==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 27-MAR-09 3GSN . COMPND 2 MOLECULE: HLA CLASS I HISTOCOMPATIBILITY ANTIGEN, A-2 ALPHA . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.GRAS,X.SAULQUIN,J.-B.REISER,E.DEBEAUPUIS,K.ECHASSERIEAU, . 825 5 7 7 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 38632.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 490 59.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 266 32.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 1.2 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 . 2 0.2 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 . 81 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 61 7.4 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 1 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 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 . 15 10 13 4 6 2 2 2 3 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 6 4 3 0 0 1 0 0 0 0 1 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 H G 0 0 56 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-165.1 34.1 -11.8 9.2 2 2 H S - 0 0 68 103,-0.0 2,-0.3 104,-0.0 102,-0.2 -0.182 360.0-145.2 -81.5 178.6 32.7 -11.3 12.7 3 3 H H E -A 103 0A 24 100,-2.0 100,-2.0 2,-0.0 2,-0.3 -0.986 9.9-155.3-149.8 159.4 30.8 -8.3 14.1 4 4 H S E -A 102 0A 12 -2,-0.3 25,-0.7 98,-0.2 2,-0.3 -0.938 20.4-174.4-141.0 149.7 30.5 -6.4 17.3 5 5 H M E +AB 101 28A 0 96,-1.3 96,-1.1 -2,-0.3 2,-0.3 -0.930 25.7 167.7-140.2 120.4 28.5 -4.2 19.6 6 6 H R E -AB 100 27A 92 21,-1.3 21,-3.0 -2,-0.3 2,-0.4 -0.964 21.8-152.9-131.8 149.6 30.2 -3.0 22.7 7 7 H Y E -AB 99 26A 3 92,-2.5 92,-1.4 -2,-0.3 2,-0.4 -0.985 11.6-155.3-123.6 136.3 29.3 -0.3 25.3 8 8 H F E -AB 98 25A 21 17,-2.5 17,-1.8 -2,-0.4 2,-0.4 -0.940 6.6-165.1-119.4 129.2 32.0 1.5 27.3 9 9 H F E +AB 97 24A 0 88,-3.3 88,-1.4 -2,-0.4 2,-0.4 -0.919 10.8 173.0-120.7 135.0 31.5 3.2 30.7 10 10 H T E +AB 96 23A 4 13,-1.8 13,-2.6 -2,-0.4 2,-0.4 -0.949 1.0 174.1-140.6 115.4 33.6 5.7 32.5 11 11 H S E -AB 95 22A 2 84,-1.7 84,-1.8 -2,-0.4 2,-0.4 -0.989 7.4-173.4-124.9 125.3 32.6 7.4 35.7 12 12 H V E -AB 94 21A 6 9,-2.2 9,-2.4 -2,-0.4 82,-0.2 -0.957 18.1-132.0-121.6 132.3 35.1 9.6 37.6 13 13 H S - 0 0 24 80,-1.8 6,-0.1 -2,-0.4 5,-0.1 -0.405 11.3-161.4 -80.1 158.2 34.5 11.1 41.0 14 14 H R - 0 0 58 4,-0.4 78,-0.1 1,-0.2 77,-0.1 -0.824 5.2-158.7-145.5 96.9 35.1 14.8 41.7 15 15 H P S S+ 0 0 79 0, 0.0 -1,-0.2 0, 0.0 75,-0.1 0.909 88.9 22.8 -41.1 -86.4 35.4 15.6 45.5 16 16 H G S S+ 0 0 78 74,-0.1 -2,-0.0 0, 