==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HISTOCOMPATIBILITY COMPLEX 24-MAR-97 1AGC . COMPND 2 MOLECULE: B*0801; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.W.REID,S.MCADAM,K.J.SMITH,P.KLENERMAN,C.A.O'CALLAGHAN, . 383 3 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18783.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 255 66.6 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 . 135 35.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 1.6 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 0.3 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 . 24 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 59 15.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.0 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 1 0 0 0 0 0 1 0 1 1 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 . 2 7 2 2 0 4 0 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 0 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 1 A G 0 0 70 0, 0.0 103,-0.3 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 163.1 -32.0 -68.0 29.9 2 2 A S + 0 0 44 101,-1.9 2,-0.3 1,-0.2 102,-0.2 0.508 360.0 53.5-146.0 -14.6 -30.2 -64.6 30.1 3 3 A H E -A 103 0A 20 100,-2.0 100,-3.0 26,-0.1 2,-0.3 -0.975 44.7-175.9-136.6 154.3 -31.9 -61.8 28.2 4 4 A S E -A 102 0A 29 -2,-0.3 25,-2.5 98,-0.2 2,-0.4 -0.973 12.2-157.3-144.0 144.2 -35.2 -60.0 27.7 5 5 A M E +AB 101 28A 0 96,-2.3 96,-0.8 -2,-0.3 2,-0.3 -0.976 25.4 172.9-116.0 138.1 -36.6 -57.3 25.6 6 6 A R E -AB 100 27A 40 21,-2.2 21,-3.1 -2,-0.4 2,-0.5 -0.997 24.8-150.3-148.3 144.1 -39.6 -55.4 26.9 7 7 A Y E -AB 99 26A 0 92,-2.5 92,-1.3 -2,-0.3 2,-0.6 -0.976 10.2-159.6-114.0 128.7 -41.8 -52.3 26.0 8 8 A F E -AB 98 25A 28 17,-2.8 17,-2.0 -2,-0.5 2,-0.4 -0.938 14.3-175.5-111.9 105.6 -43.4 -50.3 28.8 9 9 A D E -AB 97 24A 0 88,-2.7 88,-2.1 -2,-0.6 2,-0.4 -0.891 7.5-175.2-106.8 133.7 -46.4 -48.3 27.5 10 10 A T E -AB 96 23A 4 13,-2.7 13,-3.0 -2,-0.4 2,-0.4 -0.996 2.5-177.4-128.7 125.9 -48.4 -45.8 29.6 11 11 A A E -AB 95 22A 1 84,-2.2 84,-2.8 -2,-0.4 2,-0.4 -0.998 9.5-176.7-122.7 125.9 -51.5 -44.0 28.2 12 12 A M E -AB 94 21A 12 9,-2.4 9,-2.1 -2,-0.4 82,-0.2 -0.987 16.9-142.3-132.4 122.7 -53.1 -41.6 30.6 13 13 A