==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 11-MAR-08 3CIG . COMPND 2 MOLECULE: TOLL-LIKE RECEPTOR 3; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR L.LIU,I.BOTOS,Y.WANG,J.N.LEONARD,J.SHILOACH,D.M.SEGAL,D.R.DA . 663 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29468.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 409 61.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 125 18.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.6 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 . 64 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 91 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 31 4.7 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 1 1 0 0 1 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 10 22 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 . 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 6 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 27 A Q 0 0 165 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-175.3 29.0 28.1 2.5 2 28 A a - 0 0 16 9,-0.1 2,-0.5 1,-0.1 9,-0.2 -0.230 360.0-142.8 -65.3 137.9 26.7 30.3 4.5 3 29 A T B -A 10 0A 102 7,-1.5 7,-1.8 20,-0.0 2,-0.6 -0.853 15.5-155.7 -96.6 136.7 24.5 29.0 7.4 4 30 A V + 0 0 53 -2,-0.5 5,-0.2 5,-0.2 3,-0.2 -0.848 18.2 168.1-124.7 98.4 21.1 30.5 7.6 5 31 A R > - 0 0 213 -2,-0.6 3,-0.7 3,-0.4 2,-0.5 0.200 64.2 -19.8 -79.3-157.5 19.1 30.6 10.9 6 32 A Y T 3 S- 0 0 201 1,-0.3 -1,-0.2 21,-0.0 3,-0.1 -0.389 126.0 -36.8 -53.9 109.7 15.9 32.7 11.4 7 33 A N T 3 S+ 0 0 76 -2,-0.5 21,-2.2 -3,-0.2 2,-0.4 0.560 117.6 105.5 50.9 15.0 15.8 35.4 8.8 8 34 A V < - 0 0 48 -3,-0.7 2,-0.7 19,-0.2 -3,-0.4 -0.972 56.2-155.6-129.1 134.3 19.6 35.9 9.0 9 35 A A - 0 0 0 -2,-0.4 22,-0.6 -5,-0.2 2,-0.5 -0.813 16.1-163.1-113.9 95.0 22.3 34.7 6.5 10 36 A D B +Ab 3 31A 70 -7,-1.8 -7,-1.5 -2,-0.7 22,-0.1 -0.629 24.7 157.0 -85.4 121.6 25.6 34.3 8.3 11 37 A a + 0 0 0 20,-2.8 3,-0.4 -2,-0.5 5,-0.2 -0.398 22.1 145.5-135.9 64.3 28.8 34.1 6.2 12 38 A S + 0 0 20 1,-0.2 2,-0.6 2,-0.1 3,-0.4 0.978 63.0 13.6 -76.1 -80.8 31.6 35.2 8.6 13 39 A H S S+ 0 0 138 1,-0.2 -1,-0.2 2,-0.1 22,-0.1 -0.445 86.6 110.5-101.5 64.1 35.1 33.6 8.4 14 40 A L S S- 0 0 62 -2,-0.6 -1,-0.2 -3,-0.4 21,-0.1 0.665 79.1-123.6-103.5 -18.9 34.9 31.9 5.0 15 41 A K + 0 0 147 19,-0.4 20,-0.1 -3,-0.4 -2,-0.1 0.834 46.4 178.3 73.3 34.4 37.3 34.2 3.1 16 42 A L - 0 0 36 -5,-0.2 20,-0.8 -4,-0.1 -1,-0.1 -0.160 27.5-176.1 -60.9 159.4 34.7 34.9 0.4 17 43 A T + 0 0 60 1,-0.1 21,-0.5 19,-0.1 2,-0.3 0.251 69.7 53.9-136.1 -1.8 35.4 37.2 -2.5 18 44 A H S S- 0 0 141 19,-0.1 -1,-0.1 20,-0.1 19,-0.1 -0.934 86.7-109.2-133.5 157.8 31.9 37.2 -4.0 19 45 A I - 0 0 15 -2,-0.3 2,-0.1 -3,-0.1 13,-0.0 -0.804 41.0-125.2 -92.5 119.0 28.4 37.8 -2.6 20 46 A P - 0 0 17 0, 0.0 -1,-0.0 0, 0.0 -9,-0.0 -0.404 24.7-175.2 -70.6 143.9 26.4 34.5 -2.3 21 47 A D + 0 0 109 -2,-0.1 -2,-0.0 1,-0.1 24,-0.0 0.649 66.5 87.3-111.5 -25.2 23.0 34.0 -3.9 22 48 A D S S+ 0 0 76 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.855 70.8 99.8 -40.7 -41.3 22.0 30.6 -2.6 23 49 A L S S- 0 0 6 2,-0.1 -14,-0.1 -14,-0.0 -20,-0.0 0.106 84.9 -88.1 -50.8 159.6 20.5 32.2 0.5 24 50 A P - 0 0 51 0, 0.0 3,-0.1 0, 0.0 -1,-0.0 0.161 17.7-136.3 -50.2 174.1 16.8 32.9 0.9 25 51 A S S S+ 0 0 51 23,-0.1 25,-0.1 24,-0.1 24,-0.1 0.290 97.1 75.2-110.0 3.1 15.0 36.0 -0.4 26 52 A N S S+ 0 0 139 22,-0.1 2,-0.3 23,-0.0 22,-0.1 -0.035 73.3 115.3-100.8 27.9 13.0 36.1 2.9 27 53 A I - 0 0 2 -3,-0.1 23,-0.2 1,-0.1 -19,-0.2 -0.752 42.9-174.7 -99.4 148.2 15.9 37.4 4.9 28 54 A T S S+ 0 0 47 -21,-2.2 2,-0.3 -2,-0.3 -20,-0.1 -0.161 72.4 50.4-129.2 34.0 16.2 40.7 6.7 29 55 A V - 0 0 27 -22,-0.2 25,-0.1 23,-0.2 21,-0.1 -0.933 53.8-175.5-155.9 171.1 19.9 40.4 7.8 30 56 A L E - c 0 54A 6 23,-0.6 25,-1.7 -2,-0.3 2,-1.0 -0.350 9.5-161.1-178.4 91.8 23.2 39.4 6.2 31 57 A N E +bc 10 55A 46 -22,-0.6 -20,-2.8 1,-0.1 25,-0.2 -0.692 21.5 161.8 -86.3 97.9 26.5 39.0 8.1 32 58 A L > + 0 0 0 23,-2.0 3,-0.6 -2,-1.0 5,-0.2 -0.009 28.9 155.1-101.2 31.4 29.3 39.3 5.5 33 59 A T T 3 + 0 0 20 1,-0.2 25,-0.2 22,-0.2 23,-0.1 -0.211 53.3 7.3 -59.1 140.2 31.8 40.0 8.3 34 60 A H T 3 S+ 0 0 81 23,-2.4 -19,-0.4 -21,-0.1 -1,-0.2 0.895 94.5 119.6 63.3 44.8 35.5 39.3 8.1 35 61 A N S < S- 0 0 14 -3,-0.6 -18,-0.1 23,-0.5 -1,-0.1 0.154 70.1-103.0-113.3-133.7 35.8 38.3 4.5 36 62 A Q + 0 0 98 -20,-0.8 -19,-0.1 23,-0.1 23,-0.1 0.279 49.2 160.2-144.0 16.0 37.7 39.5 1.4 37 63 A L - 0 0 5 -5,-0.2 23,-1.4 1,-0.1 24,-0.1 -0.062 34.1-150.9 -57.4 134.0 35.2 41.4 -0.7 38 64 A R S S- 0 0 158 -21,-0.5 24,-0.7 1,-0.3 2,-0.3 0.957 73.2 -45.4 -58.7 -63.2 36.5 43.9 -3.3 39 65 A R - 0 0 84 22,-0.2 -1,-0.3 23,-0.1 25,-0.1 -0.882 59.6 -96.8-155.9-172.3 33.3 46.0 -3.1 40 66 A L - 0 0 2 23,-0.5 25,-0.3 -2,-0.3 28,-0.1 -0.717 35.9-142.1-122.1 82.0 29.5 45.4 -3.0 41 67 A P > - 0 0 33 0, 0.0 3,-1.3 0, 0.0 4,-0.2 -0.110 14.8-130.0 -50.6 129.1 28.1 45.9 -6.5 42 68 A P T 3 S+ 0 0 17 0, 0.0 29,-0.0 0, 0.0 22,-0.0 0.315 103.7 56.9 -65.6 10.9 24.7 47.7 -6.1 43 69 A T T > S+ 0 0 94 2,-0.1 3,-1.2 1,-0.1 -3,-0.0 0.695 88.3 66.7-112.8 -29.9 23.3 44.9 -8.4 44 70 A N T < S+ 0 0 74 -3,-1.3 3,-0.2 1,-0.3 -1,-0.1 0.385 90.4 69.6 -79.5 6.2 24.1 41.7 -6.6 45 71 A F T 3 + 0 0 2 -4,-0.2 3,-0.5 1,-0.2 -1,-0.3 0.320 67.8 96.7-106.9 8.2 21.7 42.6 -3.8 46 72 A T S X S+ 0 0 93 -3,-1.2 3,-1.1 1,-0.2 -1,-0.2 0.864 71.5 64.5 -65.6 -42.7 18.5 42.2 -5.7 47 73 A R T 3 S+ 0 0 115 1,-0.3 2,-0.3 -3,-0.2 -1,-0.2 0.849 113.2 35.4 -52.3 -34.4 17.6 38.7 -4.6 48 74 A Y T > + 0 0 6 -3,-0.5 3,-1.5 1,-0.1 -1,-0.3 -0.534 63.6 153.4-121.0 60.9 17.3 39.9 -1.0 49 75 A S T < + 0 0 49 -3,-1.1 25,-0.2 1,-0.3 -1,-0.1 0.185 67.8 78.8 -72.7 17.9 15.8 43.4 -1.4 50 76 A Q T 3 + 0 0 89 -23,-0.2 2,-0.3 -25,-0.1 -1,-0.3 0.263 60.9 140.1-102.1 8.0 14.5 42.5 2.1 51 77 A L < + 0 0 0 -3,-1.5 23,-0.2 -6,-0.2 3,-0.2 -0.338 22.5 173.5 -67.2 111.8 17.8 43.3 3.7 52 78 A A S S+ 0 0 26 -2,-0.3 24,-3.2 1,-0.3 25,-1.3 0.798 74.1 20.8 -86.7 -31.4 17.1 45.1 7.0 53 79 A I E - d 0 77A 52 23,-0.2 2,-0.7 22,-0.2 -23,-0.6 -0.908 64.7-165.4-143.1 108.7 20.7 45.1 8.2 54 80 A L E -cd 30 78A 5 23,-0.7 25,-1.9 -2,-0.3 2,-0.8 -0.861 9.1-171.7 -95.0 116.4 23.8 44.8 5.9 55 81 A D E +cd 31 79A 33 -25,-1.7 -23,-2.0 -2,-0.7 -22,-0.2 -0.812 20.5 155.2-115.4 91.0 26.8 44.0 8.0 56 82 A A + 0 0 0 23,-1.9 3,-0.3 -2,-0.8 5,-0.2 -0.124 19.0 153.5-111.1 39.7 30.0 44.1 5.9 57 83 A G + 0 0 0 1,-0.2 -23,-2.4 23,-0.1 -22,-0.3 -0.384 56.9 22.2 -63.0 138.5 32.6 44.9 8.6 58 84 A F S S+ 0 0 73 23,-2.2 -23,-0.5 -25,-0.2 2,-0.2 0.961 89.0 111.2 74.7 60.8 36.2 43.8 8.0 59 85 A N S S- 0 0 11 22,-0.4 -1,-0.2 -3,-0.3 -21,-0.1 -0.561 78.2 -95.3-136.5-155.9 36.6 43.4 4.2 60 86 A S + 0 0 61 -23,-1.4 -22,-0.1 -2,-0.2 23,-0.1 0.336 59.6 155.2-116.9 8.8 38.5 45.1 1.5 61 87 A I + 0 0 