0.0 74,-0.0 0.893 117.4 72.6 -51.6 -47.7 34.8 19.3 45.7 17 17 H R S S- 0 0 182 1,-0.1 -3,-0.1 -4,-0.0 -4,-0.0 0.016 92.5-103.2 -59.7 178.9 32.8 19.4 42.5 18 18 H G S S- 0 0 60 1,-0.2 -4,-0.4 -5,-0.1 3,-0.1 0.477 75.3 -0.7 -81.6-137.4 29.4 17.9 42.3 19 19 H E S S- 0 0 89 1,-0.1 -1,-0.2 -6,-0.1 3,-0.1 -0.126 87.2 -91.5 -49.1 145.0 28.2 14.5 40.9 20 20 H P - 0 0 16 0, 0.0 2,-0.3 0, 0.0 -7,-0.3 -0.262 44.2-100.0 -62.0 148.7 30.8 12.3 39.3 21 21 H R E -B 12 0A 89 -9,-2.4 -9,-2.2 -3,-0.1 2,-0.5 -0.531 39.0-166.0 -74.3 130.1 31.5 12.6 35.5 22 22 H F E +B 11 0A 4 -2,-0.3 16,-2.6 -11,-0.2 2,-0.5 -0.945 12.0 174.7-127.4 113.6 29.8 9.9 33.4 23 23 H I E +BC 10 37A 11 -13,-2.6 -13,-1.8 -2,-0.5 2,-0.4 -0.969 3.6 177.9-116.4 122.4 30.6 9.1 29.8 24 24 H A E -BC 9 36A 4 12,-3.0 12,-2.6 -2,-0.5 2,-0.3 -0.985 4.3-177.3-121.4 132.9 29.0 6.1 28.0 25 25 H V E -BC 8 35A 1 -17,-1.8 -17,-2.5 -2,-0.4 2,-0.4 -0.977 13.8-146.9-131.1 149.4 29.6 5.3 24.3 26 26 H G E -BC 7 34A 0 8,-2.1 7,-2.1 -2,-0.3 8,-1.1 -0.940 15.1-167.3-117.2 134.1 28.3 2.7 22.0 27 27 H Y E -BC 6 32A 37 -21,-3.0 -21,-1.3 -2,-0.4 2,-0.4 -0.887 18.5-169.0-121.8 149.2 30.1 1.0 19.2 28 28 H V E S-B 5 0A 0 3,-2.7 3,-0.4 -2,-0.3 -23,-0.2 -0.896 81.1 -39.3-131.1 100.4 29.3 -1.2 16.2 29 29 H D S S- 0 0 30 -25,-0.7 -1,-0.1 -2,-0.4 -24,-0.0 0.930 126.3 -31.6 42.4 83.1 32.6 -2.6 14.7 30 30 H D S S+ 0 0 68 1,-0.1 2,-0.5 180,-0.1 -1,-0.2 0.629 121.4 105.6 59.7 12.0 34.9 0.4 15.0 31 31 H T - 0 0 28 -3,-0.4 -3,-2.7 18,-0.0 2,-0.4 -0.940 63.2-145.9-128.4 110.7 31.9 2.7 14.5 32 32 H Q E +C 27 0A 30 -2,-0.5 -5,-0.3 -5,-0.3 3,-0.1 -0.614 20.7 174.5 -71.2 124.8 30.5 4.7 17.4 33 33 H F E + 0 0 0 -7,-2.1 15,-3.2 -2,-0.4 16,-1.1 0.622 60.3 15.5-107.7 -18.8 26.7 5.1 16.9 34 34 H V E -CD 26 47A 1 -8,-1.1 -8,-2.1 13,-0.3 2,-0.3 -0.961 56.7-172.8-146.1 170.6 25.7 6.7 20.2 35 35 H R E -CD 25 46A 39 11,-1.5 11,-2.5 -2,-0.3 2,-0.3 -0.990 8.7-164.6-156.5 154.4 27.0 8.6 23.3 36 36 H F E -C 24 0A 6 -12,-2.6 -12,-3.0 -2,-0.3 2,-0.4 -0.976 7.1-177.2-139.7 135.3 26.0 10.0 26.7 37 37 H D E > -C 23 0A 16 -2,-0.3 3,-1.8 7,-0.3 6,-0.3 -0.997 25.8-141.2-130.1 128.1 27.9 12.5 28.8 38 38 H S T 3 S+ 0 0 10 -16,-2.6 -15,-0.1 -2,-0.4 -1,-0.1 0.667 104.8 49.4 -60.9 -18.3 26.7 13.5 32.2 39 39 H D T 3 S+ 0 0 78 -17,-0.2 -1,-0.3 -3,-0.0 -16,-0.1 0.454 82.1 121.0-101.3 -3.0 27.8 17.1 31.5 40 40 H A < - 0 0 18 -3,-1.8 3,-0.2 1,-0.1 0, 0.0 -0.324 68.6-127.4 -61.9 143.6 26.2 17.4 28.0 41 41 H A S S+ 0 0 115 1,-0.2 -1,-0.1 2,-0.1 -3,-0.0 0.755 106.3 53.7 -64.7 -27.2 23.7 