0 -57.8 -36.7 -27.5 -12.7 -57.4 53 53 A A H X S+ 0 0 0 -4,-1.8 4,-3.5 2,-0.2 -1,-0.2 0.964 109.8 48.4 -61.6 -50.2 -24.4 -11.3 -55.7 54 54 A Q H X S+ 0 0 61 -4,-2.0 4,-2.9 1,-0.2 -2,-0.2 0.909 111.3 51.4 -53.9 -45.6 -24.6 -8.4 -58.1 55 55 A N H X S+ 0 0 74 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.930 112.7 44.4 -58.5 -49.9 -28.4 -8.0 -57.2 56 56 A V H X S+ 0 0 16 -4,-2.9 4,-1.5 2,-0.2 14,-0.2 0.931 114.7 48.4 -65.0 -44.1 -27.7 -8.1 -53.5 57 57 A Q H >X S+ 0 0 1 -4,-3.5 4,-2.5 1,-0.2 3,-1.1 0.986 112.3 49.1 -57.1 -58.6 -24.7 -5.6 -53.8 58 58 A S H 3X>S+ 0 0 44 -4,-2.9 4,-1.7 1,-0.3 5,-0.9 0.835 108.5 53.0 -48.4 -42.4 -26.7 -3.2 -56.0 59 59 A Y H 3<>S+ 0 0 122 -4,-2.1 5,-1.2 -5,-0.2 -1,-0.3 0.820 111.7 45.9 -67.4 -29.9 -29.7 -3.2 -53.6 60 60 A H H <<5S+ 0 0 13 -4,-1.5 6,-2.9 -3,-1.1 -2,-0.2 0.877 124.4 33.3 -78.1 -38.8 -27.5 -2.3 -50.6 61 61 A V H X5S+ 0 0 37 -4,-2.5 4,-1.1 4,-0.3 -2,-0.2 0.982 125.5 33.6 -80.1 -70.0 -25.7 0.4 -52.6 62 62 A R T <5S+ 0 0 171 -4,-1.7 -3,-0.2 1,-0.2 -2,-0.1 0.877 133.5 27.0 -57.7 -41.9 -28.1 2.0 -55.0 63 63 A N T 4 - 0 0 0 4,-2.7 3,-1.1 -2,-0.5 47,-0.1 -0.531 25.4-128.8 -94.5 161.8 -24.3 -19.5 -53.2 77 77 A E T 3 S+ 0 0 3 -34,-1.4 -33,-0.2 1,-0.3 43,-0.1 0.400 108.1 76.1 -86.1 4.9 -26.3 -22.8 -53.6 78 78 A D T 3 S- 0 0 0 -35,-0.2 -1,-0.3 2,-0.2 -34,-0.1 0.486 120.2-110.2 -87.1 -5.6 -23.9 -23.4 -56.4 79 79 A G S < S+ 0 0 4 -3,-1.1 2,-0.3 1,-0.3 -2,-0.1 0.587 77.8 121.4 88.5 14.4 -21.5 -24.2 -53.6 80 80 A L - 0 0 5 172,-0.0 -4,-2.7 -71,-0.0 2,-0.4 -0.816 58.0-129.2-114.0 151.7 -19.2 -21.1 -54.0 81 81 A V E -aD 9 75A 7 -73,-1.1 -71,-3.9 -2,-0.3 2,-0.5 -0.790 21.2-151.0 -95.6 136.4 -18.2 -18.3 -51.6 82 82 A Y E -aD 10 74A 2 -8,-3.7 -8,-2.6 -2,-0.4 2,-0.2 -0.945 18.4-119.6-114.2 123.9 -18.6 -14.7 -53.0 83 83 A E E + D 0 73A 61 -73,-2.6 -10,-0.2 -2,-0.5 -68,-0.1 -0.411 39.3 165.5 -65.2 122.8 -16.3 -11.9 -51.8 84 84 A G S S- 0 0 0 -12,-1.7 -12,-0.3 -2,-0.2 -11,-0.2 0.372 74.6 -33.7-102.7-121.0 -18.3 -9.1 -50.1 85 85 A R S > S- 0 0 21 -14,-1.6 4,-0.5 1,-0.2 3,-0.3 0.739 93.8-152.6 -75.5 -19.5 -16.4 -6.6 -48.1 86 86 A G T 4 - 0 0 2 -14,-2.1 -1,-0.2 -15,-0.2 -13,-0.0 -0.467 34.5 -41.4 87.6-157.4 -14.1 -9.4 -47.1 87 87 A W T 4 S+ 0 0 24 -2,-0.1 -1,-0.2 1,-0.1 -57,-0.1 0.762 129.1 43.3 -82.7 -32.3 -12.0 -9.9 -43.9 88 88 A N T 4 S+ 0 0 