==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JUN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 24-FEB-11 3QUX . COMPND 2 MOLECULE: ANTIGEN-PRESENTING GLYCOPROTEIN CD1D1; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR Y.LI,E.GIRARDI,E.D.YU,D.M.ZAJONC . 804 5 8 7 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 39060.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 523 65.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 2.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 298 37.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 11 1.4 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 . 1 0.1 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 . 70 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 58 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 65 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.5 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 0 0 2 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 RESIDUES PER ALPHA HELIX . 2 0 0 0 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 PARALLEL BRIDGES PER LADDER . 3 10 9 6 5 8 5 1 3 1 1 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 4 3 1 1 1 0 0 1 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 7 A N 0 0 155 0, 0.0 2,-0.4 0, 0.0 100,-0.2 0.000 360.0 360.0 360.0 125.7 0.2 -0.8 16.5 2 8 A Y E -A 100 0A 72 98,-1.1 98,-3.6 25,-0.1 2,-0.6 -0.963 360.0-149.3-126.4 136.9 -0.0 2.5 18.3 3 9 A T E -A 99 0A 35 -2,-0.4 24,-2.6 96,-0.2 2,-0.6 -0.919 8.2-155.2-106.0 123.2 0.2 6.1 17.0 4 10 A F E -AB 98 26A 11 94,-3.2 94,-0.9 -2,-0.6 2,-0.4 -0.859 18.4-172.3 -93.1 121.2 1.6 8.8 19.3 5 11 A R E -AB 97 25A 86 20,-3.4 20,-2.6 -2,-0.6 2,-0.6 -0.963 21.5-171.2-122.1 127.9 0.3 12.3 18.4 6 12 A C E -AB 96 24A 42 90,-3.2 90,-2.2 -2,-0.4 2,-0.6 -0.973 20.5-164.6-107.9 117.4 1.2 15.7 19.6 7 13 A L E -AB 95 23A 3 16,-2.8 16,-1.7 -2,-0.6 2,-0.4 -0.916 4.6-169.2-112.0 119.1 -1.2 18.1 18.1 8 14 A Q E -AB 94 22A 13 86,-2.9 86,-1.5 -2,-0.6 2,-0.4 -0.868 6.6-173.5-108.3 138.2 -0.5 21.8 18.1 9 15 A M E +AB 93 21A 9 12,-2.2 12,-2.3 -2,-0.4 2,-0.4 -0.994 6.3 177.4-126.5 127.2 -2.9 24.6 17.2 10 16 A S E -AB 92 20A 0 82,-3.0 82,-2.7 -2,-0.4 2,-0.5 -0.995 7.5-167.4-130.0 130.5 -1.7 28.2 17.0 11 17 A S E -AB 91 19A 22 8,-2.4 