20.3 27.6 42 42 H S S S- 0 0 57 2,-0.1 -1,-0.2 1,-0.0 3,-0.1 0.889 84.7-153.0 -75.7 -43.0 21.0 17.9 26.3 43 43 H Q + 0 0 83 1,-0.3 2,-0.3 -6,-0.3 -2,-0.1 0.815 61.1 102.9 65.2 32.9 21.1 15.4 29.2 44 44 H R S S- 0 0 88 -7,-0.1 2,-0.4 -9,-0.1 -1,-0.3 -0.950 85.5 -91.0-137.2 157.8 19.8 12.7 26.7 45 45 H M - 0 0 9 15,-0.4 -9,-0.2 -2,-0.3 19,-0.1 -0.577 52.3-150.8 -69.0 127.4 21.4 9.8 24.8 46 46 H E E -D 35 0A 41 -11,-2.5 -11,-1.5 -2,-0.4 2,-0.3 -0.690 11.9-110.2-108.9 153.6 22.5 11.2 21.4 47 47 H P E +D 34 0A 46 0, 0.0 -13,-0.3 0, 0.0 -14,-0.1 -0.605 29.3 173.4 -76.9 138.3 22.9 9.8 17.9 48 48 H R + 0 0 97 -15,-3.2 -14,-0.2 -2,-0.3 -16,-0.1 0.456 65.9 51.0-121.5 -8.7 26.5 9.5 16.6 49 49 H A S >> S- 0 0 5 -16,-1.1 3,-3.0 -18,-0.1 4,-0.6 -0.973 81.0-125.6-138.0 123.3 25.9 7.7 13.3 50 50 H P T 34 S+ 0 0 104 0, 0.0 4,-0.5 0, 0.0 -17,-0.0 0.416 106.5 64.7 -41.9 -7.6 23.4 8.8 10.6 51 51 H W T 34 S+ 0 0 20 2,-0.2 -18,-0.0 1,-0.1 123,-0.0 0.388 99.2 49.8-102.4 0.8 21.8 5.3 10.6 52 52 H I T <4 S+ 0 0 0 -3,-3.0 3,-0.1 -19,-0.1 -1,-0.1 0.520 98.3 67.5-108.4 -15.0 20.5 5.6 14.2 53 53 H E S >< S+ 0 0 127 -4,-0.6 2,-3.2 1,-0.2 3,-0.5 0.893 85.8 72.3 -64.5 -41.7 19.0 9.0 13.5 54 54 H Q T 3 S+ 0 0 117 -4,-0.5 -1,-0.2 1,-0.3 -3,-0.0 -0.333 98.5 49.0 -71.6 61.0 16.5 7.2 11.3 55 55 H E T 3 S+ 0 0 30 -2,-3.2 -1,-0.3 -3,-0.1 4,-0.2 0.054 72.5 143.9 168.1 49.8 14.9 5.8 14.4 56 56 H G < + 0 0 54 -3,-0.5 -3,-0.1 3,-0.1 -2,-0.1 -0.208 42.1 74.0-109.5 43.4 14.4 8.9 16.6 57 57 H P S S- 0 0 87 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.728 110.1 -9.9-115.0 -82.5 11.2 8.7 18.6 58 58 H E S >> S+ 0 0 137 1,-0.1 4,-1.0 2,-0.1 3,-0.6 0.378 114.8 82.7-106.6 -0.2 10.8 6.4 21.6 59 59 H Y H 3> S+ 0 0 15 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.813 92.1 51.0 -66.5 -31.4 14.1 4.6 21.1 60 60 H W H 3> S+ 0 0 16 1,-0.2 4,-0.6 2,-0.2 -15,-0.4 0.433 99.1 65.5 -91.3 -0.6 15.8 7.4 22.8 61 61 H D H <> S+ 0 0 70 -3,-0.6 4,-1.8 3,-0.2 -1,-0.2 0.878 109.0 35.6 -84.1 -45.7 13.5 7.3 25.8 62 62 H G H X S+ 0 0 8 -4,-1.0 4,-4.5 2,-0.2 5,-0.4 0.948 118.5 50.1 -74.0 -51.5 14.6 3.9 27.0 63 63 H E H X S+ 0 0 2 -4,-1.5 4,-1.9 1,-0.2 5,-0.2 0.894 115.1 44.9 -51.2 -45.1 18.2 4.3 26.0 64 64 H T H X S+ 0 0 11 -4,-0.6 4,-1.9 2,-0.2 -1,-0.2 0.899 116.5 47.4 -67.2 -39.0 18.3 7.6 27.9 65 65 H R H X S+ 0 0 97 -4,-1.8 4,-1.2 2,-0.2 -2,-0.2 0.923 115.2 42.7 -71.2 -44.9 16.4 6.0 30.8 66 66 H K H X S+ 0 0 6 -4,-4.5 4,-1.8 2,-0.2 -1,-0.2 0.796 113.5 52.4 -74.0 -24.7 18.6 3.0 31.1 67 67 H V H X S+ 0 0 0 -4,-1.9 