==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-NOV-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 15-MAY-12 4F7C . COMPND 2 MOLECULE: CD1D ANTIGEN, D POLYPEPTIDE; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR J.WANG,D.M.ZAJONC . 726 7 4 3 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37546.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 500 68.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 267 36.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 14 1.9 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 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 50 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 114 15.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.1 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 0 2 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 4 10 4 9 2 6 1 3 6 1 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 4 4 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 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 P 0 0 152 0, 0.0 2,-0.8 0, 0.0 26,-0.1 0.000 360.0 360.0 360.0 -37.8 -51.5 16.6 -1.5 2 8 A F - 0 0 66 24,-0.1 2,-0.2 163,-0.0 163,-0.0 -0.637 360.0-161.5 -81.7 102.1 -48.7 14.3 -0.2 3 9 A S - 0 0 52 -2,-0.8 24,-2.4 94,-0.1 2,-0.4 -0.483 11.5-133.0 -79.9 150.9 -46.8 12.6 -3.1 4 10 A F E +AB 26 96A 12 92,-1.4 92,-0.7 22,-0.2 2,-0.3 -0.853 26.8 177.6-103.3 143.0 -44.7 9.5 -2.9 5 11 A Q E -AB 25 95A 48 20,-1.8 20,-2.7 -2,-0.4 2,-0.4 -0.964 16.6-159.2-153.1 123.2 -41.2 9.5 -4.5 6 12 A G E -AB 24 94A 15 88,-1.7 88,-1.9 -2,-0.3 2,-0.4 -0.896 17.0-163.5-106.6 131.8 -38.5 6.9 -4.6 7 13 A L E -AB 23 93A 8 16,-3.6 16,-1.8 -2,-0.4 2,-0.4 -0.939 9.5-169.4-124.4 139.1 -35.0 8.1 -5.3 8 14 A Q E -AB 22 92A 20 84,-2.4 84,-1.6 -2,-0.4 2,-0.5 -0.981 3.1-168.6-124.4 134.5 -31.8 6.3 -6.4 9 15 A I E +AB 21 91A 9 12,-3.1 12,-2.2 -2,-0.4 2,-0.4 -0.944 12.4 178.0-122.5 111.4 -28.3 7.7 -6.6 10 16 A S E -AB 20 90A 0 80,-2.8 80,-2.5 -2,-0.5 2,-0.4 -0.918 3.6-174.6-111.1 136.0 -25.8 5.6 -8.4 11 17 A S E -AB 19 89A 8 8,-2.8 8,-2.0 -2,-0.4 2,-0.4 -0.994 11.5-172.8-129.8 138.9 -22.2 6.5 -9.0 12 18 A F E +AB 18 88A 0 76,-2.2 76,-2.7 -2,-0.4 6,-0.2 -0.958 