==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-MAR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 25-FEB-11 3QV4 . COMPND 2 MOLECULE: PEPTIDOGLYCAN RECOGNITION PROTEIN 1; . SOURCE 2 ORGANISM_SCIENTIFIC: CAMELUS DROMEDARIUS; . AUTHOR P.K.SHUKLA,P.SHARMA,M.SINHA,P.KAUR,S.SHARMA,T.P.SINGH . 686 5 12 12 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30570.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 444 64.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 90 13.1 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 . 37 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 59 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 164 23.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 2.2 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 6 0 0 3 0 1 0 0 0 0 0 1 2 5 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 2 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 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 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, 0.0 133,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 58.8 1.7 -13.4 -41.7 2 2 A D + 0 0 124 132,-0.2 0, 0.0 1,-0.1 0, 0.0 -0.920 360.0 157.3-118.5 104.0 0.0 -16.6 -42.9 3 3 A P + 0 0 115 0, 0.0 -1,-0.1 0, 0.0 131,-0.1 0.097 40.2 95.3-114.0 24.5 -1.3 -16.2 -46.5 4 4 A P + 0 0 98 0, 0.0 -2,-0.1 0, 0.0 297,-0.0 0.425 63.0 20.4 -88.9-135.8 -1.6 -19.8 -47.9 5 5 A A S S+ 0 0 40 296,-0.2 2,-0.2 295,-0.1 293,-0.1 0.096 71.4 125.8 -34.7 117.1 -4.1 -22.6 -48.3 6 6 A a - 0 0 43 292,-0.1 295,-0.1 -3,-0.1 296,-0.1 -0.743 52.7 -59.7-167.6 174.0 -7.5 -21.6 -48.2 7 7 A G - 0 0 32 119,-0.3 2,-0.3 -2,-0.2 172,-0.1 0.397 42.0-111.6 -39.4 166.5 -10.8 -21.7 -50.1 8 8 A S - 0 0 35 287,-0.0 2,-0.3 283,-0.0 73,-0.3 -0.793 31.7-176.4-103.4 147.5 -12.0 -20.5 -53.4 9 9 A I - 0 0 43 -2,-0.3 73,-0.2 71,-0.1 71,-0.0 -0.996 34.9-112.5-144.9 137.9 -14.4 -17.6 -53.7 10 10 A V B -a 82 0A 7 71,-3.3 73,-2.4 -2,-0.3 2,-0.1 -0.632 48.2-131.1 -71.5 121.7 -16.1 -16.1 -56.8 11 11 A P >> - 0 0 47 0, 0.0 4,-1.4 0, 0.0 3,-0.8 -0.390 15.7-103.4 -78.8 159.4 -14.4 -12.7 -56.8 12 12 A R G >4>S+ 0 0 46 1,-0.3 5,-1.6 