==== 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 16-MAR-07 2P5W . COMPND 2 MOLECULE: HLA CLASS I HISTOCOMPATIBILITY ANTIGEN, A-2 ALPHA . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.SAMI,P.J.RIZKALLAH,S.DUNN,Y.LI,R.MOYSEY,A.VUIDEPOT,E.BASTO . 819 5 8 7 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 38440.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 519 63.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 1.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 303 37.0 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 . 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 . 62 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 60 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 64 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 0.7 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 1 0 0 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 RESIDUES PER ALPHA HELIX . 1 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 . 5 9 11 7 4 7 2 4 3 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 2 3 3 1 1 1 0 1 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 1 A G 0 0 41 0, 0.0 106,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-166.0 15.1 9.0 61.6 2 2 A S - 0 0 77 104,-0.1 2,-0.3 1,-0.0 102,-0.2 -0.143 360.0-164.2 -63.9 162.0 16.9 7.7 58.5 3 3 A H E -A 103 0A 21 100,-2.3 100,-2.8 26,-0.1 2,-0.3 -0.937 7.1-171.5-144.1 163.9 14.9 6.6 55.4 4 4 A S E -A 102 0A 22 -2,-0.3 25,-2.7 98,-0.2 2,-0.4 -0.989 15.3-150.9-156.3 155.3 15.5 4.6 52.2 5 5 A M E +AB 101 28A 1 96,-2.0 96,-1.6 -2,-0.3 2,-0.3 -0.992 26.9 175.1-126.6 136.0 13.9 3.7 48.9 6 6 A R E -AB 100 27A 42 21,-2.9 21,-2.8 -2,-0.4 2,-0.4 -0.998 22.7-156.4-149.6 141.1 14.8 0.4 47.4 7 7 A Y E -AB 99 26A 2 92,-2.5 92,-1.7 -2,-0.3 2,-0.5 -0.960 11.0-163.4-114.6 134.7 13.9 -1.8 44.4 8 8 A F E -AB 98 25A 24 17,-2.6 17,-2.5 -2,-0.4 2,-0.4 -0.983 6.2-170.3-119.4 128.1 14.4 -5.6 44.4 9 9 A F E -AB 97 24A 0 88,-3.0 88,-2.2 -2,-0.5 2,-0.4 -0.981 4.2-176.2-122.8 130.7 14.4 -7.5 41.1 10 10 A T E -AB 96 23A 4 13,-2.7 13,-2.7 -2,-0.4 2,-0.4 -0.995 1.0-178.0-127.9 127.3 14.4 -11.3 40.8 11 11 A S E -AB 95 22A 2 84,-2.9 84,-2.6 -2,-0.4 2,-0.4 -0.996 4.9-172.8-126.7 127.5 14.5 -13.3 37.4 12 12 A V E -AB 94 21A 21 9,-2.3 9,-2.6 -2,-0.4 