5.3 176.5-128.5 109.9 -19.4 4.8 -10.9 13 19 A A S S- 0 0 37 4,-1.8 2,-0.2 -2,-0.4 -1,-0.1 0.930 72.2 -32.2 -75.3 -48.6 -16.0 6.4 -10.5 14 20 A N S S- 0 0 77 3,-1.0 3,-0.3 72,-0.1 -1,-0.3 -0.759 85.2 -69.7-155.2-171.7 -14.2 3.8 -12.6 15 21 A R S S+ 0 0 117 -2,-0.2 3,-0.1 1,-0.2 61,-0.0 0.629 130.3 47.1 -71.1 -8.7 -14.6 0.0 -13.2 16 22 A S S S+ 0 0 114 1,-0.2 2,-0.5 -4,-0.0 -1,-0.2 0.737 105.0 56.3-106.2 -24.1 -13.6 -0.7 -9.7 17 23 A W + 0 0 122 -3,-0.3 -4,-1.8 2,-0.0 -3,-1.0 -0.948 57.4 144.7-122.1 129.4 -15.5 1.7 -7.5 18 24 A T E -A 12 0A 33 -2,-0.5 2,-0.3 -6,-0.2 -6,-0.2 -0.988 18.1-172.0-152.4 149.2 -19.3 2.2 -7.4 19 25 A R E -A 11 0A 65 -8,-2.0 -8,-2.8 -2,-0.3 2,-0.4 -0.986 4.2-166.7-146.5 147.6 -22.0 3.0 -4.9 20 26 A T E +A 10 0A 9 -2,-0.3 2,-0.3 -10,-0.2 -10,-0.2 -0.979 11.4 174.0-132.8 119.0 -25.8 3.0 -4.9 21 27 A D E -A 9 0A 21 -12,-2.2 -12,-3.1 -2,-0.4 2,-0.3 -0.903 7.8-167.8-120.1 149.8 -28.0 4.6 -2.2 22 28 A G E +AC 8 34A 14 12,-2.1 12,-2.8 -2,-0.3 2,-0.3 -0.918 10.5 167.1-131.7 161.2 -31.7 5.1 -2.2 23 29 A L E -AC 7 33A 9 -16,-1.8 -16,-3.6 -2,-0.3 2,-0.3 -0.952 16.9-144.5-159.0 173.7 -34.4 7.0 -0.2 24 30 A A E -AC 6 32A 6 8,-1.3 8,-0.7 -2,-0.3 2,-0.4 -0.995 3.9-149.6-147.4 147.1 -38.0 7.9 -0.4 25 31 A W E -A 5 0A 46 -20,-2.7 -20,-1.8 -2,-0.3 2,-0.5 -0.948 4.5-165.1-117.8 140.8 -40.3 10.8 0.5 26 32 A L E > S-AC 4 29A 0 3,-3.3 3,-2.7 -2,-0.4 2,-0.4 -0.987 79.8 -45.9-120.3 118.3 -43.9 10.9 1.5 27 33 A G T 3 S- 0 0 28 -24,-2.4 -22,-0.0 -2,-0.5 145,-0.0 -0.506 123.7 -31.8 48.7-114.6 -44.9 14.4 1.2 28 34 A E T 3 S+ 0 0 47 -2,-0.4 2,-0.3 144,-0.1 -1,-0.3 0.265 120.4 95.2-113.9 10.0 -41.9 16.0 3.0 29 35 A L E < -C 26 0A 2 -3,-2.7 -3,-3.3 2,-0.0 143,-0.0 -0.775 68.9-135.1-100.6 148.1 -41.1 13.2 5.4 30 36 A Q E + 0 0 36 -2,-0.3 -5,-0.2 -5,-0.2 -2,-0.0 -0.844 25.8 172.4-107.0 98.6 -38.5 10.5 4.7 31 37 A P E + 0 0 1 0, 0.0 13,-3.0 0, 0.0 14,-0.6 0.773 61.2 24.7 -76.0 -26.6 -39.9 7.0 5.6 32 38 A Y E -CD 24 43A 13 -8,-0.7 -8,-1.3 11,-0.2 2,-0.3 -0.923 49.2-177.3-136.0 157.2 -37.0 4.9 4.1 33 39 A T E -CD 23 42A 9 9,-1.1 9,-2.7 -2,-0.3 2,-0.4 -0.971 9.3-162.6-140.8 155.8 -33.4 4.7 3.1 34 40 A W E -C 22 0A 24 -12,-2.8 -12,-2.1 -2,-0.3 