2,-0.2 3,-0.6 0.854 118.9 49.3 -41.0 -57.9 -16.1 -9.3 -57.1 13 13 A R G >45S+ 0 0 233 1,-0.2 3,-1.5 3,-0.2 -1,-0.3 0.855 104.1 60.4 -55.8 -38.8 -15.2 -8.7 -60.7 14 14 A E G <45S+ 0 0 58 -3,-0.8 -1,-0.2 1,-0.3 -2,-0.2 0.841 105.5 45.9 -63.4 -35.1 -16.3 -12.2 -61.8 15 15 A W G <<5S- 0 0 2 -4,-1.4 -1,-0.3 -3,-0.6 -2,-0.2 0.397 117.3-116.3 -90.4 14.2 -19.9 -11.6 -60.7 16 16 A R T < 5 - 0 0 194 -3,-1.5 -3,-0.2 -4,-0.2 2,-0.2 0.871 49.3-179.3 57.4 47.3 -19.8 -8.2 -62.4 17 17 A A < - 0 0 21 -5,-1.6 -1,-0.2 1,-0.1 3,-0.1 -0.473 31.6-112.2 -80.8 141.5 -20.2 -6.2 -59.3 18 18 A L - 0 0 60 -2,-0.2 -1,-0.1 1,-0.1 2,-0.0 -0.383 52.3 -87.6 -65.7 150.1 -20.4 -2.4 -59.1 19 19 A A - 0 0 76 1,-0.1 2,-0.2 49,-0.1 -1,-0.1 -0.308 43.9-115.1 -62.9 145.1 -17.3 -1.1 -57.3 20 20 A S - 0 0 25 1,-0.1 48,-0.2 -3,-0.1 -1,-0.1 -0.519 22.3-171.3 -81.7 148.0 -17.5 -0.7 -53.5 21 21 A E + 0 0 134 46,-2.2 2,-0.2 -2,-0.2 47,-0.2 0.067 49.2 120.8-121.0 16.3 -17.4 2.7 -51.9 22 22 A b + 0 0 8 45,-0.4 -2,-0.1 1,-0.1 69,-0.0 -0.581 26.5 163.4 -81.4 148.0 -17.2 1.3 -48.4 23 23 A R + 0 0 188 -2,-0.2 2,-0.3 67,-0.1 -1,-0.1 0.518 35.4 107.0-139.7 -16.0 -14.1 2.2 -46.4 24 24 A E - 0 0 146 66,-0.1 66,-2.0 65,-0.1 2,-0.2 -0.546 59.0-144.0 -74.0 129.0 -14.8 1.5 -42.7 25 25 A R B -G 89 0B 154 -2,-0.3 64,-0.3 64,-0.2 2,-0.2 -0.584 4.6-128.2 -97.5 153.5 -12.8 -1.6 -41.5 26 26 A L - 0 0 15 62,-2.7 2,-0.6 -2,-0.2 75,-0.1 -0.549 32.7-110.0 -89.3 159.1 -13.4 -4.4 -39.1 27 27 A T - 0 0 119 73,-0.4 -1,-0.0 -2,-0.2 62,-0.0 -0.841 45.9 -97.5 -97.0 126.5 -10.9 -5.2 -36.4 28 28 A R S S+ 0 0 134 -2,-0.6 108,-0.1 1,-0.2 109,-0.1 -0.665 101.5 37.8 -81.9 137.1 -9.1 -8.5 -36.9 29 29 A P S S- 0 0 56 0, 0.0 2,-0.3 0, 0.0 108,-0.3 0.560 80.7-153.0 -97.5 144.7 -9.8 -11.1 -35.6 30 30 A V E -b 137 0A 7 106,-2.9 108,-2.4 1,-0.1 72,-0.1 -0.561 7.4-160.6 -80.4 138.7 -13.6 -11.0 -35.6 31 31 A R E + 0 0 2 70,-0.3 111,-3.1 -2,-0.3 2,-0.3 0.761 65.9 58.6 -88.4 -27.7 -15.5 -12.9 -32.9 32 32 A Y E -bc 142 102A 5 69,-0.9 71,-2.2 109,-0.2 2,-0.4 -0.816 48.1-172.9-117.5 149.7 -18.9 -13.2 -34.6 33 33 A V E -bc 143 103A 0 109,-2.5 111,-2.3 -2,-0.3 2,-0.5 -0.998 13.7-160.3-130.2 