==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER GLYCOPROTEIN 16-OCT-03 1UQS . COMPND 2 MOLECULE: T-CELL SURFACE GLYCOPROTEIN CD1B; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.BATUWANGALA,D.SHEPHERD,S.D.GADOLA,K.J.C.GIBSON,N.R.ZACCAI, . 380 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20023.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 262 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 . 127 33.4 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 . 3 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 39 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 59 15.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.3 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 2 0 0 0 0 0 0 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 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 . 6 7 4 4 1 1 0 1 1 2 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 1 2 2 0 0 1 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 3 A A 0 0 133 0, 0.0 5,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -68.0 31.0 34.6 18.9 2 4 A F - 0 0 73 3,-0.1 0, 0.0 1,-0.1 0, 0.0 0.366 360.0 -96.8 -71.1 7.5 31.2 34.4 22.7 3 5 A Q S S+ 0 0 74 1,-0.2 -1,-0.1 2,-0.0 3,-0.0 0.960 84.8 44.7 74.9 95.7 30.5 30.6 22.3 4 6 A G S S- 0 0 30 176,-0.1 -1,-0.2 0, 0.0 176,-0.1 -0.960 92.0 -5.6 144.8-161.5 27.1 29.2 22.7 5 7 A P - 0 0 2 0, 0.0 -3,-0.1 0, 0.0 3,-0.1 0.043 37.2-174.9 -56.3 170.3 23.5 29.9 21.6 6 8 A T + 0 0 40 1,-0.4 96,-2.8 94,-0.1 2,-0.3 0.209 68.4 32.1-150.0 -1.6 22.5 33.0 19.7 7 9 A S E -A 101 0A 10 94,-0.2 24,-0.6 161,-0.1 -1,-0.4 -0.993 55.3-155.0-161.5 155.7 18.8 32.5 19.6 8 10 A F E +AB 100 30A 24 92,-1.3 92,-1.1 -2,-0.3 2,-0.3 -0.980 26.0 158.7-131.4 143.3 15.8 31.1 21.4 9 11 A H E -AB 99 29A 31 20,-1.0 20,-3.1 -2,-0.4 90,-0.3 -0.992 31.2-122.6-162.1 160.0 12.7 30.0 19.8 10 12 A V E -AB 98 28A 39 88,-2.9 88,-1.5 -2,-0.3 2,-0.4 -0.610 20.4-151.4-104.8 168.7 9.7 27.8 20.3 11 13 A I E -AB 97 27A 11 16,-1.6 16,-1.6 -2,-0.2 2,-0.4 -0.992 7.3-168.5-142.2 146.3 8.4 25.0 18.1 12 14 A Q E -AB 96 26A 18 84,-2.3 84,-1.1 -2,-0.4 2,-0.6 -0.960 10.4-178.8-142.5 121.7 5.0 23.6 17.4 13 15 A T E +AB 95 25A 2 12,-2.2 12,-2.6 -2,-0.4 2,-0.7 -0.907 12.2 179.1-118.0 102.0 4.0 20.4 15.7 14 16 A S E -AB 94 24A 2 80,-2.4 80,-2.6 -2,-0.6 2,-0.5 -0.917 9.9-163.9-105.4 115.4 0.2 20.2 15.7 15 17 A S E -AB 93 23A 11 8,-3.5 8,-2.4 -2,-0.7 2,-0.7 -0.866 5.8-152.4-104.3 131.3 -1.0 17.1 13.9 16 18 A F E +AB 92 22A 2 76,-3.0 76,-1.3 -2,-0.5 6,-0.2 -0.830 21.6 169.6-110.2 101.4 -4.6 16.8 12.7 17 19 A T E S- 0 0 56 4,-1.6 2,-0.3 -2,-0.7 5,-0.2 0.814 70.7 -36.7 -74.4 -31.3 -5.9 13.2 12.5 18 20 A N E > S- B 0 21A 50 3,-1.6 3,-3.4 72,-0.1 -1,-0.3 -0.942 80.4 -58.1 178.2 165.5 -9.5 14.5 12.0 19 21 A S T 3 S+ 0 0 69 1,-0.3 64,-0.1 -2,-0.3 3,-0.1 0.590 133.2 20.5 -26.5 -37.1 -12.2 17.1 12.8 20 22 A T T 3 S+ 0 0 134 1,-0.1 2,-0.6 60,-0.0 -1,-0.3 0.312 111.0 80.8-123.9 10.4 -12.1 16.4 16.5 21 23 A W E < +B 18 0A 146 -3,-3.4 -4,-1.6 2,-0.0 -3,-1.6 -0.871 49.9 148.9-123.9 100.6 -8.7 14.7 16.9 22 24 A A E -B 16 0A 38 -2,-0.6 2,-0.4 -6,-0.2 -6,-0.2 -0.987 22.0-168.4-131.3 140.4 -5.7 17.0 17.1 23 25 A Q E -B 15 0A 106 -8,-2.4 -8,-3.5 -2,-0.4 2,-0.4 -0.996 7.7-166.3-129.8 122.6 -2.4 16.5 18.9 24 26 A T E -B 14 0A 15 -2,-0.4 2,-0.5 -10,-0.3 -10,-0.3 -0.940 4.1-164.7-118.6 135.2 0.0 19.3 19.4 25 27 A Q E +B 13 0A 72 -12,-2.6 -12,-2.2 -2,-0.4 2,-0.3 -0.949 14.0 180.0-119.2 112.6 3.7 19.0 20.5 26 28 A G E +B 12 0A 15 -2,-0.5 12,-1.1 12,-0.3 2,-0.3 -0.812 6.3 164.2-117.5 155.2 5.6 22.1 21.6 27 29 A S E -BC 11 37A 8 -16,-1.6 -16,-1.6 -2,-0.3 2,-0.4 -0.993 26.9-123.5-160.5 158.9 9.2 22.9 22.9 28 30 A G E -BC 10 36A 0 8,-3.2 7,-2.6 -2,-0.3 8,-2.6 -0.916 31.0-172.9-116.3 132.8 11.7 25.7 23.6 29 31 A W E -BC 9 34A 18 -20,-3.1 -20,-1.0 -2,-0.4 2,-0.3 -0.638 36.8-162.3-126.0 174.3 15.2 26.0 22.2 30 32 A L E > S-BC 8 33A 2 3,-1.0 3,-1.5 -22,-0.2 2,-0.3 -0.850 85.3 -59.1-146.3 94.4 18.7 27.6 22.0 31 33 A D T 3 S- 0 0 66 -24,-0.6 -1,-0.1 -2,-0.3 -22,-0.1 -0.398 120.2 -20.4 56.7-115.1 20.1 26.3 18.7 32 34 A D T 3 S+ 0 0 58 -2,-0.3 2,-0.8 -3,-0.1 -1,-0.3 0.766 117.5 97.5 -92.7 -26.6 20.0 22.6 19.3 33 35 A L E < -C 30 0A 13 -3,-1.5 -3,-1.0 -4,-0.1 2,-0.5 -0.482 67.0-149.7 -67.2 104.4 19.9 22.7 23.0 34 36 A Q E +C 29 0A 23 -2,-0.8 -5,-0.3 -5,-0.2 3,-0.1 -0.641 26.2 166.2 -75.9 125.6 16.3 22.3 24.1 35 37 A I E + 0 0 0 -7,-2.6 13,-2.0 -2,-0.5 2,-0.4 0.541 59.4 56.8-113.9 -13.6 15.7 24.1 27.3 36 38 A H E -CD 28 47A 29 -8,-2.6 -8,-3.2 11,-0.2 2,-0.3 -0.976 57.1-174.5-126.0 132.3 11.9 24.1 27.4 37 39 A G E -CD 27 46A 4 9,-2.9 9,-2.1 -2,-0.4 2,-0.6 -0.866 15.4-146.3-117.0 152.5 9.5 21.2 27.2 38 40 A W - 0 0 37 -12,-1.1 2,-0.8 -2,-0.3 -12,-0.3 -0.964 8.3-147.8-120.8 110.3 5.8 21.6 27.0 39 41 A D > - 0 0 65 -2,-0.6 4,-1.4 1,-0.2 5,-0.4 -0.726 23.1-158.3 -77.2 116.9 3.9 18.9 28.8 40 42 A S T 4 S+ 0 0 52 -2,-0.8 -1,-0.2 1,-0.2 -15,-0.1 0.987 71.9 47.4 -64.9 -80.8 0.9 18.6 26.6 41 43 A D T 4 S+ 0 0 156 1,-0.2 -1,-0.2 2,-0.1 -2,-0.1 0.679 119.2 46.7 -42.1 -21.1 -2.4 17.2 27.9 42 44 A S T 4 S- 0 0 71 -3,-0.1 -1,-0.2 3,-0.0 -2,-0.2 0.957 97.9-130.7 -83.9 -68.5 -1.9 19.4 31.0 43 45 A G < + 0 0 6 -4,-1.4 26,-0.2 29,-0.0 -3,-0.1 0.304 69.3 103.9 128.4 0.2 -1.1 22.8 29.7 44 46 A T - 0 0 58 -5,-0.4 2,-0.3 1,-0.1 25,-0.0 0.467 63.3-113.6 -81.9-138.0 2.0 23.6 31.8 45 47 A A - 0 0 17 -7,-0.2 2,-0.3 2,-0.0 -7,-0.3 -0.882 6.1-131.4-153.9 179.7 5.7 23.5 30.9 46 48 A I E -D 37 0A 71 -9,-2.1 -9,-2.9 -2,-0.3 2,-0.6 -0.876 14.1-156.4-146.5 105.6 8.9 21.6 31.7 47 49 A F E -D 36 0A 65 -2,-0.3 -11,-0.2 -11,-0.2 -12,-0.0 -0.775 5.7-169.6 -86.2 121.9 12.0 23.6 32.6 48 50 A L + 0 0 75 -13,-2.0 -1,-0.1 -2,-0.6 -12,-0.1 0.299 67.9 36.6 -96.3 10.8 15.0 21.4 31.8 49 51 A K S > S- 0 0 43 -14,-0.3 3,-2.4 1,-0.2 4,-0.4 -0.986 79.9-119.2-155.6 149.0 17.6 23.6 33.5 50 52 A P G > S+ 0 0 124 0, 0.0 3,-0.8 0, 0.0 2,-0.5 0.993 122.3 48.7 -54.5 -53.1 17.7 25.8 36.5 51 53 A W G 3 S+ 0 0 22 1,-0.2 124,-0.1 -3,-0.1 -3,-0.0 0.134 79.8 108.5 -70.9 24.5 18.4 28.7 34.1 52 54 A S G < S+ 0 0 0 -3,-2.4 -1,-0.2 -2,-0.5 -17,-0.1 0.981 74.3 55.1 -64.6 -54.9 15.5 27.6 31.9 53 55 A K S < S- 0 0 70 -3,-0.8 2,-0.3 -4,-0.4 4,-0.0 -0.314 96.5-136.9 -62.9 166.1 13.4 30.6 32.9 54 56 A G - 0 0 0 3,-0.1 117,-0.2 121,-0.0 3,-0.1 -0.695 54.6 -54.5-141.2 93.4 15.7 33.5 32.1 55 57 A N S S+ 0 0 114 -2,-0.3 2,-0.3 1,-0.2 116,-0.1 0.699 109.3 124.8 51.7 15.4 16.1 36.4 34.5 56 58 A F - 0 0 20 111,-0.1 2,-0.3 1,-0.0 -1,-0.2 -0.693 64.1-109.0-100.1 157.0 12.3 36.3 34.1 57 59 A S >> - 0 0 64 -2,-0.3 4,-3.5 -3,-0.1 3,-0.9 -0.645 16.0-119.4 -96.6 147.8 10.0 36.1 37.1 58 60 A D H 3> S+ 0 0 132 1,-0.3 4,-0.5 -2,-0.3 -1,-0.1 0.667 122.2 55.8 -51.3 -11.4 7.9 33.2 38.4 59 61 A K H 34 S+ 0 0 169 2,-0.1 -1,-0.3 3,-0.1 4,-0.1 0.852 113.0 33.4 -90.6 -41.5 5.3 36.0 37.7 60 62 A E H <> S+ 0 0 70 -3,-0.9 4,-2.5 2,-0.2 3,-0.3 0.874 118.1 54.7 -81.1 -40.8 6.1 36.7 34.0 61 63 A V H >X S+ 0 0 14 -4,-3.5 4,-1.9 1,-0.3 3,-1.0 0.989 108.9 45.4 -51.4 -70.9 7.0 33.1 33.3 62 64 A A H 3X S+ 0 0 44 -4,-0.5 4,-1.0 -5,-0.3 -1,-0.3 0.700 111.5 60.9 -46.8 -18.1 3.7 31.7 34.5 63 65 A E H 3> S+ 0 0 122 -3,-0.3 4,-1.2 2,-0.2 3,-0.3 0.932 100.4 47.6 -78.1 -49.6 2.4 34.6 32.5 64 66 A L H XX S+ 0 0 33 -4,-2.5 4,-1.6 -3,-1.0 3,-1.4 0.969 102.4 70.8 -54.2 -50.9 3.7 33.4 29.1 65 67 A E H 3X S+ 0 0 39 -4,-1.9 4,-4.3 1,-0.3 5,-0.2 0.791 96.3 46.0 -30.2 -62.4 2.3 30.0 30.0 66 68 A E H 3X S+ 0 0 83 -4,-1.0 4,-3.2 -3,-0.3 5,-0.4 0.877 110.1 56.2 -58.0 -35.8 -1.4 30.9 29.6 67 69 A I H X S+ 0 0 75 -4,-2.9 3,-3.1 2,-0.2 4,-1.4 0.987 105.6 56.1 -70.6 -64.7 -10.0 27.0 15.3 79 81 A V H 3< S+ 0 0 26 -4,-2.2 4,-0.4 1,-0.3 -2,-0.2 0.836 106.1 55.7 -38.1 -41.3 -8.3 25.0 12.6 80 82 A Q H 3< S+ 0 0 33 -4,-2.3 4,-0.3 2,-0.2 -1,-0.3 0.803 107.8 49.3 -66.9 -26.0 -11.1 22.4 13.1 81 83 A D H XX S+ 0 0 98 -3,-3.1 3,-0.9 -4,-0.5 4,-0.5 0.986 117.4 36.3 -73.2 -64.1 -13.7 25.0 12.4 82 84 A F H 3X S+ 0 0 61 -4,-1.4 4,-3.0 1,-0.2 6,-0.2 0.405 90.9 105.2 -70.3 4.9 -12.3 26.5 9.2 83 85 A A H 34>S+ 0 0 5 -4,-0.4 5,-3.1 -5,-0.4 -1,-0.2 0.905 88.8 32.8 -52.9 -46.6 -11.2 22.9 8.3 84 86 A G H X45S+ 0 0 59 -3,-0.9 3,-2.1 -4,-0.3 -1,-0.2 0.918 116.1 59.3 -75.7 -44.7 -14.0 22.6 5.7 85 87 A D H 3<5S+ 0 0 83 -4,-0.5 -2,-0.2 1,-0.3 -1,-0.1 0.937 111.1 38.1 -45.5 -64.0 -13.9 26.3 4.8 86 88 A F T 3<5S- 0 0 18 -4,-3.0 -1,-0.3 1,-0.1 -2,-0.2 0.287 116.3-120.7 -75.0 11.5 -10.2 26.2 3.7 87 89 A Q T < 5 - 0 0 141 -3,-2.1 2,-0.2 -5,-0.2 -3,-0.2 0.887 44.5-179.1 47.1 55.9 -11.0 22.8 2.2 88 90 A M < - 0 0 42 -5,-3.1 2,-0.5 -6,-0.2 -1,-0.2 -0.595 20.5-142.8 -83.6 144.1 -8.5 20.8 4.3 89 91 A K - 0 0 169 -2,-0.2 -71,-0.0 2,-0.1 -5,-0.0 -0.925 35.5 -97.5-108.4 127.0 -8.1 17.1 3.7 90 92 A Y S S+ 0 0 71 -2,-0.5 -73,-0.1 1,-0.1 -72,-0.1 -0.661 97.3 47.6 -85.2 145.6 -7.5 15.1 6.9 91 93 A P S S+ 0 0 86 0, 0.0 2,-0.3 0, 0.0 -74,-0.2 0.502 73.7 144.0 -94.8 141.3 -4.9 14.1 8.0 92 94 A F E -A 16 0A 21 -76,-1.3 -76,-3.0 -4,-0.0 2,-0.4 -0.832 32.7-145.3-129.0 169.0 -2.6 17.1 7.8 93 95 A E E -A 15 0A 15 -2,-0.3 24,-1.5 -78,-0.2 25,-0.7 -0.995 7.0-162.6-139.4 129.5 0.2 18.5 9.9 94 96 A I E -AE 14 116A 26 -80,-2.6 -80,-2.4 -2,-0.4 2,-0.2 -0.949 7.4-165.8-119.1 131.3 1.2 22.1 10.6 95 97 A Q E -AE 13 115A 0 20,-0.8 20,-2.5 -2,-0.5 2,-0.3 -0.681 3.4-171.6-107.9 164.3 4.5 23.2 12.0 96 98 A G E -AE 12 114A 16 -84,-1.1 -84,-2.3 18,-0.2 2,-0.4 -0.955 8.6-178.8-159.1 135.8 5.6 26.5 13.5 97 99 A I E +AE 11 113A 18 16,-1.6 16,-3.1 -2,-0.3 2,-0.3 -0.998 15.3 162.4-136.1 132.7 8.9 28.0 14.6 98 100 A A E +AE 10 112A 19 -88,-1.5 -88,-2.9 -2,-0.4 2,-0.3 -0.963 14.8 104.3-156.9 137.5 9.3 31.5 16.1 99 101 A G E -AE 9 111A 5 12,-2.5 12,-2.4 -2,-0.3 2,-0.2 -0.962 51.7 -95.5 174.6-175.1 11.8 33.3 18.1 100 102 A a E -AE 8 110A 0 -92,-1.1 -92,-1.3 10,-0.3 2,-0.3 -0.717 26.9-158.1-121.0 171.4 14.5 36.0 17.9 101 103 A E E -AE 7 109A 56 8,-2.1 8,-1.3 -2,-0.2 -94,-0.2 -0.996 17.2-118.2-153.9 149.8 18.3 36.0 17.4 102 104 A L - 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