==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 14-NOV-11 3UMQ . COMPND 2 MOLECULE: PEPTIDOGLYCAN RECOGNITION PROTEIN 1; . SOURCE 2 ORGANISM_SCIENTIFIC: CAMELUS DROMEDARIUS; . AUTHOR N.PANDEY,P.SHARMA,M.SINHA,A.BHUSHAN,P.KAUR,S.SHARMA,T.P.SING . 684 4 12 12 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30418.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 441 64.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 89 13.0 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 . 30 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 58 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 165 24.1 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 4 0 0 3 1 1 0 0 0 0 0 0 3 5 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 7 1 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 0 228 0, 0.0 134,-0.1 0, 0.0 133,-0.1 0.000 360.0 360.0 360.0 -12.6 -45.6 -36.3 -40.2 2 2 A D - 0 0 107 132,-0.2 0, 0.0 1,-0.1 0, 0.0 -0.955 360.0-165.0-133.8 118.9 -44.9 -33.3 -42.6 3 3 A P + 0 0 126 0, 0.0 -1,-0.1 0, 0.0 131,-0.0 0.857 57.0 104.7 -64.3 -42.2 -45.6 -33.4 -46.4 4 4 A P S S- 0 0 77 0, 0.0 -2,-0.1 0, 0.0 2,-0.0 -0.119 70.7-119.4 -51.2 144.2 -43.5 -30.3 -47.4 5 5 A A - 0 0 83 1,-0.0 2,-0.3 129,-0.0 128,-0.0 -0.254 22.3-153.0 -82.0 158.0 -40.2 -30.8 -49.1 6 6 A a - 0 0 44 1,-0.2 128,-0.1 -2,-0.0 292,-0.1 -0.878 42.2 -24.8-144.8 117.5 -36.9 -29.7 -47.9 7 7 A G - 0 0 31 -2,-0.3 2,-0.4 291,-0.1 -1,-0.2 0.109 65.5 -85.4 82.6 165.2 -33.6 -28.9 -49.7 8 8 A S + 0 0 35 115,-0.1 73,-0.4 289,-0.0 2,-0.3 -0.953 43.5 170.2-112.8 136.4 -31.9 -29.7 -53.0 9 9 A I - 0 0 36 -2,-0.4 73,-0.2 71,-0.1 71,-0.0 -0.994 38.5-118.6-147.3 134.4 -29.8 -32.8 -53.5 10 10 A V B -a 82 0A 6 71,-3.3 73,-2.1 -2,-0.3 5,-0.1 -0.693 42.8-130.8 -74.6 109.2 -28.3 -34.5 -56.6 11 11 A P >> - 0 0 50 0, 0.0 4,-1.2 0, 0.0 3,-0.9 -0.212 19.6-103.6 -63.6 152.7 -30.1 -37.9 -56.6 12 12 A R T 34>S+ 0 0 45 1,-0.2 5,-2.4 2,-0.2 3,-0.4 0.839 119.7 52.7 -36.9 -49.8 -28.1 -41.2 -57.0 13 13 A R T >45S+ 0 0 228 1,-0.2 3,-1.3 3,-0.2 -1,-0.2 0.881 101.9 59.6 -62.5 -38.3 -29.2 -41.6 -60.7 14 14 A E T <45S+ 0 0 65 -3,-0.9 -1,-0.2 1,-0.3 -2,-0.2 0.855 111.5 39.3 -61.9 -37.8 -28.0 -38.2 -61.6 15 15 A W T 3<5S- 0 0 1 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.334 115.9-115.9 -94.5 10.0 -24.5 -38.9 -60.6 16 16 A R T < 5 - 0 0 178 -3,-1.3 -3,-0.2 -4,-0.3 -2,-0.1 0.844 45.9-178.2 62.4 39.0 -24.7 -42.4 -62.0 17 17 A A < - 0 0 20 -5,-2.4 -1,-0.2 -6,-0.1 3,-0.1 -0.381 31.2-111.5 -64.6 143.3 -24.3 -44.3 -58.7 18 18 A L - 0 0 68 1,-0.1 -1,-0.1 36,-0.1 43,-0.0 -0.416 50.9 -84.3 -68.2 155.8 -24.2 -48.1 -58.9 19 19 A A - 0 0 83 1,-0.1 -1,-0.1 49,-0.1 2,-0.1 -0.288 50.8-116.7 -61.7 144.8 -27.3 -49.6 -57.3 20 20 A S - 0 0 34 1,-0.1 48,-0.2 -3,-0.1 -1,-0.1 -0.420 22.2-168.3 -82.0 163.6 -26.9 -49.9 -53.5 21 21 A E + 0 0 133 46,-2.2 2,-0.3 -2,-0.1 47,-0.2 0.092 49.2 119.7-132.6 18.6 -27.0 -53.2 -51.7 22 22 A b + 0 0 7 45,-0.4 -2,-0.1 1,-0.1 69,-0.0 -0.694 24.8 162.4 -88.2 135.9 -27.3 -51.8 -48.2 23 23 A R + 0 0 175 -2,-0.3 2,-0.2 2,-0.0 -1,-0.1 0.602 36.4 109.8-124.1 -19.1 -30.3 -52.7 -46.1 24 24 A E - 0 0 136 66,-0.1 66,-2.0 65,-0.1 2,-0.3 -0.397 58.9-144.7 -62.7 128.3 -29.5 -51.9 -42.4 25 25 A R B -G 89 0B 160 64,-0.2 64,-0.3 -2,-0.2 2,-0.2 -0.660 6.9-127.6-102.1 150.9 -31.6 -49.0 -41.3 26 26 A L - 0 0 13 62,-2.5 2,-0.7 -2,-0.3 75,-0.1 -0.521 33.0-114.4 -78.6 155.0 -30.9 -46.0 -38.9 27 27 A T - 0 0 122 73,-0.5 62,-0.0 -2,-0.2 -1,-0.0 -0.878 48.3 -93.5-100.3 115.9 -33.5 -45.4 -36.2 28 28 A R S S+ 0 0 122 -2,-0.7 108,-0.1 1,-0.1 109,-0.1 -0.449 102.1 35.8 -71.0 144.4 -35.3 -42.1 -36.7 29 29 A P S S- 0 0 51 0, 0.0 2,-0.3 0, 0.0 108,-0.3 0.694 80.7-148.4 -88.0 155.1 -34.6 -39.6 -35.6 30 30 A V E -b 137 0A 6 106,-2.7 108,-2.5 1,-0.1 72,-0.1 -0.614 6.6-158.6 -83.0 133.2 -30.8 -39.5 -35.5 31 31 A R E + 0 0 7 70,-0.4 111,-2.9 -2,-0.3 2,-0.3 0.810 69.0 51.1 -68.1 -40.3 -28.9 -37.7 -32.7 32 32 A Y E -bc 142 102A 6 69,-1.2 71,-2.1 109,-0.2 2,-0.4 -0.836 50.4-168.7-120.0 146.3 -25.5 -37.3 -34.4 33 33 A V E -bc 143 103A 0 109,-2.4 111,-2.8 -2,-0.3 2,-0.5 -0.998 15.1-157.3-124.6 131.2 -24.0 -36.0 -37.5 34 34 A V E -bc 144 104A 0 69,-3.1 71,-2.2 -2,-0.4 2,-0.5 -0.954 5.9-150.6-114.3 128.5 -20.3 -36.7 -38.2 35 35 A V E +bc 145 105A 0 109,-3.1 