S - 0 0 18 80,-2.8 80,-0.1 -2,-0.4 6,-0.1 -0.519 14.3-176.1 -78.4 152.2 -56.3 -39.6 30.0 14 14 A R > - 0 0 33 4,-0.5 3,-2.5 -2,-0.2 78,-0.1 -0.617 17.8-148.5-149.6 76.3 -56.5 -36.0 31.2 15 15 A P T 3 S+ 0 0 59 0, 0.0 4,-0.1 0, 0.0 77,-0.1 -0.280 85.6 18.4 -51.2 128.3 -60.0 -34.6 30.5 16 16 A G T 3 S+ 0 0 87 2,-0.1 3,-0.1 1,-0.0 74,-0.0 0.270 116.1 74.2 92.9 -10.9 -59.8 -30.9 29.9 17 17 A R S < S- 0 0 144 -3,-2.5 2,-0.1 1,-0.5 -1,-0.0 -0.133 105.5 -88.4-127.2 36.7 -56.1 -31.0 29.1 18 18 A G - 0 0 53 2,-0.0 -4,-0.5 3,-0.0 -1,-0.5 -0.374 69.7 -22.9 93.1-177.2 -55.9 -32.6 25.7 19 19 A E S S- 0 0 96 1,-0.2 -7,-0.1 -2,-0.1 56,-0.0 -0.345 85.4 -77.3 -67.5 153.2 -55.8 -36.1 24.3 20 20 A P - 0 0 14 0, 0.0 2,-0.4 0, 0.0 -7,-0.3 -0.256 50.3-118.9 -56.4 132.7 -54.4 -38.9 26.5 21 21 A R E -B 12 0A 56 -9,-2.1 -9,-2.4 -3,-0.1 2,-0.5 -0.624 29.2-162.2 -75.1 133.2 -50.7 -38.9 26.8 22 22 A F E +B 11 0A 1 -2,-0.4 16,-3.0 -11,-0.2 2,-0.4 -0.959 11.8 175.2-118.5 125.9 -49.0 -42.0 25.4 23 23 A I E -BC 10 37A 2 -13,-3.0 -13,-2.7 -2,-0.5 2,-0.4 -0.995 6.9-173.9-133.0 133.5 -45.4 -43.0 26.2 24 24 A S E -BC 9 36A 0 12,-2.7 12,-2.0 -2,-0.4 2,-0.4 -0.994 1.7-173.5-125.2 126.1 -43.6 -46.1 25.2 25 25 A V E -BC 8 35A 0 -17,-2.0 -17,-2.8 -2,-0.4 2,-0.4 -0.971 12.6-148.4-119.6 132.5 -40.0 -47.0 26.5 26 26 A G E -BC 7 34A 0 8,-2.2 7,-3.1 -2,-0.4 8,-1.3 -0.875 16.0-172.8-102.6 140.1 -38.1 -50.0 25.2 27 27 A Y E -BC 6 32A 25 -21,-3.1 -21,-2.2 -2,-0.4 2,-0.5 -0.925 25.6-159.3-130.6 149.1 -35.6 -52.0 27.2 28 28 A V E > S-BC 5 31A 0 3,-2.2 3,-2.4 -2,-0.3 -23,-0.2 -0.994 83.2 -49.2-121.6 109.9 -33.1 -54.8 26.7 29 29 A D T 3 S- 0 0 31 -25,-2.5 -23,-0.1 -2,-0.5 -26,-0.1 -0.327 124.3 -21.7 58.7-121.8 -32.7 -56.1 30.3 30 30 A D T 3 S+ 0 0 61 -3,-0.1 2,-0.6 149,-0.1 -1,-0.3 -0.005 117.1 98.6-106.3 25.1 -32.1 -53.0 32.4 31 31 A T E < -C 28 0A 24 -3,-2.4 -3,-2.2 148,-0.0 2,-0.2 -0.953 65.5-145.1-114.3 112.1 -30.9 -50.8 29.5 32 32 A Q E +C 27 0A 28 -2,-0.6 -5,-0.3 -5,-0.2 3,-0.1 -0.588 23.5 172.0 -72.6 135.7 -33.5 -48.4 28.0 33 33 A F E + 0 0 0 -7,-3.1 15,-2.0 1,-0.3 16,-0.7 0.560 57.3 18.4-120.4 -16.6 -32.8 -48.1 24.3 34 34 A V E -CD 26 47A 0 -8,-1.3 -8,-2.2 13,-0.3 -1,-0.3 -0.974 52.6-171.0-150.1 160.6 -35.8 -46.2 22.9 35 35 A R E -CD 25 46A 51 11,-1.0 11,-2.4 -2,-0.3 2,-0.4 -0.972 2.8-170.2-150.6 145.6 -38.6 -43.9 24.0 36 36 A F E -C 24 0A 2 -12,-2.0 -12,-2.7 -2,-0.3 2,-0.4 -0.981 8.5-178.4-137.2 131.1 -41.7 -42.5 22.2 37 37 A D E > -C 23 0A 13 7,-0.4 3,-1.6 -2,-0.4 -14,-0.2 -0.990 24.2-153.6-134.9 121.7 -43.7 -39.7 23.8 38 38 A S T 3 S+ 0 0 22 -16,-3.0 -15,-0.1 -2,-0.4 -1,-0.1 0.692 99.2 61.2 -67.2 -17.8 -46.9 -38.3 22.2 39 39 A D T 3 S+ 0 0 82 -17,-0.3 -1,-0.3 3,-0.1 2,-0.2 0.337 77.0 111.7 -85.8 -1.6 -46.2 -35.1 24.2 40 40 A A S < S- 0 0 21 -3,-1.6 -4,-0.0 1,-0.1 0, 0.0 -0.542 84.8-114.0 -70.3 144.7 -42.8 -34.5 22.5 41 41 A A S S+ 0 0 113 1,-0.3 -1,-0.1 -2,-0.2 -3,-0.0 0.869 114.9 17.5 -47.0 -41.7 -42.8 -31.4 20.3 42 42 A S S S- 0 0 68 2,-0.1 -1,-0.3 -5,-0.1 -3,-0.1 -0.772 93.1-143.8-132.3 84.6 -42.3 -33.8 17.3 43 43 A P + 0 0 31 0, 0.0 2,-0.3 0, 0.0 -5,-0.1 -0.311 40.4 139.4 -54.7 123.4 -43.2 -37.4 18.5 44 44 A R - 0 0 121 -7,-0.2 2,-0.5 -9,-0.1 -7,-0.4 -0.954 61.9 -85.8-157.7 159.6 -41.0 -40.0 17.0 45 45 A E - 0 0 5 15,-0.5 -9,-0.2 -2,-0.3 19,-0.2 -0.667 55.0-167.8 -73.0 120.9 -39.2 -43.1 18.0 46 46 A E E -D 35 0A 30 -11,-2.4 -11,-1.0 -2,-0.5 7,-0.1 -0.964 21.6-112.8-126.4 133.0 -35.8 -42.0 19.5 47 47 A P E +D 34 0A 47 0, 0.0 -13,-0.3 0, 0.0 -14,-0.1 -0.125 27.5 173.9 -55.3 142.3 -32.6 -43.7 20.6 48 48 A R S S+ 0 0 117 -15,-2.0 -14,-0.2 1,-0.3 -16,-0.1 0.086 70.3 50.3-134.6 11.3 -31.7 -43.8 24.3 49 49 A A S >> S- 0 0 6 -16,-0.7 3,-1.8 1,-0.1 4,-0.7 -0.952 82.3-124.2-154.0 134.7 -28.7 -46.0 23.9 50 50 A P G >4 S+ 0 0 106 0, 0.0 3,-0.9 0, 0.0 4,-0.5 0.813 103.7 62.8 -48.9 -39.9 -25.7 -45.7 21.5 51 51 A W G 34 S+ 0 0 17 1,-0.2 125,-0.1 2,-0.2 -18,-0.1 0.556 100.0 51.0 -70.3 -8.3 -26.1 -49.2 20.0 52 52 A I G X4 S+ 0 0 0 -3,-1.8 3,-1.6 1,-0.1 -1,-0.2 0.622 91.9 77.5-100.7 -15.3 -29.6 -48.6 18.4 53 53 A E T << S+ 0 0 121 -3,-0.9 -2,-0.2 -4,-0.7 -1,-0.1 0.773 83.8 63.7 -61.9 -35.7 -28.5 -45.3 16.7 54 54 A Q T 3 S+ 0 0 123 -4,-0.5 -1,-0.3 120,-0.1 -2,-0.1 0.550 78.1 109.6 -65.6 -15.3 -26.7 -47.2 13.9 55 55 A E S < S- 0 0 14 -3,-1.6 5,-0.1 1,-0.1 -3,-0.0 -0.446 78.1-102.8 -64.4 139.4 -30.1 -48.6 12.9 56 56 A G >> - 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