82,-0.2 -0.981 19.0-134.6-127.0 123.9 14.4 -17.1 37.3 13 13 A S - 0 0 21 80,-2.4 6,-0.1 -2,-0.4 5,-0.0 -0.503 14.1-163.6 -73.4 141.9 15.0 -19.3 34.1 14 14 A R > - 0 0 72 4,-0.4 3,-1.6 -2,-0.2 78,-0.1 -0.658 17.0-139.4-130.5 74.5 12.4 -22.1 33.7 15 15 A P T 3 S- 0 0 48 0, 0.0 75,-0.1 0, 0.0 77,-0.1 -0.041 86.8 -2.0 -34.9 118.1 13.8 -24.6 31.2 16 16 A G T 3 S+ 0 0 87 2,-0.1 3,-0.1 1,-0.1 74,-0.0 0.828 113.6 95.9 61.8 35.9 10.9 -25.8 28.9 17 17 A R S < S- 0 0 190 -3,-1.6 -1,-0.1 1,-0.5 2,-0.0 -0.178 90.7 -99.4-146.9 42.8 8.4 -23.6 30.9 18 18 A G S S- 0 0 68 -5,-0.0 -1,-0.5 3,-0.0 -4,-0.4 -0.260 77.5 -4.6 74.3-159.9 8.1 -20.3 28.8 19 19 A E S S- 0 0 44 1,-0.1 3,-0.0 -6,-0.1 2,-0.0 -0.145 87.2 -92.5 -59.5 157.1 9.8 -17.0 29.5 20 20 A P - 0 0 16 0, 0.0 2,-0.4 0, 0.0 -7,-0.2 -0.352 48.5-100.9 -64.5 166.6 11.8 -16.8 32.7 21 21 A R E -B 12 0A 73 -9,-2.6 -9,-2.3 -3,-0.1 2,-0.4 -0.736 37.8-166.2 -88.9 139.0 9.8 -15.4 35.7 22 22 A F E +B 11 0A 1 -2,-0.4 16,-3.0 -11,-0.2 2,-0.4 -0.988 8.5 178.3-132.0 124.6 10.4 -11.8 36.6 23 23 A I E -BC 10 37A 19 -13,-2.7 -13,-2.7 -2,-0.4 2,-0.4 -0.990 3.6-174.2-129.1 128.5 9.3 -10.2 39.9 24 24 A A E +BC 9 36A 2 12,-2.8 12,-2.0 -2,-0.4 2,-0.4 -0.979 3.5 179.4-122.3 130.9 9.9 -6.6 40.9 25 25 A V E -BC 8 35A 0 -17,-2.5 -17,-2.6 -2,-0.4 2,-0.4 -0.973 10.9-155.8-128.5 147.1 9.1 -5.1 44.3 26 26 A G E -BC 7 34A 0 8,-1.8 7,-2.8 -2,-0.4 8,-1.2 -0.977 11.7-173.3-123.9 139.2 9.6 -1.5 45.6 27 27 A Y E -BC 6 32A 30 -21,-2.8 -21,-2.9 -2,-0.4 2,-0.5 -0.947 20.9-161.0-131.2 148.1 10.0 -0.4 49.2 28 28 A V E > S-BC 5 31A 0 3,-2.2 3,-2.2 -2,-0.3 -23,-0.2 -0.995 80.5 -42.9-122.4 116.9 10.2 2.9 51.2 29 29 A D T 3 S- 0 0 28 -25,-2.7 -23,-0.1 -2,-0.5 -26,-0.1 -0.397 126.0 -24.1 58.6-128.4 11.8 2.0 54.5 30 30 A D T 3 S+ 0 0 66 149,-0.1 2,-0.5 -3,-0.1 -1,-0.3 0.124 119.7 96.8-100.3 20.5 10.0 -1.2 55.7 31 31 A T E < -C 28 0A 27 -3,-2.2 -3,-2.2 148,-0.0 2,-0.3 -0.946 65.9-141.8-117.6 117.7 6.9 -0.6 53.6 32 32 A Q E +C 27 0A 28 -2,-0.5 -5,-0.3 -5,-0.2 3,-0.1 -0.583 24.7 170.1 -74.7 135.4 6.3 -2.2 50.1 33 33 A F E + 0 0 0 -7,-2.8 15,-2.7 -2,-0.3 16,-0.9 0.616 55.1 32.9-120.9 -20.3 4.6 0.2 47.7 34 34 A V E -CD 26 47A 3 -8,-1.2 -8,-1.8 13,-0.3 2,-0.3 -0.947 54.2-172.9-140.4 162.0 4.8 -1.4 44.2 35 35 A R E +CD 25 46A 60 11,-1.6 11,-3.6 -2,-0.3 2,-0.3 -0.995 8.4 179.6-152.7 146.0 4.8 -4.7 42.5 36 36 A F E +C 24 0A 4 -12,-2.0 -12,-2.8 -2,-0.3 2,-0.4 -0.965 5.1 178.9-148.3 131.2 5.3 -6.3 39.1 37 37 A D E > -C 23 0A 35 -2,-0.3 3,-1.4 7,-0.3 6,-0.3 -0.962 24.6-145.8-136.4 115.9 5.0 -10.1 38.4 38 38 A S T 3 S+ 0 0 12 -16,-3.0 -15,-0.1 -2,-0.4 -1,-0.1 0.718 99.5 51.3 -53.6 -26.4 5.5 -11.3 34.8 39 39 A D T 3 S+ 0 0 78 -17,-0.2 -1,-0.2 -3,-0.0 -16,-0.1 0.622 85.3 101.4 -87.3 -17.1 2.9 -14.2 35.4 40 40 A A S < S- 0 0 33 -3,-1.4 3,-0.2 1,-0.1 -3,-0.0 -0.340 77.6-124.5 -67.1 154.6 0.1 -12.0 36.8 41 41 A A S S+ 0 0 103 1,-0.2 -1,-0.1 2,-0.1 -3,-0.0 0.825 98.9 66.4 -70.4 -33.3 -2.7 -11.2 34.3 42 42 A S S S- 0 0 52 1,-0.1 -1,-0.2 2,-0.1 3,-0.1 0.865 75.8-156.7 -59.6 -43.2 -2.6 -7.3 34.7 43 43 A Q + 0 0 71 -6,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.821 55.3 118.1 64.0 32.6 0.8 -6.8 33.1 44 44 A R S S- 0 0 93 -7,-0.1 2,-0.4 23,-0.0 -7,-0.3 -0.905 78.6-109.7-127.4 151.3 0.9 -3.5 35.0 45 45 A M - 0 0 6 15,-0.4 -9,-0.2 -2,-0.3 19,-0.1 -0.714 52.3-151.1 -73.0 132.1 3.2 -2.2 37.7 46 46 A E E -D 35 0A 45 -11,-3.6 -11,-1.6 -2,-0.4 2,-0.2 -0.881 10.7-112.5-119.5 148.9 0.7 -2.3 40.7 47 47 A P E +D 34 0A 45 0, 0.0 -13,-0.3 0, 0.0 -14,-0.1 -0.490 29.4 170.2 -74.0 136.9 0.2 -0.4 43.9 48 48 A R + 0 0 95 -15,-2.7 -14,-0.2 -2,-0.2 -16,-0.1 0.324 66.3 52.1-126.8 1.6 0.8 -2.1 47.2 49 49 A A S > S- 0 0 5 -16,-0.9 3,-0.8 1,-0.1 4,-0.4 -0.983 82.6-122.0-137.4 146.7 0.7 0.9 49.7 50 50 A P G > S+ 0 0 101 0, 0.0 3,-1.6 0, 0.0 4,-0.2 0.904 101.7 57.3 -58.6 -47.0 -2.2 3.5 49.9 51 51 A W G > S+ 0 0 13 1,-0.3 3,-1.0 2,-0.2 4,-0.1 0.630 96.5 63.3 -61.1 -23.7 -0.2 6.8 49.2 52 52 A I G X S+ 0 0 0 -3,-0.8 3,-1.9 1,-0.2 -1,-0.3 0.700 84.5 74.8 -76.6 -19.5 1.2 5.7 45.8 53 53 A E G < S+ 0 0 129 -3,-1.6 -1,-0.2 -4,-0.4 -2,-0.2 0.627 80.1 74.0 -69.6 -8.4 -2.3 5.5 44.3 54 54 A Q G < S+ 0 0 119 -3,-1.0 -1,-0.3 -4,-0.2 -2,-0.1 0.649 75.6 99.3 -78.1 -11.2 -2.3 9.3 44.2 55 55 A E S < S- 0 0 12 -3,-1.9 -3,-0.0 1,-0.1 5,-0.0 -0.444 76.2-122.1 -71.9 147.5 0.1 9.1 41.3 56 56 A G > - 0 0 35 -2,-0.1 4,-1.8 1,-0.1 3,-0.3 -0.116 28.1 -86.2 -85.1-177.8 -1.6 9.6 37.9 57 57 A P H > S+ 0 0 98 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.784 123.2 59.6 -57.9 -37.8 -1.8 7.5 34.7 58 58 A E H > S+ 0 0 177 