4,-2.1 -5,-0.4 -2,-0.2 0.879 109.2 49.3 -75.6 -37.4 21.8 5.0 30.6 68 68 H K H X S+ 0 0 82 -4,-1.9 4,-1.4 1,-0.2 -2,-0.2 0.785 110.7 52.8 -65.9 -28.6 20.8 7.3 33.4 69 69 H A H X S+ 0 0 3 -4,-1.2 4,-1.8 2,-0.2 -2,-0.2 0.879 107.1 49.9 -73.2 -40.0 20.1 4.2 35.4 70 70 H H H X S+ 0 0 0 -4,-1.8 4,-1.9 1,-0.2 -2,-0.2 0.915 108.3 53.4 -62.6 -44.6 23.6 2.8 34.7 71 71 H S H X S+ 0 0 18 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.890 105.4 55.2 -56.9 -42.6 25.1 6.2 35.8 72 72 H Q H X S+ 0 0 19 -4,-1.4 4,-1.5 1,-0.2 -1,-0.2 0.898 106.4 50.2 -56.5 -46.8 23.1 5.8 39.0 73 73 H T H X S+ 0 0 0 -4,-1.8 4,-2.9 1,-0.2 211,-0.3 0.871 109.6 51.3 -57.2 -41.8 24.7 2.4 39.7 74 74 H H H X S+ 0 0 0 -4,-1.9 4,-1.1 2,-0.2 -1,-0.2 0.811 102.0 60.5 -70.2 -30.2 28.2 3.8 39.1 75 75 H R H X S+ 0 0 79 -4,-1.6 4,-0.6 2,-0.2 3,-0.5 0.944 113.2 37.0 -62.9 -48.3 27.6 6.7 41.5 76 76 H V H >X S+ 0 0 18 -4,-1.5 3,-2.8 1,-0.2 4,-1.9 0.968 106.1 67.7 -66.2 -52.9 27.1 4.2 44.3 77 77 H D H 3X S+ 0 0 0 -4,-2.9 4,-2.0 1,-0.3 -1,-0.2 0.751 96.9 57.6 -37.1 -31.3 29.7 1.9 43.0 78 78 H L H 3X S+ 0 0 16 -4,-1.1 4,-1.2 -3,-0.5 -1,-0.3 0.825 107.7 44.2 -76.3 -31.4 32.2 4.6 43.9 79 79 H G H S+ 0 0 79 -4,-1.2 5,-2.6 2,-0.2 4,-0.4 0.924 111.0 45.5 -65.1 -43.1 35.9 3.4 48.5 83 83 H G H ><5S+ 0 0 56 -4,-2.8 3,-0.9 3,-0.2 -2,-0.2 0.937 112.0 52.5 -63.2 -48.1 34.6 1.6 51.6 84 84 H Y H 3<5S+ 0 0 76 -4,-3.0 -2,-0.2 1,-0.2 -3,-0.2 0.977 117.0 36.1 -50.7 -61.6 36.1 -1.7 50.4 85 85 H Y T 3<5S- 0 0 80 -4,-2.8 -1,-0.2 -5,-0.1 -2,-0.2 0.359 109.3-121.4 -84.8 10.3 39.6 -0.3 49.8 86 86 H N T < 5 + 0 0 146 -3,-0.9 -3,-0.2 -4,-0.4 -4,-0.1 0.878 58.8 153.2 60.8 39.8 39.3 2.0 52.9 87 87 H Q < - 0 0 60 -5,-2.6 2,-0.2 -6,-0.2 -1,-0.1 -0.304 34.4-118.0 -93.6-177.9 39.9 5.1 50.8 88 88 H S - 0 0 65 -2,-0.1 -1,-0.1 1,-0.0 -5,-0.0 -0.673 23.3-106.6-122.2 172.4 38.8 8.7 51.5 89 89 H E S S+ 0 0 153 -2,-0.2 -1,-0.0 1,-0.1 -2,-0.0 0.404 98.0 89.3 -78.1 1.1 36.6 11.5 50.0 90 90 H A S S+ 0 0 62 -75,-0.1 -74,-0.1 2,-0.0 -1,-0.1 0.900 81.1 31.8 -57.9-100.8 39.9 13.3 49.1 91 91 H G S S- 0 0 42 1,-0.1 2,-0.3 -77,-0.1 -77,-0.0 0.302 83.1 -96.9 -60.8 179.9 41.0 12.2 45.6 92 92 H S - 0 0 50 -78,-0.1 2,-0.3 -80,-0.0 -1,-0.1 -0.749 36.2-166.4 -98.1 145.4 39.3 11.2 42.4 93 93 H H - 0 0 17 -2,-0.3 -80,-1.8 193,-0.0 2,-0.4 -0.931 8.8-137.7-135.0 163.2 38.7 7.5 41.4 94 94 H T E -A 12 0A 5 -2,-0.3 25,-4.3 -82,-0.2 2,-0.4 -0.962 12.3-175.8-130.6 123.5 37.7 5.7 38.3 95 95 H V E -AE 11 118A 0 -84,-1.8 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