8,-1.7 -2,-0.4 2,-0.6 -0.966 4.1-169.5-118.5 127.9 -3.8 31.1 16.0 12 18 A F E +AB 90 18A 2 78,-2.9 78,-2.7 -2,-0.5 6,-0.2 -0.924 6.9 177.1-118.2 104.5 -2.4 34.5 15.2 13 19 A A - 0 0 41 4,-1.3 2,-0.2 -2,-0.6 -1,-0.2 0.947 67.8 -22.8 -72.5 -52.5 -5.2 37.1 14.9 14 20 A N S S- 0 0 81 3,-0.9 -1,-0.1 74,-0.1 76,-0.1 -0.721 89.7 -69.1-144.5-171.1 -3.1 40.2 14.3 15 21 A R S S+ 0 0 134 -2,-0.2 64,-0.0 1,-0.2 3,-0.0 0.723 130.2 33.1 -66.0 -20.8 0.6 41.2 15.0 16 22 A S S S+ 0 0 97 1,-0.1 2,-0.4 -4,-0.0 -1,-0.2 0.871 105.0 70.5-101.0 -43.6 -0.0 41.4 18.8 17 23 A W + 0 0 130 -5,-0.0 -4,-1.3 2,-0.0 -3,-0.9 -0.633 55.0 138.5 -89.2 130.1 -2.6 38.7 19.7 18 24 A S E -B 12 0A 27 -2,-0.4 2,-0.3 -6,-0.2 -6,-0.2 -0.986 24.8-164.4-157.5 161.4 -2.0 34.9 19.6 19 25 A R E -B 11 0A 81 -8,-1.7 -8,-2.4 -2,-0.3 2,-0.4 -0.989 3.8-160.7-148.6 152.6 -2.6 31.6 21.4 20 26 A T E +B 10 0A 2 -2,-0.3 2,-0.4 -10,-0.2 -10,-0.2 -0.986 11.6 174.7-139.0 122.8 -1.2 28.1 21.3 21 27 A D E -B 9 0A 39 -12,-2.3 -12,-2.2 -2,-0.4 2,-0.3 -0.992 6.2-170.8-130.6 135.6 -2.8 24.9 22.6 22 28 A S E -BC 8 34A 20 12,-2.5 12,-3.1 -2,-0.4 2,-0.3 -0.931 6.0-171.2-124.3 149.7 -1.6 21.3 22.4 23 29 A V E -BC 7 33A 4 -16,-1.7 -16,-2.8 -2,-0.3 2,-0.5 -0.965 15.9-140.2-131.3 153.5 -3.1 17.9 23.2 24 30 A V E -BC 6 32A 18 8,-2.5 7,-4.3 -2,-0.3 8,-1.1 -0.953 15.4-169.8-125.9 119.7 -1.4 14.5 23.2 25 31 A W E -BC 5 30A 37 -20,-2.6 -20,-3.4 -2,-0.5 2,-0.4 -0.843 16.9-172.9-108.3 139.3 -2.9 11.2 21.9 26 32 A L E > S-BC 4 29A 0 3,-2.2 3,-1.1 -2,-0.4 2,-0.3 -0.909 81.9 -43.8-122.2 98.7 -1.7 7.6 22.2 27 33 A G T 3 S- 0 0 26 -24,-2.6 -22,-0.1 -2,-0.4 -25,-0.1 -0.650 122.0 -29.0 72.9-133.9 -4.2 5.8 20.0 28 34 A D T 3 S+ 0 0 49 -2,-0.3 2,-0.4 -3,-0.1 -1,-0.2 0.104 119.8 94.8-100.6 21.7 -7.6 7.2 20.8 29 35 A L E < S-C 26 0A 1 -3,-1.1 -3,-2.2 148,-0.0 2,-0.4 -0.950 74.0-126.8-114.7 131.2 -6.8 8.1 24.4 30 36 A Q E +C 25 0A 23 -2,-0.4 -5,-0.3 -5,-0.2 3,-0.1 -0.598 29.1 172.8 -77.3 129.7 -5.6 11.6 25.5 31 37 A T E + 0 0 0 -7,-4.3 13,-2.2 -2,-0.4 14,-0.7 0.716 61.8 17.8-105.4 -29.1 -2.4 11.5 27.5 32 38 A H E -CD 24 43A 6 -8,-1.1 -8,-2.5 11,-0.3 2,-0.4 -0.974 52.9-164.9-144.2 156.7 -1.5 15.2 27.9 33 39 A R E -CD 23 42A 95 9,-2.5 9,-3.3 -2,-0.3 2,-0.4 -0.987 5.0-178.0-141.1 132.9 -3.1 18.6 27.6 34 40 A W E -C 22 