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.923 106.5 48.0 -59.9 -45.1 1.5 8.8 33.3 59 59 A Y H > S+ 0 0 21 -3,-0.3 4,-3.1 2,-0.2 5,-0.3 0.974 115.0 43.2 -59.1 -55.6 3.3 7.5 36.4 60 60 A W H X S+ 0 0 32 -4,-1.8 4,-1.7 1,-0.2 -15,-0.4 0.858 115.5 49.5 -60.9 -38.4 1.8 4.0 36.2 61 61 A D H X S+ 0 0 63 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.894 115.4 44.7 -64.5 -42.9 2.2 3.9 32.4 62 62 A G H X S+ 0 0 7 -4,-2.6 4,-2.4 -5,-0.2 -2,-0.2 0.906 113.8 46.8 -69.2 -45.9 5.9 5.0 32.7 63 63 A E H X S+ 0 0 8 -4,-3.1 4,-2.3 -5,-0.2 -1,-0.2 0.839 112.9 51.6 -66.7 -32.7 6.7 2.7 35.6 64 64 A T H X S+ 0 0 3 -4,-1.7 4,-2.0 -5,-0.3 -2,-0.2 0.956 111.5 46.0 -67.8 -46.5 5.0 -0.2 33.8 65 65 A R H X S+ 0 0 28 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.892 114.8 48.2 -64.4 -40.1 7.0 0.4 30.6 66 66 A K H X S+ 0 0 6 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.929 111.1 48.9 -67.0 -44.0 10.3 0.8 32.6 67 67 A V H X S+ 0 0 0 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.856 111.5 51.2 -66.9 -31.0 9.7 -2.4 34.6 68 68 A K H X S+ 0 0 30 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.911 109.0 49.1 -70.7 -40.8 9.0 -4.3 31.3 69 69 A A H X S+ 0 0 4 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.942 110.3 53.2 -60.1 -46.7 12.2 -3.1 29.7 70 70 A H H X S+ 0 0 1 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.863 107.5 50.8 -53.8 -42.1 13.9 -4.2 33.0 71 71 A S H X S+ 0 0 7 -4,-1.7 4,-1.8 1,-0.2 -1,-0.2 0.854 108.9 51.6 -67.0 -36.3 12.4 -7.7 32.5 72 72 A Q H X S+ 0 0 3 -4,-1.9 4,-1.4 2,-0.2 -2,-0.2 0.879 109.1 49.0 -67.7 -41.2 13.6 -7.9 28.9 73 73 A T H X S+ 0 0 2 -4,-2.2 4,-2.5 2,-0.2 314,-0.2 0.887 112.6 48.1 -64.5 -41.4 17.2 -7.0 29.9 74 74 A H H X S+ 0 0 0 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.841 106.7 56.7 -69.0 -34.6 17.3 -9.7 32.7 75 75 A R H X S+ 0 0 88 -4,-1.8 4,-0.7 2,-0.2 -1,-0.2 0.868 111.0 44.2 -62.5 -37.9 15.8 -12.3 30.3 76 76 A V H >X S+ 0 0 14 -4,-1.4 4,-2.3 1,-0.2 3,-1.0 0.939 109.4 56.2 -70.4 -48.2 18.8 -11.6 28.0 77 77 A D H 3X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.3 5,-0.3 0.809 99.3 61.1 -52.6 -37.5 21.3 -11.6 31.0 78 78 A L H 3X S+ 0 0 12 -4,-1.8 4,-1.3 2,-0.2 -1,-0.3 0.888 110.0 40.8 -57.8 -40.3 20.2 -15.1 32.0 79 79 A G H S+ 0 0 72 -4,-1.3 5,-2.8 -5,-0.3 