0 -5,-0.2 23,-1.6 -24,-0.1 -22,-0.2 0.059 15.8 177.4 -35.2 133.1 35.7 47.4 0.3 62 88 A S + 0 0 45 -24,-0.7 24,-1.1 1,-0.4 2,-0.3 0.739 59.3 16.3-113.9 -43.7 37.0 50.5 -1.4 63 89 A K - 0 0 110 -25,-0.2 -23,-0.5 22,-0.2 2,-0.5 -0.960 61.6-138.0-132.5 155.8 34.0 52.5 -2.7 64 90 A L - 0 0 22 -2,-0.3 3,-0.0 -25,-0.1 -25,-0.0 -0.967 19.1-136.6-115.3 124.8 30.3 52.5 -2.1 65 91 A E > - 0 0 47 -2,-0.5 3,-1.3 -25,-0.3 4,-0.4 -0.644 10.1-138.6 -83.1 129.9 27.9 52.9 -5.0 66 92 A P T >> S+ 0 0 32 0, 0.0 3,-1.3 0, 0.0 4,-0.7 0.826 99.4 64.3 -53.1 -39.4 25.0 55.3 -4.3 67 93 A E H >> S+ 0 0 79 1,-0.3 4,-3.1 2,-0.2 3,-0.7 0.836 83.2 79.3 -59.4 -29.5 22.4 53.0 -6.0 68 94 A L H <> S+ 0 0 13 -3,-1.3 4,-1.4 1,-0.3 -1,-0.3 0.825 91.4 51.1 -43.3 -47.5 23.0 50.4 -3.3 69 95 A b H <4 S+ 0 0 4 -3,-1.3 6,-0.3 -4,-0.4 -1,-0.3 0.902 114.2 41.7 -61.1 -45.7 20.8 52.3 -0.9 70 96 A Q H << S+ 0 0 83 -3,-0.7 -2,-0.2 -4,-0.7 -1,-0.2 0.831 111.2 54.9 -75.2 -34.1 17.9 52.6 -3.3 71 97 A I H < S+ 0 0 60 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.812 115.3 44.7 -66.6 -24.2 18.3 49.0 -4.6 72 98 A L S >< S+ 0 0 6 -4,-1.4 3,-1.2 -5,-0.4 -1,-0.3 -0.742 71.9 170.8-118.4 78.5 18.0 48.2 -0.9 73 99 A P T 3 S+ 0 0 67 0, 0.0 25,-0.2 0, 0.0 -1,-0.1 0.502 73.7 53.2 -72.4 -3.5 15.1 50.4 0.3 74 100 A L T 3 + 0 0 88 -23,-0.2 2,-0.6 -25,-0.2 -4,-0.1 0.011 69.6 137.4-120.2 31.0 14.8 48.7 3.7 75 101 A L < + 0 0 7 -3,-1.2 -22,-0.2 -6,-0.3 -23,-0.2 -0.664 14.3 158.9 -79.4 112.3 18.4 49.1 4.9 76 102 A K + 0 0 83 -24,-3.2 24,-3.1 -2,-0.6 25,-1.7 0.837 64.6 31.5-102.6 -49.7 18.3 50.2 8.6 77 103 A V E -de 53 101A 31 -25,-1.3 -23,-0.7 23,-0.2 2,-0.4 -0.916 65.7-178.2-114.2 109.9 21.7 49.3 10.0 78 104 A L E -de 54 102A 6 23,-2.0 25,-1.3 -2,-0.6 2,-0.4 -0.843 5.4-168.4-100.8 137.5 24.7 49.4 7.7 79 105 A N E +de 55 103A 17 -25,-1.9 -23,-1.9 -2,-0.4 25,-0.1 -0.978 22.7 156.6-129.6 121.5 28.1 48.4 9.1 80 106 A L > + 0 0 0 23,-2.8 3,-0.9 -2,-0.4 26,-0.3 -0.101 22.3 159.4-132.9 39.0 31.4 49.0 7.3 81 107 A Q T 3 + 0 0 23 1,-0.2 -23,-2.2 24,-0.1 -22,-0.4 -0.051 65.2 8.4 -59.4 155.5 33.9 49.0 10.2 82 108 A H T 3 S+ 0 0 100 -25,-0.2 -1,-0.2 -24,-0.1 25,-0.1 0.720 95.7 133.4 40.6 39.9 37.6 48.4 9.5 83 109 A N < - 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