7,-0.1 -0.823 17.0-162.9-132.7 98.1 -31.3 2.1 1.5 35 41 A R > - 0 0 57 -2,-0.4 3,-0.6 5,-0.3 -14,-0.2 -0.431 30.6-114.2 -72.1 152.6 -27.6 2.7 2.0 36 42 A N T 3 S+ 0 0 55 1,-0.2 -1,-0.1 -2,-0.1 -15,-0.1 0.850 114.7 54.7 -49.3 -42.9 -25.1 0.9 -0.2 37 43 A E T 3 S+ 0 0 134 2,-0.0 -1,-0.2 -18,-0.0 2,-0.1 0.855 94.4 84.5 -62.9 -36.5 -23.7 -1.0 2.8 38 44 A S < - 0 0 15 -3,-0.6 4,-0.0 1,-0.1 3,-0.0 -0.408 60.2-158.9 -79.6 142.0 -27.0 -2.4 3.8 39 45 A D S S+ 0 0 111 -2,-0.1 2,-0.3 2,-0.1 -1,-0.1 0.406 84.9 39.2 -89.2 -2.8 -28.5 -5.5 2.4 40 46 A T S S- 0 0 61 -5,-0.1 -5,-0.3 25,-0.0 2,-0.2 -0.920 88.7-100.0-142.5 166.2 -31.8 -4.2 3.5 41 47 A I - 0 0 18 -2,-0.3 2,-0.5 -7,-0.1 -7,-0.2 -0.607 29.9-125.1 -92.5 148.3 -33.8 -1.0 3.8 42 48 A R E -D 33 0A 123 -9,-2.7 -9,-1.1 -2,-0.2 2,-0.9 -0.817 8.8-144.9 -88.6 127.7 -34.3 1.1 6.9 43 49 A F E -D 32 0A 54 -2,-0.5 -11,-0.2 -11,-0.2 6,-0.1 -0.834 17.1-171.7 -86.4 105.1 -37.8 1.9 8.1 44 50 A L + 0 0 81 -13,-3.0 -12,-0.2 -2,-0.9 -1,-0.1 0.522 64.3 44.4 -82.1 -4.5 -37.1 5.4 9.5 45 51 A K S > S- 0 0 46 -14,-0.6 3,-1.8 1,-0.1 4,-0.3 -0.973 80.8-121.3-137.1 152.9 -40.6 5.8 11.0 46 52 A P T 3 S+ 0 0 122 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.740 118.1 47.5 -67.3 -17.5 -42.8 3.6 13.1 47 53 A W T > S+ 0 0 16 1,-0.2 3,-1.9 2,-0.1 120,-0.2 0.372 81.4 101.0 -96.0 5.0 -45.5 3.9 10.4 48 54 A S T < S+ 0 0 0 -3,-1.8 -1,-0.2 1,-0.3 116,-0.1 0.804 72.8 63.3 -62.5 -29.6 -43.0 3.2 7.6 49 55 A R T > S- 0 0 100 -4,-0.3 3,-1.2 -3,-0.3 -1,-0.3 0.651 83.8-174.1 -70.4 -15.6 -44.3 -0.4 7.4 50 56 A G T < - 0 0 17 -3,-1.9 -1,-0.2 1,-0.2 114,-0.1 -0.253 59.6 -44.7 58.4-139.8 -47.8 0.9 6.3 51 57 A T T 3 S+ 0 0 66 109,-0.2 2,-0.3 108,-0.2 -1,-0.2 0.284 100.6 128.4-107.2 7.5 -50.4 -1.9 6.1 52 58 A F < - 0 0 13 -3,-1.2 5,-0.0 108,-0.1 108,-0.0 -0.484 58.1-125.8 -68.3 127.5 -48.0 -4.2 4.2 53 59 A S > - 0 0 39 -2,-0.3 4,-2.1 1,-0.1 5,-0.1 -0.093 23.8-108.6 -61.4 166.7 -47.6 -7.7 5.6 54 60 A D H > S+ 0 0 116 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.893 121.2 50.6 -64.7 -41.7 -44.1 -9.1 6.6 55 61 A Q H > S+ 0 0 150 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.866 109.3 52.6 -65.5 -36.3 -44.2 -11.5 3.6 56 