==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 26-NOV-11 3UTT . COMPND 2 MOLECULE: HLA CLASS I HISTOCOMPATIBILITY ANTIGEN, A-2 ALPHA . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.J.RIZKALLAH,D.K.COLE,A.K.SEWELL,A.M.BULEK,J.ROSSJOHN,S.GRA . 1657 10 16 14 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 71593.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1098 66.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 1.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 574 34.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 7 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 23 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 . 4 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 . 198 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 110 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 134 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 0.9 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 5 1 2 0 0 0 2 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 RESIDUES PER ALPHA HELIX . 4 0 2 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 . 18 19 21 8 9 11 10 8 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 . 2 2 9 7 2 1 1 0 0 0 2 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 55 0, 0.0 2,-0.3 0, 0.0 106,-0.3 0.000 360.0 360.0 360.0 -70.1 8.4 19.9 11.5 2 2 A S - 0 0 75 104,-0.1 2,-0.3 105,-0.0 102,-0.2 -0.693 360.0-179.8 -96.3 148.6 10.6 18.4 8.9 3 3 A H E -A 103 0A 21 100,-1.5 100,-2.4 -2,-0.3 2,-0.3 -0.880 8.3-172.7-141.9 170.4 9.3 16.6 5.8 4 4 A S E -A 102 0A 12 -2,-0.3 25,-2.0 98,-0.2 2,-0.4 -0.993 19.2-141.1-158.6 161.2 10.4 14.7 2.7 5 5 A M E +AB 101 28A 0 96,-1.5 96,-1.3 -2,-0.3 2,-0.4 -0.999 27.2 178.8-125.8 131.2 9.3 13.1 -0.6 6 6 A R E -AB 100 27A 84 21,-3.4 21,-3.6 -2,-0.4 2,-0.5 -0.997 17.3-154.6-137.1 136.7 11.0 9.9 -1.6 7 7 A Y E -AB 99 26A 0 92,-2.3 92,-1.1 -2,-0.4 2,-0.6 -0.937 9.1-161.7-109.6 128.9 10.6 7.6 -4.6 8 8 A F E -AB 98 25A 17 17,-3.6 17,-3.4 -2,-0.5 2,-0.5 -0.942 7.2-172.8-113.4 119.6 11.6 3.9 -4.4 9 9 A F E -AB 97 24A 0 88,-2.9 88,-2.1 -2,-0.6 2,-0.4 -0.940 2.8-176.4-113.4 131.6 12.1 2.0 -7.6 10 10 A T E +AB 96 23A 2 13,-3.1 13,-3.8 -2,-0.5 2,-0.4 -0.983 2.7 177.9-129.4 122.1 12.7 -1.8 -7.6 11 11 A S E -AB 95 22A 1 84,-2.9 84,-2.9 -2,-0.4 2,-0.4 -0.985 2.9-176.3-127.0 125.4 13.5 -3.7 -10.8 12 12 A V E -AB 94 21A 13 9,-3.2 9,-3.5 -2,-0.4 82,-0.2 -0.979 21.8-129.3-125.7 128.6 14.2 -7.4 -10.8 13 13 A S - 0 0 18 80,-1.9 6,-0.1 -2,-0.4 62,-0.0 -0.394 13.9-159.6 -73.2 149.3 15.1 -9.5 -13.9 14 14 A R > - 0 0 46 3,-0.2 3,-2.1 4,-0.1 2,-0.1 -0.698 9.1-150.1-134.9 81.7 13.2 -12.6 -14.7 15 15 A P T 3 S+ 0 0 31 0, 0.0 3,-0.1 0, 0.0 75,-0.1 -0.318 86.5 20.2 -52.7 115.9 15.2 -15.0 -16.9 16 16 A G T 3 S+ 0 0 1 1,-0.5 1411,-0.2 2,-0.2 2,-0.2 -0.062 108.0 87.9 113.8 -31.1 12.6 -16.9 -18.9 17 17 A R S < S- 0 0 124 -3,-2.1 -1,-0.5 1,-0.1 -3,-0.2 -0.479 88.3 -99.7 -92.8 170.4 9.7 -14.6 -18.5 18 18 A G S S- 0 0 33 -2,-0.2 -2,-0.2 -3,-0.1 -4,-0.1 0.951 88.9 -5.1 -52.8 -92.5 8.9 -11.6 -20.7 19 19 A E S S- 0 0 77 1,-0.2 -2,-0.1 19,-0.1 2,-0.1 -0.381 85.5 -85.3 -98.7 176.0 10.1 -8.4 -19.1 20 20 A P - 0 0 17 0, 0.0 2,-0.6 0, 0.0 -7,-0.3 -0.361 47.9 -99.7 -72.8 164.9 11.7 -7.8 -15.7 21 21 A R E -B 12 0A 61 -9,-3.5 -9,-3.2 -2,-0.1 2,-0.5 -0.800 43.6-168.2 -85.4 119.9 9.5 -7.2 -12.6 22 22 A F E +B 11 0A 0 -2,-0.6 16,-2.6 -11,-0.2 2,-0.4 -0.949 12.1 174.6-116.6 126.6 9.3 -3.5 -12.0 23 23 A I E +BC 10 37A 9 -13,-3.8 -13,-3.1 -2,-0.5 2,-0.4 -0.954 1.9 178.2-132.7 114.2 7.9 -2.0 -8.8 24 24 A A E -BC 9 36A 1 12,-2.0 12,-2.1 -2,-0.4 2,-0.4 -0.936 4.0-175.6-114.2 137.5 8.0 1.8 -8.1 25 25 A V E -BC 8 35A 1 -17,-3.4 -17,-3.6 -2,-0.4 2,-0.4 -0.997 14.1-145.6-135.2 133.2 6.5 3.4 -5.0 26 26 A G E -BC 7 34A 0 8,-3.2 7,-3.0 -2,-0.4 8,-1.0 -0.794 17.7-170.8 -96.4 136.9 6.2 7.0 -4.1 27 27 A Y E -BC 6 32A 31 -21,-3.6 -21,-3.4 -2,-0.4 2,-0.4 -0.974 18.0-169.4-126.7 140.0 6.5 8.2 -0.5 28 28 A V E > S-BC 5 31A 0 3,-1.4 3,-2.1 -2,-0.4 2,-0.4 -0.997 77.5 -44.2-119.3 124.0 5.9 11.4 1.3 29 29 A D T 3 S- 0 0 30 -25,-2.0 150,-0.1 -2,-0.4 -26,-0.0 -0.418 125.2 -25.5 53.9-109.5 7.3 11.2 4.9 30 30 A D T 3 S+ 0 0 67 -2,-0.4 2,-0.4 149,-0.1 -1,-0.2 -0.018 118.6 88.9-124.5 29.1 6.0 7.8 6.0 31 31 A T E < -C 28 0A 26 -3,-2.1 -3,-1.4 179,-0.0 17,-0.1 -0.925 69.3-133.3-135.2 112.7 3.0 7.3 3.7 32 32 A Q E +C 27 0A 29 -2,-0.4 -5,-0.3 -5,-0.2 3,-0.1 -0.315 26.8 171.5 -58.4 134.4 3.1 5.7 0.3 33 33 A F E + 0 0 0 -7,-3.0 15,-3.4 1,-0.3 16,-1.3 0.622 59.7 30.8-121.9 -22.6 1.1 7.7 -2.3 34 34 A V E +CD 26 47A 0 -8,-1.0 -8,-3.2 13,-0.3 -1,-0.3 -0.996 56.8 177.8-138.4 147.8 2.0 6.0 -5.7 35 35 A R E -CD 25 46A 26 11,-2.9 11,-3.8 -2,-0.3 2,-0.3 -0.976 8.9-168.5-139.8 156.3 2.9 2.5 -6.9 36 36 A F E -C 24 0A 2 -12,-2.1 -12,-2.0 -2,-0.3 2,-0.5 -0.937 4.4-178.5-144.6 123.5 3.6 0.8 -10.2 37 37 A D E > -C 23 0A 16 7,-0.4 3,-2.5 -2,-0.3 6,-0.5 -0.953 19.0-154.9-124.8 113.0 3.9 -2.9 -10.7 38 38 A S T 3 S+ 0 0 11 -16,-2.6 -1,-0.1 -2,-0.5 -15,-0.1 0.731 97.6 58.7 -56.1 -22.8 4.7 -4.2 -14.2 39 39 A D T 3 S+ 0 0 81 -17,-0.3 -1,-0.3 -3,-0.1 2,-0.1 0.600 85.8 97.8 -84.7 -12.4 2.9 -7.4 -13.3 40 40 A A S < S- 0 0 21 -3,-2.5 3,-0.2 1,-0.1 0, 0.0 -0.398 84.2-122.9 -70.2 154.5 -0.3 -5.6 -12.6 41 41 A A S S+ 0 0 110 1,-0.2 -1,-0.1 -2,-0.1 -3,-0.1 0.652 103.1 70.6 -71.3 -14.2 -2.9 -5.6 -15.4 42 42 A S S S- 0 0 51 -5,-0.2 -1,-0.2 2,-0.1 3,-0.1 0.938 70.8-162.9 -71.1 -52.2 -2.8 -1.8 -15.2 43 43 A Q + 0 0 69 -6,-0.5 2,-0.3 1,-0.3 -5,-0.1 0.914 58.7 108.5 58.5 43.5 0.6 -0.8 -16.7 44 44 A R S S- 0 0 87 -7,-0.2 2,-0.5 -9,-0.1 -7,-0.4 -0.987 83.8 -96.8-146.0 151.6 -0.1 2.5 -15.0 45 45 A M - 0 0 6 15,-0.4 -9,-0.2 -2,-0.3 19,-0.2 -0.612 50.1-155.0 -65.7 121.3 1.2 4.6 -12.1 46 46 A E E -D 35 0A 39 -11,-3.8 -11,-2.9 -2,-0.5 2,-0.2 -0.786 9.7-120.4-107.3 148.1 -1.4 3.9 -9.4 47 47 A P E +D 34 0A 40 0, 0.0 -13,-0.3 0, 0.0 -14,-0.1 -0.582 27.4 172.1 -83.4 146.3 -2.4 6.0 -6.4 48 48 A R + 0 0 106 -15,-3.4 -14,-0.2 -2,-0.2 -15,-0.1 0.351 66.5 61.6-130.9 -4.9 -2.0 4.8 -2.9 49 49 A A S >> S- 0 0 1 -16,-1.3 3,-1.7 1,-0.1 4,-0.9 -0.982 77.3-134.0-123.3 139.7 -2.8 8.0 -1.0 50 50 A P T 34 S+ 0 0 95 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.684 104.3 61.2 -63.4 -17.4 -6.2 9.7 -1.2 51 51 A W T 34 S+ 0 0 11 1,-0.2 -18,-0.1 2,-0.2 4,-0.1 0.447 99.7 51.8 -94.1 -1.9 -4.4 13.0 -1.7 52 52 A I T X4 S+ 0 0 0 -3,-1.7 3,-1.9 2,-0.1 -1,-0.2 0.629 91.9 74.4 -99.7 -22.1 -2.6 12.1 -4.9 53 53 A E T 3< S+ 0 0 118 -4,-0.9 -2,-0.2 1,-0.3 -1,-0.1 0.590 82.9 73.3 -64.8 -8.9 -5.9 11.0 -6.5 54 54 A Q T 3 S+ 0 0 117 -4,-0.1 -1,-0.3 2,-0.1 -2,-0.1 0.791 76.8 94.9 -73.3 -29.4 -6.5 14.7 -6.7 55 55 A E S < S- 0 0 20 -3,-1.9 -3,-0.0 1,-0.1 5,-0.0 -0.360 74.6-127.2 -68.5 143.5 -3.9 15.0 -9.5 56 56 A G >> - 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