0A 15 -12,-3.1 -12,-2.5 -2,-0.4 2,-0.2 -0.847 10.4-167.0-135.1 100.9 -1.2 21.9 27.4 35 41 A S > - 0 0 29 -2,-0.4 3,-1.3 5,-0.3 -14,-0.2 -0.492 31.9-121.4 -83.9 153.3 -3.4 25.1 27.3 36 42 A N T 3 S+ 0 0 53 1,-0.3 -1,-0.1 -2,-0.2 -15,-0.1 0.843 115.2 59.4 -55.8 -34.4 -2.1 28.5 26.3 37 43 A D T 3 S+ 0 0 132 2,-0.0 2,-0.4 -18,-0.0 -1,-0.3 0.719 96.0 79.2 -67.0 -24.5 -3.3 29.6 29.8 38 44 A S < - 0 0 31 -3,-1.3 4,-0.0 1,-0.1 0, 0.0 -0.724 63.2-155.5 -99.0 136.6 -1.0 27.1 31.5 39 45 A A S S+ 0 0 70 -2,-0.4 2,-0.3 2,-0.0 -1,-0.1 0.693 83.1 43.2 -71.8 -21.1 2.8 27.4 32.2 40 46 A T S S- 0 0 61 -5,-0.0 2,-0.3 25,-0.0 -5,-0.3 -0.867 89.0-104.1-129.9 154.0 3.1 23.6 32.3 41 47 A I - 0 0 22 -2,-0.3 2,-0.4 -7,-0.1 -7,-0.2 -0.656 39.1-137.5 -75.3 133.6 1.9 20.5 30.4 42 48 A S E -D 33 0A 41 -9,-3.3 -9,-2.5 -2,-0.3 2,-0.4 -0.786 6.8-129.0 -98.0 136.5 -0.9 18.7 32.3 43 49 A F E -D 32 0A 76 -2,-0.4 -11,-0.3 -11,-0.2 -12,-0.1 -0.699 17.8-173.7 -76.7 127.6 -1.1 14.9 32.5 44 50 A T S S+ 0 0 38 -13,-2.2 -12,-0.2 -2,-0.4 -1,-0.1 0.398 74.1 47.7-101.3 3.8 -4.5 13.7 31.5 45 51 A K S > S- 0 0 22 -14,-0.7 3,-1.3 1,-0.1 4,-0.2 -0.960 85.2-121.7-133.9 153.4 -3.6 10.1 32.6 46 52 A P T 3 S+ 0 0 120 0, 0.0 3,-0.4 0, 0.0 -1,-0.1 0.902 115.9 43.3 -57.6 -37.4 -1.9 8.8 35.8 47 53 A W T > S+ 0 0 25 1,-0.2 3,-1.9 2,-0.1 126,-0.2 0.049 74.0 117.2-100.1 23.3 0.8 7.3 33.6 48 54 A S T < S+ 0 0 0 -3,-1.3 -1,-0.2 1,-0.3 3,-0.1 0.779 70.4 63.6 -64.9 -26.7 1.4 10.2 31.2 49 55 A Q T > S- 0 0 39 -3,-0.4 3,-1.8 1,-0.2 -1,-0.3 0.608 89.6-167.1 -69.3 -11.9 5.0 10.7 32.5 50 56 A G T < - 0 0 16 -3,-1.9 -1,-0.2 1,-0.2 119,-0.1 -0.336 58.3 -31.2 58.6-133.9 5.6 7.2 31.1 51 57 A K T 3 S+ 0 0 130 114,-0.4 -1,-0.2 113,-0.2 2,-0.2 0.181 102.4 122.9-104.7 16.8 8.9 5.7 32.4 52 58 A L < - 0 0 21 -3,-1.8 2,-0.1 113,-0.1 -3,-0.0 -0.525 62.0-121.7 -76.8 143.1 10.8 9.1 32.7 53 59 A S > - 0 0 55 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.409 30.7-106.3 -71.4 160.8 12.3 10.2 36.0 54 60 A N H > S+ 0 0 124 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.939 123.8 51.8 -54.6 -47.8 11.1 13.5 37.4 55 61 A Q H > S+ 0 0 165 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.887 109.4 50.3 -55.4 -43.0 14.4 15.0 36.5 56 62 A Q H > S+ 0 0 94 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.901 