62 A Q H > S+ 0 0 40 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.925 111.6 45.2 -63.4 -47.1 -45.1 -8.6 1.3 57 63 A W H X S+ 0 0 8 -4,-2.1 4,-3.2 2,-0.2 -2,-0.2 0.955 110.5 53.1 -61.0 -51.5 -42.1 -6.6 2.6 58 64 A E H X S+ 0 0 119 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.894 110.9 48.3 -50.0 -44.8 -39.7 -9.5 2.3 59 65 A Q H X S+ 0 0 96 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.966 112.7 46.4 -60.8 -54.1 -40.8 -10.0 -1.3 60 66 A L H X S+ 0 0 9 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.886 112.2 52.4 -56.5 -46.3 -40.4 -6.2 -2.1 61 67 A Q H X S+ 0 0 27 -4,-3.2 4,-2.8 2,-0.2 -1,-0.2 0.964 110.4 46.7 -47.1 -61.7 -37.0 -6.2 -0.4 62 68 A H H X S+ 0 0 102 -4,-2.5 4,-3.2 1,-0.3 5,-0.3 0.874 110.7 52.2 -56.0 -45.2 -35.7 -9.1 -2.4 63 69 A T H X S+ 0 0 34 -4,-2.6 4,-2.4 2,-0.2 -1,-0.3 0.945 112.3 45.7 -54.2 -49.4 -36.9 -7.7 -5.6 64 70 A L H X S+ 0 0 49 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.879 112.7 52.4 -66.0 -35.3 -35.2 -4.4 -4.9 65 71 A L H X S+ 0 0 46 -4,-2.8 4,-1.8 2,-0.2 5,-0.2 0.955 109.4 45.6 -64.8 -53.8 -32.1 -6.3 -3.8 66 72 A V H X S+ 0 0 74 -4,-3.2 4,-2.9 1,-0.2 3,-0.3 0.958 113.0 54.2 -54.1 -48.2 -31.8 -8.4 -7.0 67 73 A Y H X S+ 0 0 86 -4,-2.4 4,-3.5 -5,-0.3 -1,-0.2 0.878 103.9 54.1 -49.5 -47.4 -32.4 -5.2 -8.9 68 74 A R H X S+ 0 0 34 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.905 114.0 40.5 -60.4 -43.4 -29.6 -3.3 -7.2 69 75 A S H X S+ 0 0 75 -4,-1.8 4,-2.4 -3,-0.3 -1,-0.2 0.922 118.1 46.7 -68.3 -47.7 -26.9 -6.0 -8.1 70 76 A S H X S+ 0 0 29 -4,-2.9 4,-2.9 -5,-0.2 -2,-0.2 0.929 110.6 53.7 -61.6 -47.0 -28.3 -6.6 -11.6 71 77 A F H X S+ 0 0 23 -4,-3.5 4,-2.5 -5,-0.3 -2,-0.2 0.950 109.7 47.2 -51.0 -56.4 -28.5 -2.9 -12.2 72 78 A T H X S+ 0 0 20 -4,-2.0 4,-2.2 -5,-0.2 5,-0.2 0.955 113.4 47.8 -51.7 -57.5 -24.8 -2.3 -11.3 73 79 A R H X S+ 0 0 120 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.898 111.0 52.3 -51.2 -44.8 -23.7 -5.3 -13.4 74 80 A D H X S+ 0 0 59 -4,-2.9 4,-2.3 2,-0.2 -1,-0.2 0.910 107.5 50.5 -64.3 -43.7 -25.7 -4.1 -16.4 75 81 A I H X S+ 0 0 28 -4,-2.5 4,-2.6 2,-0.2 3,-0.3 0.972 108.6 52.5 -54.6 -54.6 -24.3 -0.5 -16.3 76 82 A W H X S+ 0 0 44 -4,-2.2 