131.5 -20.5 -14.6 -37.7 34 34 A V E -bc 144 104A 1 69,-2.6 71,-1.4 -2,-0.4 2,-0.4 -0.968 7.0-151.7-119.5 119.6 -24.2 -13.9 -38.4 35 35 A V E +bc 145 105A 0 109,-2.9 111,-1.7 -2,-0.5 2,-0.2 -0.754 25.3 155.9 -94.6 132.7 -26.0 -16.1 -40.8 36 36 A S E - c 0 106A 2 69,-1.8 71,-2.8 -2,-0.4 2,-0.3 -0.805 31.3-129.9-140.7 177.7 -29.0 -14.8 -42.8 37 37 A H E - c 0 107A 15 69,-0.3 71,-0.2 -2,-0.2 73,-0.1 -0.871 18.3-130.1-129.3 164.2 -30.9 -15.4 -46.0 38 38 A T - 0 0 28 69,-1.5 72,-0.2 71,-0.6 70,-0.1 0.524 26.8-140.4 -92.3 -7.3 -31.9 -13.0 -48.7 39 39 A A S S+ 0 0 59 70,-2.3 71,-0.3 68,-0.3 2,-0.1 0.764 70.3 114.1 50.3 25.1 -35.5 -14.1 -48.8 40 40 A G S S- 0 0 31 69,-0.6 -1,-0.2 1,-0.2 70,-0.1 -0.256 77.1 -51.6-106.9-163.3 -35.0 -13.7 -52.5 41 41 A S - 0 0 81 68,-0.2 -1,-0.2 -3,-0.1 2,-0.2 -0.438 52.9-131.7 -73.9 144.9 -34.9 -16.0 -55.4 42 42 A H - 0 0 95 -2,-0.1 2,-0.3 -3,-0.1 67,-0.2 -0.517 18.6-163.9 -92.8 167.1 -32.7 -19.0 -55.3 43 43 A c - 0 0 7 65,-0.4 34,-0.8 -2,-0.2 35,-0.2 -0.982 13.6-168.0-147.3 144.7 -30.3 -20.1 -58.1 44 44 A D + 0 0 84 -2,-0.3 175,-0.3 33,-0.1 32,-0.0 0.207 65.0 62.6-125.3 19.2 -28.6 -23.4 -58.7 45 45 A T S > S- 0 0 28 172,-0.1 4,-3.0 173,-0.1 5,-0.3 -0.981 82.7-113.6-140.8 151.6 -26.0 -22.7 -61.4 46 46 A P H > S+ 0 0 9 0, 0.0 4,-0.8 0, 0.0 5,-0.1 0.799 117.4 46.8 -53.2 -32.6 -22.9 -20.4 -61.5 47 47 A A H > S+ 0 0 78 2,-0.2 4,-1.4 1,-0.1 5,-0.1 0.888 114.9 43.5 -79.9 -39.8 -24.4 -18.2 -64.1 48 48 A S H > S+ 0 0 41 1,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.850 113.2 52.9 -74.1 -32.4 -27.8 -17.9 -62.4 49 49 A c H X S+ 0 0 0 -4,-3.0 4,-2.1 2,-0.2 -1,-0.2 0.730 105.9 53.2 -75.7 -20.9 -26.2 -17.3 -59.0 50 50 A A H X S+ 0 0 21 -4,-0.8 4,-2.5 -5,-0.3 -1,-0.2 0.885 108.2 50.6 -77.9 -38.7 -24.0 -14.5 -60.4 51 51 A Q H X S+ 0 0 96 -4,-1.4 4,-1.8 1,-0.2 -2,-0.2 0.956 112.6 48.1 -60.0 -48.4 -27.0 -12.8 -61.7 52 52 A Q H X S+ 0 0 30 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.888 107.6 52.0 -60.0 -46.7 -28.6 -13.1 -58.3 53 53 A A H >X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 3,-0.7 0.971 111.0 52.1 -54.2 -48.2 -25.6 -11.9 -56.4 54 54 A Q H 3X S+ 0 0 52 -4,-2.5 4,-2.4 1,-0.3 -2,-0.2 0.833 106.0 52.0 -54.9 -40.5 -25.8 -8.9 -58.7 55 55 A N H 3X S+ 0 0 74 -4,-1.8 4,-2.0 2,-0.2 -1,-0.3 0.807 110.5 49.2 -70.1 -28.8 -29.5 -8.3 -58.0 56 56 A V H S+ 0 0 47 -4,-2.4 4,-2.4 -5,-0.3 5,-0.7 0.934 107.5 45.6 -51.0 -57.1 -28.0 -3.8 -56.8 59 59 A Y H X>S+ 0 0 127 -4,-2.0 5,-1.3 1,-0.2 4,-1.0 0.861 114.3 50.0 -59.3 -36.2 -31.0 -3.4 -54.4 60 60 A H H <5S+ 0 0 12 -4,-2.2 6,-2.8 3,-0.2 -1,-0.2 0.862 122.6 30.8 -72.1 -35.4 -28.6 -2.6 -51.5 61 61 A V H X5S+ 0 0 33 -4,-2.7 4,-1.0 4,-0.2 -2,-0.2 0.951 127.0 37.0 -86.4 -61.2 -26.8 0.1 -53.5 62 62 A R H <5S+ 0 0 166 -4,-2.4 -3,-0.2 -5,-0.3 -2,-0.1 0.794 133.6 23.6 -62.2 -31.9 -29.4 1.5 -55.9 63 63 A N T < - 0 0 1 4,-2.5 3,-2.0 -2,-0.4 4,-0.2 -0.743 25.2-125.1-105.0 153.7 -25.2 -19.8 -53.7 77 77 A E T 3 S+ 0 0 8 -34,-0.8 43,-0.2 31,-0.3 42,-0.2 0.567 108.0 75.7 -69.9 -6.2 -27.1 -23.0 -54.0 78 78 A D T 3 S- 0 0 0 2,-0.2 -1,-0.3 -33,-0.2 -34,-0.1 0.525 118.6-110.1 -80.1 -5.0 -24.7 -23.8 -56.7 79 79 A G S < S+ 0 0 5 -3,-2.0 2,-0.3 1,-0.3 -2,-0.2 0.628 79.2 122.0 86.9 14.6 -22.2 -24.4 -53.9 80 80 A L - 0 0 14 -4,-0.2 -4,-2.5 172,-0.0 2,-0.5 -0.837 58.2-130.7-113.4 150.9 -20.1 -21.4 -54.6 81 81 A V E - D 0 75A 10 -2,-0.3 -71,-3.3 -73,-0.3 2,-0.5 -0.835 20.2-150.4 -97.3 131.5 -19.2 -18.5 -52.2 82 82 A Y E -aD 10 74A 3 -8,-3.2 -8,-2.4 -2,-0.5 2,-0.2 -0.881 17.9-119.4-106.7 133.3 -19.6 -15.0 -53.7 83 83 A E E + D 0 73A 61 -73,-2.4 -10,-0.2 -2,-0.5 -68,-0.1 -0.482 39.9 159.9 -74.9 133.0 -17.5 -12.2 -52.5 84 84 A G S S- 0 0 1 -12,-1.8 -12,-0.3 -2,-0.2 -11,-0.2 0.257 73.7 -25.8-114.8-118.8 -19.1 -9.3 -50.8 85 85 A R S > S- 0 0 26 -14,-1.9 4,-0.7 1,-0.2 3,-0.3 0.657 92.4-145.3 -76.4 -12.0 -17.4 -6.8 -48.6 86 86 A G T 4 - 0 0 5 -14,-2.1 -1,-0.2 -15,-0.2 3,-0.1 -0.257 35.5 -49.9 81.0-170.7 -14.9 -9.5 -47.8 87 87 A W T 4 S+ 0 0 30 1,-0.2 -1,-0.2 -3,-0.1 -57,-0.1 0.772 129.6 46.7 -75.0 -28.4 -13.1 -10.2 -44.5 88 88 A N T 4 S+ 0 0 62 -3,-0.3 -62,-2.7 -16,-0.1 2,-0.4 0.697 93.8 76.5 -93.1 -19.3 -11.8 -6.7 -43.8 89 89 A I B < S-G 25 0B 33 -4,-0.7 -64,-0.2 -64,-0.3 2,-0.1 -0.814 82.0-111.8-102.2 132.2 -14.7 -4.3 -44.4 90 90 A K - 0 0 71 -66,-2.0 -66,-0.1 -2,-0.4 13,-0.1 -0.338 36.4-145.7 -58.0 124.2 -17.7 -3.7 -42.0 91 91 A G - 0 0 1 11,-0.6 -20,-0.2 8,-0.5 -21,-0.1 0.022 9.4-134.6 -78.7-166.7 -20.9 -5.1 -43.5 92 92 A A + 0 0 20 -22,-2.4 -21,-0.2 12,-0.1 -22,-0.1 -0.239 69.3 104.4-146.2 45.4 -24.4 -3.7 -43.1 93 93 A H S S+ 0 0 16 -23,-0.3 -22,-0.1 2,-0.1 -23,-0.1 0.784 76.4 35.6 -98.9 -34.7 -26.4 -6.8 -42.4 94 94 A A S S- 0 0 0 1,-0.4 4,-0.4 8,-0.1 3,-0.2 -0.085 105.2 -84.1-125.3 38.0 -27.3 -7.0 -38.8 95 95 A G >> - 0 0 12 1,-0.2 4,-2.4 3,-0.2 3,-0.5 0.056 55.7 -68.1 85.6 162.8 -28.0 -3.6 -37.2 96 96 A P T 34 S+ 0 0 108 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 0.643 127.4 49.0 -67.9 -21.0 -25.7 -0.9 -35.8 97 97 A T T 34 S+ 0 0 87 -3,-0.2 -2,-0.1 2,-0.1 4,-0.1 0.717 119.8 36.3 -93.6 -17.6 -24.5 -2.8 -32.7 98 98 A W T X4 S+ 0 0 23 -3,-0.5 3,-1.4 -4,-0.4 -3,-0.2 0.780 102.1 67.8-101.7 -31.6 -23.6 -6.0 -34.6 99 99 A N G >< S+ 0 0 14 -4,-2.4 3,-0.9 1,-0.3 -8,-0.5 0.858 96.5 58.0 -56.7 -38.9 -22.2 -4.8 -37.9 100 100 A P G 3 S+ 0 0 52 0, 0.0 -73,-0.4 0, 0.0 -1,-0.3 0.636 116.4 33.2 -67.8 -14.2 -19.1 -3.3 -36.2 101 101 A I G < S+ 0 0 33 -3,-1.4 -69,-0.9 -75,-0.1 -70,-0.3 0.057 109.9 57.2-132.9 29.9 -18.1 -6.7 -34.8 102 102 A S E < -c 32 0A 0 -3,-0.9 -11,-0.6 -4,-0.1 2,-0.5 -0.995 63.2-124.1-158.7 163.1 -19.1 -9.4 -37.2 103 103 A I E -c 33 0A 0 -71,-2.2 -69,-2.6 -2,-0.3 2,-0.6 -0.903 29.1-153.5-104.5 132.9 -19.0 -11.1 -40.6 104 104 A G E -c 34 0A 0 -2,-0.5 -32,-2.0 -71,-0.2 -31,-1.3 -0.955 12.4-176.5-113.7 118.0 -22.4 -11.6 -42.1 105 105 A I E -ce 35 73A 0 -71,-1.4 -69,-1.8 -2,-0.6 2,-0.4 -0.940 8.9-162.3-111.6 136.4 -22.8 -14.4 -44.6 106 106 A S E -ce 36 74A 0 -33,-1.8 -31,-2.2 -2,-0.4 -69,-0.3 -0.966 14.5-137.6-124.8 124.9 -26.1 -14.8 -46.3 107 107 A F E -ce 37 75A 0 -71,-2.8 -69,-1.5 -2,-0.4 2,-1.3 -0.558 31.2-119.1 -74.5 140.7 -27.5 -17.8 -48.2 108 108 A M S S+ 0 0 0 -33,-2.5 -65,-0.4 -2,-0.2 -31,-0.3 -0.641 77.4 39.7 -88.9 92.0 -29.3 -16.7 -51.4 109 109 A G S S- 0 0 0 -2,-1.3 -70,-2.3 -67,-0.2 -69,-0.6 -0.973 93.1 -72.7 165.2-168.1 -32.9 -17.7 -51.1 110 110 A N > - 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