4,-0.4 0.899 111.2 49.1 -58.1 -39.9 25.0 -19.2 31.1 83 83 A G H ><5S+ 0 0 51 -4,-1.6 3,-0.7 3,-0.2 -2,-0.2 0.913 108.9 49.9 -66.4 -44.9 27.3 -18.5 28.2 84 84 A Y H 3<5S+ 0 0 65 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.871 119.0 38.8 -61.9 -38.9 30.0 -16.9 30.3 85 85 A Y T 3<5S- 0 0 76 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.398 107.3-126.4 -90.7 0.2 29.9 -19.8 32.7 86 86 A N T < 5 + 0 0 154 -3,-0.7 -3,-0.2 -4,-0.4 2,-0.2 0.966 56.0 164.2 50.5 59.4 29.5 -22.4 29.9 87 87 A Q < - 0 0 66 -5,-2.8 -1,-0.1 1,-0.2 -5,-0.0 -0.556 38.0 -56.9-109.4 171.0 26.4 -23.8 31.7 88 88 A S - 0 0 54 -2,-0.2 3,-0.4 1,-0.1 -1,-0.2 -0.049 28.1-155.6 -42.5 130.0 23.3 -25.9 31.2 89 89 A E S S+ 0 0 140 1,-0.2 -1,-0.1 3,-0.0 -7,-0.0 0.807 99.9 37.1 -78.4 -32.1 20.8 -25.0 28.5 90 90 A A S S+ 0 0 82 -75,-0.1 2,-0.3 2,-0.1 -1,-0.2 0.061 95.6 103.7-109.6 23.9 18.1 -26.8 30.4 91 91 A G S S- 0 0 23 -3,-0.4 2,-0.4 -77,-0.0 -78,-0.0 -0.826 72.4-115.2-106.6 146.6 19.1 -25.9 34.0 92 92 A S + 0 0 70 -2,-0.3 2,-0.3 -78,-0.1 -78,-0.1 -0.678 38.1 176.9 -84.4 126.3 17.3 -23.3 36.2 93 93 A H - 0 0 15 -2,-0.4 -80,-2.4 2,-0.0 2,-0.4 -0.878 17.5-136.9-128.8 160.4 19.3 -20.2 37.2 94 94 A T E -A 12 0A 3 -2,-0.3 25,-3.3 -82,-0.2 2,-0.4 -0.956 10.6-171.6-125.9 137.9 18.6 -17.0 39.1 95 95 A V E -AE 11 118A 0 -84,-2.6 -84,-2.9 -2,-0.4 2,-0.3 -0.990 11.8-176.2-123.7 128.6 19.6 -13.3 38.6 96 96 A Q E -AE 10 117A 0 21,-2.0 21,-2.7 -2,-0.4 2,-0.3 -0.950 3.9-176.6-125.6 146.4 18.9 -10.7 41.3 97 97 A R E -AE 9 116A 3 -88,-2.2 -88,-3.0 -2,-0.3 2,-0.4 -0.996 0.8-176.8-142.6 140.8 19.4 -7.0 41.3 98 98 A M E +AE 8 115A 14 17,-2.1 17,-2.5 -2,-0.3 2,-0.3 -0.999 9.4 161.9-138.7 138.8 18.9 -4.4 44.0 99 99 A Y E +AE 7 114A 0 -92,-1.7 -92,-2.5 -2,-0.4 2,-0.3 -0.975 15.4 103.0-150.8 161.4 19.3 -0.6 43.9 100 100 A G E -AE 6 113A 0 13,-1.6 13,-2.1 -2,-0.3 2,-0.3 -0.946 46.7 -87.9 155.0-170.9 18.3 2.4 45.8 101 101 A a E -AE 5 112A 0 -96,-1.6 -96,-2.0 -2,-0.3 2,-0.4 -0.926 12.2-144.2-140.5 156.9 19.2 5.2 48.3 102 102 A D E -AE 4 111A 19 9,-2.7 8,-3.0 -2,-0.3 9,-1.2 -0.946 16.1-172.5-118.7 140.5 19.5 6.1 52.0 103 103 A V E -AE 3 109A 0 -100,-2.8 -100,-2.3 -2,-0.4 6,-0.2 -0.910 20.1-123.6-129.5 153.8 18.9 9.6 53.4 104 104 A G > - 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