4,-1.9 1,-0.3 -1,-0.2 0.896 112.2 46.3 -51.8 -41.0 -20.7 -1.8 -16.2 77 83 A E H X S+ 0 0 108 -4,-2.0 4,-2.2 -5,-0.2 -1,-0.3 0.857 110.4 51.7 -72.9 -33.1 -21.5 -3.9 -19.3 78 84 A F H X S+ 0 0 30 -4,-2.3 4,-1.1 -3,-0.3 -1,-0.2 0.814 109.8 52.4 -69.1 -31.1 -23.2 -1.1 -21.1 79 85 A V H X>S+ 0 0 8 -4,-2.6 5,-1.2 -5,-0.2 4,-0.9 0.916 112.7 41.8 -69.7 -47.4 -20.2 1.0 -20.5 80 86 A E H ><5S+ 0 0 96 -4,-1.9 3,-0.9 -5,-0.2 -2,-0.2 0.967 118.3 45.4 -64.4 -53.6 -17.7 -1.5 -21.9 81 87 A K H 3<5S+ 0 0 141 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.721 124.2 35.0 -65.9 -22.5 -19.8 -2.4 -24.9 82 88 A L H 3<5S- 0 0 40 -4,-1.1 -1,-0.2 -5,-0.2 -2,-0.2 0.399 98.9-130.2-113.1 6.9 -20.6 1.2 -25.6 83 89 A H T <<5 + 0 0 169 -3,-0.9 2,-0.4 -4,-0.9 -3,-0.2 0.927 43.9 163.4 38.9 61.7 -17.3 3.0 -24.6 84 90 A V < - 0 0 28 -5,-1.2 2,-0.3 -6,-0.1 -1,-0.2 -0.862 34.0-121.4 -99.3 146.1 -18.8 5.7 -22.5 85 91 A E - 0 0 167 -2,-0.4 -71,-0.0 2,-0.1 -6,-0.0 -0.612 32.9 -79.7 -99.2 148.5 -16.3 7.3 -20.2 86 92 A Y S S+ 0 0 61 -2,-0.3 2,-0.1 2,-0.1 -73,-0.1 -0.318 87.6 61.1 -76.9 165.6 -16.2 7.7 -16.5 87 93 A P - 0 0 79 0, 0.0 2,-0.4 0, 0.0 -74,-0.2 0.710 67.2-169.9 -76.1 165.5 -17.1 9.0 -14.1 88 94 A L E -B 12 0A 3 -76,-2.7 -76,-2.2 -2,-0.1 2,-0.4 -0.977 13.6-170.3-120.6 139.8 -20.9 8.2 -14.3 89 95 A E E -B 11 0A 6 -2,-0.4 21,-2.3 -78,-0.2 2,-0.4 -0.994 10.2-179.3-125.4 119.9 -23.7 9.6 -12.4 90 96 A I E -BE 10 109A 17 -80,-2.5 -80,-2.8 -2,-0.4 2,-0.4 -0.983 2.3-174.0-120.9 133.7 -27.1 7.9 -12.8 91 97 A Q E -BE 9 108A 1 17,-2.6 17,-3.0 -2,-0.4 2,-0.4 -0.980 2.3-169.6-127.4 139.1 -30.3 9.0 -11.0 92 98 A I E -BE 8 107A 22 -84,-1.6 -84,-2.4 -2,-0.4 2,-0.4 -0.982 2.1-173.0-130.3 138.7 -33.7 7.4 -10.9 93 99 A A E +BE 7 106A 5 13,-2.7 13,-3.2 -2,-0.4 2,-0.2 -0.989 11.5 162.6-132.2 122.4 -37.0 8.7 -9.6 94 100 A T E +BE 6 105A 15 -88,-1.9 -88,-1.7 -2,-0.4 2,-0.2 -0.656 16.3 117.6-117.1-175.8 -40.3 6.7 -9.3 95 101 A G E -BE 5 104A 0 9,-1.1 9,-2.2 -90,-0.3 2,-0.3 -0.818 38.8-123.4 145.1 179.4 -43.4 7.4 -7.4 96 102 A C E -BE 4 103A 3 -92,-0.7 -92,-1.4 -2,-0.2 2,-0.5 -0.979 3.5-144.6-156.3 147.0 -47.2 8.1 -7.7 97 103 A E E - 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