56 -3,-0.3 -62,-2.9 -63,-0.1 2,-0.4 0.713 96.2 79.6 -93.7 -20.4 -10.6 -6.4 -43.3 89 89 A I B < S-G 25 0B 31 -4,-0.5 -64,-0.2 -64,-0.3 -4,-0.1 -0.741 78.6-120.3 -97.2 134.9 -13.6 -4.1 -43.9 90 90 A K - 0 0 56 -66,-2.5 2,-0.2 -2,-0.4 -66,-0.1 -0.416 35.4-153.6 -67.0 140.5 -16.4 -3.5 -41.4 91 91 A G - 0 0 0 8,-0.7 2,-0.5 11,-0.3 3,-0.2 -0.621 15.8-126.9-113.4 173.5 -19.8 -4.6 -42.8 92 92 A A + 0 0 26 -22,-1.2 -22,-0.1 -2,-0.2 -24,-0.0 -0.864 69.0 100.6-122.5 94.3 -23.3 -3.6 -42.2 93 93 A H S S+ 0 0 21 -2,-0.5 -1,-0.1 2,-0.2 -22,-0.1 0.483 81.2 33.6-147.2 -19.8 -25.5 -6.6 -41.5 94 94 A A S > S- 0 0 1 1,-0.2 4,-0.5 -3,-0.2 3,-0.2 0.260 105.2 -91.3-131.2 15.0 -26.1 -7.0 -37.8 95 95 A G H > - 0 0 13 1,-0.2 4,-3.4 2,-0.1 -1,-0.2 0.032 50.2 -65.5 94.9 156.7 -26.4 -3.6 -36.2 96 96 A P H 4 S+ 0 0 115 0, 0.0 -1,-0.2 0, 0.0 -4,-0.0 0.709 128.4 55.6 -53.5 -26.9 -24.0 -1.1 -34.5 97 97 A T H 4 S+ 0 0 74 -3,-0.2 4,-0.3 52,-0.1 -2,-0.1 0.985 122.2 24.9 -69.5 -54.0 -23.3 -3.4 -31.6 98 98 A W H >X S+ 0 0 22 -4,-0.5 3,-1.0 -3,-0.2 4,-0.6 0.783 102.6 77.6 -82.8 -32.4 -22.2 -6.2 -33.8 99 99 A N T 3< S+ 0 0 13 -4,-3.4 -8,-0.7 1,-0.3 3,-0.3 0.780 97.7 46.2 -55.5 -31.1 -20.9 -4.7 -37.1 100 100 A P T 34 S+ 0 0 55 0, 0.0 -73,-0.5 0, 0.0 -1,-0.3 0.747 118.7 40.2 -86.0 -17.7 -17.6 -3.6 -35.7 101 101 A I T <4 S+ 0 0 27 -3,-1.0 -69,-1.4 -4,-0.3 -70,-0.6 0.231 110.9 58.7-111.8 15.6 -16.8 -6.8 -33.9 102 102 A S E < -c 32 0A 0 -4,-0.6 2,-0.4 -3,-0.3 -11,-0.3 -0.846 64.5-127.9-140.2 176.0 -18.0 -9.4 -36.4 103 103 A I E -c 33 0A 0 -71,-1.5 -69,-2.4 -2,-0.3 2,-0.5 -0.989 28.1-152.9-119.8 126.9 -17.9 -11.0 -39.9 104 104 A G E -c 34 0A 0 -2,-0.4 -32,-1.9 -71,-0.2 -31,-1.6 -0.919 13.4-178.2-108.9 124.3 -21.3 -11.4 -41.5 105 105 A I E -ce 35 73A 0 -71,-1.7 -69,-2.3 -2,-0.5 2,-0.4 -0.970 9.1-159.6-118.9 136.4 -21.8 -14.1 -44.1 106 106 A S E -ce 36 74A 0 -33,-2.3 -31,-2.9 -2,-0.4 2,-0.6 -0.944 14.6-139.7-121.4 137.1 -25.1 -14.5 -45.9 107 107 A F E -ce 37 75A 1 -71,-2.7 -69,-1.9 -2,-0.4 2,-1.1 -0.843 31.2-123.5 -90.6 117.6 -26.6 -17.5 -47.7 108 108 A M S S+ 0 0 0 -33,-2.4 -65,-0.5 -2,-0.6 2,-0.3 -0.490 77.7 43.5 -69.4 97.2 -28.3 -16.2 -50.9 109 109 A G S S- 0 0 0 -2,-1.1 -70,-3.6 -67,-0.2 -69,-0.5 -0.961 91.3 -77.2 160.4-172.2 -31.8 -17.4 -50.6 110 110 A N - 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