114.5 43.0 -62.5 -45.3 14.0 13.7 32.9 57 63 A W H X S+ 0 0 28 -4,-2.5 4,-3.4 2,-0.2 5,-0.3 0.921 109.4 56.4 -67.1 -45.1 10.5 15.1 32.5 58 64 A E H X S+ 0 0 56 -4,-3.3 4,-2.0 1,-0.3 -2,-0.2 0.922 112.0 45.0 -52.4 -44.0 11.4 18.4 34.2 59 65 A K H X S+ 0 0 156 -4,-2.0 4,-1.1 -5,-0.2 -1,-0.3 0.827 113.7 48.8 -69.3 -34.9 14.1 18.8 31.5 60 66 A L H X S+ 0 0 27 -4,-1.5 4,-1.2 2,-0.2 -2,-0.2 0.891 111.1 49.2 -75.0 -39.4 11.8 17.8 28.7 61 67 A Q H X S+ 0 0 27 -4,-3.4 4,-3.3 1,-0.2 3,-0.3 0.904 108.1 53.9 -64.1 -42.9 8.9 20.1 29.8 62 68 A H H X S+ 0 0 105 -4,-2.0 4,-2.3 -5,-0.3 -1,-0.2 0.817 103.4 57.3 -63.3 -31.6 11.3 23.1 30.0 63 69 A M H X S+ 0 0 47 -4,-1.1 4,-1.5 2,-0.2 -1,-0.2 0.873 112.5 40.5 -65.0 -39.5 12.5 22.4 26.4 64 70 A F H X S+ 0 0 59 -4,-1.2 4,-2.8 -3,-0.3 5,-0.2 0.910 110.0 58.6 -73.9 -44.0 8.8 22.7 25.3 65 71 A Q H X S+ 0 0 57 -4,-3.3 4,-1.0 1,-0.2 -2,-0.2 0.893 110.6 43.3 -49.1 -44.1 8.3 25.6 27.6 66 72 A V H X S+ 0 0 31 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.869 112.0 55.3 -70.1 -37.2 11.1 27.4 25.8 67 73 A Y H X S+ 0 0 68 -4,-1.5 4,-4.3 1,-0.2 5,-0.3 0.935 101.2 55.5 -63.4 -48.3 9.8 26.3 22.4 68 74 A R H X S+ 0 0 37 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.879 110.8 45.1 -53.8 -43.8 6.3 27.7 22.8 69 75 A V H X S+ 0 0 101 -4,-1.0 4,-1.9 -5,-0.2 -1,-0.2 0.916 118.1 44.4 -64.3 -43.0 7.7 31.2 23.4 70 76 A S H X S+ 0 0 15 -4,-1.9 4,-3.4 2,-0.2 -2,-0.2 0.962 110.0 53.2 -69.5 -51.9 10.1 30.9 20.6 71 77 A F H X S+ 0 0 22 -4,-4.3 4,-2.5 1,-0.2 5,-0.2 0.886 109.2 51.5 -46.0 -45.3 7.6 29.4 18.1 72 78 A T H X S+ 0 0 25 -4,-1.7 4,-1.9 -5,-0.3 -1,-0.2 0.926 113.6 41.8 -64.9 -45.7 5.3 32.3 18.8 73 79 A R H X S+ 0 0 50 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.866 112.6 55.8 -70.4 -36.2 8.0 34.9 18.2 74 80 A D H X S+ 0 0 22 -4,-3.4 4,-3.5 2,-0.2 3,-0.3 0.954 107.9 45.8 -63.4 -51.0 9.4 33.1 15.2 75 81 A I H X S+ 0 0 24 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.954 110.8 55.1 -53.8 -50.7 6.1 32.9 13.3 76 82 A Q H X S+ 0 0 41 -4,-1.9 4,-1.2 1,-0.2 -1,-0.2 0.840 114.0 40.6 -51.5 -39.7 5.5 36.6 14.1 77 83 A E H X S+ 0 0 5 -4,-1.9 4,-2.0 -3,-0.3 -1,-0.2 0.883 107.5 59.7 -79.8 -41.4 8.8 37.5 12.6 78 84 A L H X S+ 0 0 19 -4,-3.5 4,-1.7 1,-0.2 -2,-0.2 0.835 105.4 52.6 -55.4 -30.7 8.5 35.1 9.6 79 85 A V H X S+ 0 0 18 -4,-2.1 4,-3.4 -5,-0.2 7,-0.3 0.929 107.1 49.9 -67.5 -48.2 5.3 37.2 8.8 80 86 A K H < S+ 0 0 24 -4,-1.2 -2,-0.2 1,-0.2 538,-0.2 0.789 110.7 53.3 -56.5 -30.6 7.3 40.4 8.9 81 87 A M H < S+ 0 0 17 -4,-2.0 -1,-0.2 1,-0.1 -2,-0.2 0.896 117.0 34.0 -75.3 -42.4 9.8 38.7 6.6 82 88 A M H >< S+ 0 0 24 -4,-1.7 3,-1.0 -5,-0.2 -2,-0.2 0.909 94.8 155.1 -79.5 -44.0 7.3 37.7 4.0 83 89 A S T 3< + 0 0 55 -4,-3.4 4,-0.1 1,-0.4 -3,-0.0 0.108 63.3 28.1 -31.2 131.8 5.0 40.7 4.3 84 90 A P T 3 S+ 0 0 133 0, 0.0 -1,-0.4 0, 0.0 3,-0.1 -0.855 114.2 74.0 -90.3 34.6 3.1 41.8 2.3 85 91 A K S < S+ 0 0 122 -3,-1.0 2,-0.3 -6,-0.2 -2,-0.2 0.985 106.7 19.2 -65.4 -60.0 3.1 38.2 1.0 86 92 A E S S- 0 0 59 -7,-0.3 2,-0.3 4,-0.0 -1,-0.2 -0.887 71.7-161.5-121.4 150.8 1.0 36.7 3.8 87 93 A D - 0 0 122 -2,-0.3 -73,-0.0 2,-0.2 -8,-0.0 -0.875 24.9 -68.1-130.3 150.0 -1.4 38.3 6.3 88 94 A Y S S+ 0 0 38 -2,-0.3 -75,-0.2 2,-0.1 2,-0.1 -0.382 90.8 75.9 -63.9 154.1 -3.1 37.7 9.6 89 95 A P S S- 0 0 89 0, 0.0 2,-0.4 0, 0.0 -76,-0.2 0.519 72.3-178.9 -65.3 141.5 -5.3 35.8 10.6 90 96 A I E -A 12 0A 1 -78,-2.7 -78,-2.9 -2,-0.1 2,-0.5 -0.952 15.3-163.3-117.0 140.0 -2.8 33.0 10.5 91 97 A E E -A 11 0A 16 -2,-0.4 24,-2.5 -80,-0.2 2,-0.4 -0.957 9.0-178.3-123.3 112.7 -3.5 29.4 11.5 92 98 A I E -AE 10 114A 11 -82,-2.7 -82,-3.0 -2,-0.5 2,-0.4 -0.920 0.7-178.3-108.5 136.1 -0.6 27.0 12.2 93 99 A Q E -AE 9 113A 0 20,-2.2 20,-3.2 -2,-0.4 2,-0.4 -0.984 5.4-166.9-123.8 144.9 -1.0 23.3 13.1 94 100 A L E -AE 8 112A 18 -86,-1.5 -86,-2.9 -2,-0.4 2,-0.4 -0.990 4.1-170.5-123.8 142.8 1.7 20.8 14.0 95 101 A S E +AE 7 111A 17 16,-2.5 16,-2.8 -2,-0.4 2,-0.3 -0.976 22.0 160.7-128.8 115.0 1.3 17.0 14.1 96 102 A A E +AE 6 110A 19 -90,-2.2 -90,-3.2 -2,-0.4 2,-0.3 -0.980 18.6 75.6-139.0 151.2 4.2 15.2 15.6 97 103 A G E -AE 5 109A 2 12,-1.9 12,-2.4 -2,-0.3 2,-0.3 -0.990 62.7 -80.5 154.1-145.4 5.0 11.8 17.2 98 104 A a E -AE 4 108A 0 -94,-0.9 -94,-3.2 -2,-0.3 2,-0.6 -0.996 16.9-123.8-156.5 154.2 5.5 8.2 15.9 99 105 A E E -AE 3 107A 66 8,-1.8 8,-1.3 -2,-0.3 2,-0.4 -0.918 36.1-141.8 -97.9 118.5 3.8 5.0 14.9 100 106 A M E -AE 2 106A 10 -98,-3.6 -98,-1.1 -2,-0.6 6,-0.2 -0.712 19.9-175.3 -86.8 129.5 5.0 2.2 17.1 101 107 A Y - 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