111,-1.9 -2,-0.5 112,-0.2 -0.831 25.4 160.1-105.8 129.3 -18.4 -34.6 -40.6 36 36 A S E - c 0 106A 1 69,-2.4 71,-2.4 -2,-0.5 2,-0.3 -0.727 30.1-129.0-133.4 172.3 -15.5 -36.0 -42.6 37 37 A H E - c 0 107A 15 69,-0.3 71,-0.2 -2,-0.2 73,-0.1 -0.958 15.1-135.7-128.0 152.4 -13.5 -35.4 -45.7 38 38 A T - 0 0 24 69,-2.0 72,-0.2 71,-0.5 70,-0.1 0.767 25.4-145.8 -66.7 -34.6 -12.7 -37.7 -48.5 39 39 A A + 0 0 59 70,-2.1 71,-0.3 68,-0.4 2,-0.1 0.700 65.2 116.3 69.9 16.7 -9.1 -36.6 -48.4 40 40 A G S S- 0 0 31 69,-0.3 70,-0.5 1,-0.2 -1,-0.2 -0.321 78.6 -55.8-105.0-174.1 -9.5 -37.2 -52.2 41 41 A S - 0 0 89 68,-0.2 -1,-0.2 -2,-0.1 2,-0.2 -0.280 58.8-135.1 -59.0 151.7 -9.3 -35.0 -55.3 42 42 A H - 0 0 92 67,-0.1 2,-0.3 -3,-0.1 67,-0.2 -0.523 16.2-157.7-103.4 177.3 -11.8 -32.0 -55.1 43 43 A c - 0 0 6 65,-0.5 34,-1.0 -2,-0.2 35,-0.4 -0.985 16.8-168.3-155.3 146.5 -14.2 -30.7 -57.8 44 44 A D + 0 0 82 -2,-0.3 175,-0.2 33,-0.2 -1,-0.1 0.440 66.0 66.3-120.9 4.3 -16.0 -27.4 -58.6 45 45 A T S > S- 0 0 32 172,-0.1 4,-3.2 1,-0.1 5,-0.4 -0.967 80.9-118.3-129.2 143.7 -18.5 -28.1 -61.3 46 46 A P H > S+ 0 0 9 0, 0.0 4,-1.2 0, 0.0 5,-0.1 0.812 119.3 50.7 -44.8 -35.4 -21.7 -30.3 -61.2 47 47 A A H > S+ 0 0 79 169,-0.2 4,-1.6 2,-0.2 3,-0.2 0.961 113.6 41.6 -67.3 -49.3 -20.0 -32.3 -63.9 48 48 A S H > S+ 0 0 41 -3,-0.3 4,-1.9 1,-0.2 -1,-0.1 0.849 114.4 52.0 -73.9 -29.7 -16.7 -32.8 -62.0 49 49 A c H X S+ 0 0 0 -4,-3.2 4,-2.3 2,-0.2 -1,-0.2 0.786 106.1 52.9 -73.9 -27.2 -18.4 -33.4 -58.7 50 50 A A H X S+ 0 0 20 -4,-1.2 4,-2.1 -5,-0.4 -2,-0.2 0.896 110.3 49.8 -74.2 -38.0 -20.7 -36.1 -60.0 51 51 A Q H X S+ 0 0 87 -4,-1.6 4,-2.5 2,-0.2 -2,-0.2 0.918 111.4 47.8 -61.0 -47.7 -17.6 -37.9 -61.4 52 52 A Q H X S+ 0 0 25 -4,-1.9 4,-2.0 2,-0.2 5,-0.2 0.911 108.3 53.7 -65.5 -41.2 -15.9 -37.6 -58.1 53 53 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 3,-0.2 0.950 110.3 49.6 -53.5 -47.0 -18.9 -38.9 -56.2 54 54 A Q H X S+ 0 0 52 -4,-2.1 4,-2.9 1,-0.2 -2,-0.2 0.923 109.1 51.7 -58.2 -49.3 -18.8 -41.9 -58.6 55 55 A N H X S+ 0 0 72 -4,-2.5 4,-1.8 2,-0.2 -1,-0.2 0.814 111.2 46.2 -56.0 -36.7 -15.0 -42.4 -58.0 56 56 A V H X S+ 0 0 15 -4,-2.0 4,-2.5 -3,-0.2 -1,-0.2 0.932 113.8 47.5 -76.1 -43.1 -15.4 -42.5 -54.2 57 57 A Q H X S+ 0 0 1 -4,-2.3 4,-3.2 -5,-0.2 5,-0.3 0.943 111.7 52.5 -57.4 -48.1 -18.4 -44.8 -54.3 58 58 A S H X>S+ 0 0 49 -4,-2.9 4,-2.5 1,-0.2 5,-0.6 0.851 109.0 48.7 -56.5 -43.5 -16.4 -47.0 -56.7 59 59 A Y H X>S+ 0 0 128 -4,-1.8 4,-1.7 3,-0.2 5,-1.6 0.923 115.1 44.9 -63.7 -45.9 -13.5 -47.1 -54.4 60 60 A H H <5S+ 0 0 14 -4,-2.5 6,-2.2 3,-0.2 5,-0.2 0.886 119.5 40.4 -62.7 -46.6 -15.7 -48.1 -51.4 61 61 A V H <5S+ 0 0 36 -4,-3.2 4,-0.3 4,-0.2 -2,-0.2 0.924 125.6 31.2 -75.0 -46.4 -17.7 -50.6 -53.3 62 62 A R H <5S+ 0 0 164 -4,-2.5 -3,-0.2 -5,-0.3 -2,-0.2 0.877 130.6 28.5 -84.2 -39.5 -15.0 -52.3 -55.4 63 63 A N T < - 0 0 0 4,-2.3 3,-1.7 -2,-0.4 4,-0.1 -0.710 31.2-117.9-107.2 158.4 -18.9 -30.8 -53.4 77 77 A E T 3 S+ 0 0 7 -34,-1.0 -33,-0.2 1,-0.3 43,-0.2 0.624 108.4 77.5 -66.8 -12.8 -17.3 -27.4 -53.9 78 78 A D T 3 S- 0 0 0 -35,-0.4 -1,-0.3 2,-0.1 -34,-0.1 0.474 116.4-113.7 -69.0 -3.9 -19.8 -26.8 -56.7 79 79 A G S < S+ 0 0 4 -3,-1.7 2,-0.3 1,-0.3 -2,-0.2 0.570 77.7 124.3 78.5 12.1 -22.1 -26.1 -53.8 80 80 A L - 0 0 15 -4,-0.1 -4,-2.3 172,-0.0 2,-0.5 -0.745 57.4-132.9-104.4 150.1 -24.3 -29.2 -54.4 81 81 A V E - D 0 75A 5 -73,-0.4 -71,-3.3 -2,-0.3 2,-0.5 -0.905 18.5-150.4 -98.9 133.7 -25.1 -32.0 -52.0 82 82 A Y E -aD 10 74A 2 -8,-2.9 -8,-2.7 -2,-0.5 2,-0.2 -0.918 16.9-124.2-107.0 119.5 -24.8 -35.5 -53.5 83 83 A E E + D 0 73A 61 -73,-2.1 -10,-0.2 -2,-0.5 -68,-0.1 -0.411 37.3 165.5 -66.2 131.7 -27.1 -38.2 -52.0 84 84 A G S S- 0 0 1 -12,-2.4 -12,-0.3 -2,-0.2 -11,-0.2 0.320 73.6 -21.8-109.5-118.3 -25.2 -41.2 -50.7 85 85 A R S > S- 0 0 27 -14,-1.8 4,-0.6 1,-0.2 3,-0.4 0.670 96.6-146.0 -68.8 -16.2 -26.9 -43.8 -48.5 86 86 A G T 4 - 0 0 6 -14,-2.4 -1,-0.2 -15,-0.2 3,-0.1 -0.311 33.0 -51.2 84.6-166.3 -29.4 -41.1 -47.6 87 87 A W T 4 S+ 0 0 29 1,-0.2 -1,-0.2 -3,-0.1 -57,-0.1 0.655 128.1 48.3 -86.4 -15.6 -31.2 -40.4 -44.4 88 88 A N T 4 S+ 0 0 71 -3,-0.4 -62,-2.5 -16,-0.1 2,-0.4 0.679 95.0 74.1-101.4 -17.8 -32.6 -43.8 -43.7 89 89 A I B < S-G 25 0B 34 -4,-0.6 -64,-0.2 -64,-0.3 2,-0.1 -0.836 80.9-110.3-113.5 132.2 -29.7 -46.2 -44.2 90 90 A K - 0 0 49 -66,-2.0 -66,-0.1 -2,-0.4 13,-0.1 -0.300 36.9-151.9 -59.6 124.1 -26.7 -46.9 -41.9 91 91 A G - 0 0 2 8,-0.5 -20,-0.2 11,-0.4 2,-0.2 -0.171 15.0-129.3 -85.3-176.2 -23.5 -45.6 -43.5 92 92 A A S S+ 0 0 19 -22,-2.7 -22,-0.1 -23,-0.1 -21,-0.1 -0.706 71.2 103.7-133.2 76.1 -19.9 -46.8 -43.0 93 93 A H S S+ 0 0 13 -2,-0.2 -22,-0.1 2,-0.2 -1,-0.1 0.553 79.4 32.6-127.7 -25.2 -18.0 -43.6 -42.2 94 94 A A S S- 0 0 1 1,-0.3 4,-0.4 -3,-0.1 3,-0.1 0.233 104.8 -95.0-126.8 14.3 -17.2 -43.5 -38.4 95 95 A G > - 0 0 11 1,-0.2 4,-3.5 3,-0.1 3,-0.4 -0.089 52.5 -61.6 88.1 167.8 -16.7 -47.0 -37.2 96 96 A P T 4 S+ 0 0 110 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.855 130.3 51.5 -62.0 -41.2 -19.0 -49.6 -35.5 97 97 A T T 4 S+ 0 0 89 -3,-0.1 4,-0.1 1,-0.1 -2,-0.1 0.866 123.1 28.6 -60.7 -39.5 -19.7 -47.5 -32.4 98 98 A W T >> S+ 0 0 30 -4,-0.4 3,-2.0 -3,-0.4 4,-0.5 0.885 103.1 73.8 -97.3 -36.4 -20.8 -44.4 -34.4 99 99 A N G >< S+ 0 0 17 -4,-3.5 3,-1.2 1,-0.3 -8,-0.5 0.846 95.8 52.1 -42.5 -49.8 -22.1 -45.8 -37.7 100 100 A P G 34 S+ 0 0 59 0, 0.0 -73,-0.5 0, 0.0 -1,-0.3 0.604 117.4 36.6 -66.2 -13.4 -25.4 -47.1 -36.2 101 101 A I G <4 S+ 0 0 42 -3,-2.0 -69,-1.2 -4,-0.1 -70,-0.4 0.146 108.7 67.6-127.3 13.7 -26.3 -43.8 -34.5 102 102 A S E << -c 32 0A 0 -3,-1.2 2,-0.5 -4,-0.5 -11,-0.4 -0.892 62.5-133.3-136.1 164.5 -25.2 -41.2 -36.9 103 103 A I E -c 33 0A 0 -71,-2.1 -69,-3.1 -2,-0.3 2,-0.5 -0.983 30.7-155.9-105.2 125.7 -25.5 -39.4 -40.3 104 104 A G E -c 34 0A 0 -2,-0.5 -32,-1.7 -71,-0.2 -31,-1.5 -0.921 11.4-175.7-104.9 126.2 -22.0 -39.0 -41.9 105 105 A I E -ce 35 73A 0 -71,-2.2 -69,-2.4 -2,-0.5 2,-0.5 -0.953 7.5-160.3-119.2 140.6 -21.5 -36.2 -44.4 106 106 A S E -ce 36 74A 0 -33,-1.8 -31,-2.4 -2,-0.4 2,-0.4 -0.984 15.0-140.5-128.7 122.8 -18.3 -35.9 -46.2 107 107 A F E -ce 37 75A 0 -71,-2.4 -69,-2.0 -2,-0.5 2,-0.6 -0.710 34.4-121.1 -74.3 127.3 -16.8 -32.8 -48.1 108 108 A M S S+ 0 0 0 -33,-2.6 -65,-0.5 -2,-0.4 -31,-0.3 -0.609 76.4 30.7 -79.5 118.0 -15.1 -34.2 -51.2 109 109 A G S S- 0 0 0 -2,-0.6 -70,-2.1 -67,-0.2 2,-0.5 -0.654 96.3 -61.5 124.6 176.2 -11.4 -33.3 -51.3 110 110 A N - 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