==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM/PEPTIDE 30-AUG-99 1QLF . COMPND 2 MOLECULE: MHC CLASS I H-2DB HEAVY CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR J.TORMO,E.Y.JONES . 384 3 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19550.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 250 65.1 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 . 4 1.0 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-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 . 0 0.0 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 . 27 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 57 14.8 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 6 4 1 0 3 1 3 2 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 67 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 172.5 19.4 17.4 29.1 2 2 A P - 0 0 89 0, 0.0 2,-0.3 0, 0.0 102,-0.3 0.020 360.0-150.3 -63.6 170.8 19.6 17.1 32.9 3 3 A H E +A 103 0A 23 100,-3.2 100,-3.3 101,-0.0 2,-0.3 -0.837 14.3 176.1-136.6 173.1 19.6 14.0 35.1 4 4 A S E -A 102 0A 11 98,-0.3 25,-2.8 -2,-0.3 2,-0.3 -0.967 22.8-140.3-175.6 160.0 18.5 12.9 38.5 5 5 A M E -AB 101 28A 0 96,-1.7 96,-1.2 -2,-0.3 2,-0.3 -0.925 24.8-179.5-125.8 149.7 18.0 10.3 41.2 6 6 A R E -AB 100 27A 32 21,-2.0 21,-2.8 -2,-0.3 2,-0.5 -0.998 20.4-156.4-151.3 149.3 15.0 9.9 43.4 7 7 A Y E -AB 99 26A 0 92,-2.1 92,-1.7 -2,-0.3 2,-0.7 -0.985 10.2-164.8-128.3 119.2 13.8 7.8 46.2 8 8 A F E -AB 98 25A 23 17,-3.5 17,-1.3 -2,-0.5 2,-0.4 -0.905 14.3-175.3-106.8 105.8 10.1 7.6 46.7 9 9 A E E -AB 97 24A 0 88,-2.5 88,-2.3 -2,-0.7 2,-0.4 -0.855 6.0-177.9-108.3 138.1 9.3 6.2 50.1 10 10 A T E -AB 96 23A 9 13,-2.7 13,-2.9 -2,-0.4 2,-0.4 -0.992 7.4-173.7-134.0 139.8 5.8 5.4 51.5 11 11 A A E -AB 95 22A 1 84,-2.1 84,-2.3 -2,-0.4 2,-0.5 -0.999 5.5-167.9-133.2 129.1 4.7 4.0 54.9 12 12 A V E -AB 94 21A 24 9,-2.8 9,-2.5 -2,-0.4 82,-0.2 -0.945 9.9-150.5-122.8 112.6 1.2 3.1 55.5 13 13 A S - 0 0 22 80,-2.5 80,-0.1 -2,-0.5 5,-0.1 -0.296 17.5-167.7 -70.8 164.6 0.1 2.4 59.1 14 14 A R - 0 0 74 3,-0.5 78,-0.2 78,-0.2 3,-0.1 -0.944 27.0 -93.6-159.3 136.9 -2.8 -0.1 59.6 15 15 A P S S+ 0 0 77 0, 0.0 2,-1.5 0, 0.0 3,-0.0 -0.124 102.4 3.0 -51.2 135.6 -5.1 -1.1 62.5 16 16 A G S S+ 0 0 84 1,-0.1 2,-0.8 2,-0.0 75,-0.0 -0.449 105.7 90.9 88.9 -65.1 -4.0 -4.1 64.5 17 17 A L - 0 0 93 -2,-1.5 -3,-0.5 1,-0.2 -1,-0.1 -0.578 63.9-156.2 -72.1 108.4 -0.6 -4.8 62.8 18 18 A E S S+ 0 0 174 -2,-0.8 -1,-0.2 -5,-0.1 -2,-0.0 0.510 75.5 78.0 -63.8 -6.0 1.9 -2.8 64.9 19 19 A E S S- 0 0 87 -5,-0.1 -2,-0.1 -6,-0.0 -1,-0.0 -0.931 78.1-141.0-110.5 117.1 4.2 -2.8 61.8 20 20 A P - 0 0 18 0, 0.0 2,-0.4 0, 0.0 -7,-0.2 -0.343 26.3-104.7 -71.6 155.2 3.4 -0.3 59.0 21 21 A R E -B 12 0A 82 -9,-2.5 -9,-2.8 16,-0.0 2,-0.4 -0.681 39.3-161.5 -82.3 137.2 3.8 -1.3 55.5 22 22 A Y E +B 11 0A 3 -2,-0.4 16,-2.7 -11,-0.2 2,-0.4 -0.973 14.8 176.2-124.8 129.0 6.9 0.3 53.9 23 23 A I E -BC 10 37A 13 -13,-2.9 -13,-2.7 -2,-0.4 2,-0.4 -0.980 3.2-177.6-133.8 122.2 7.7 0.7 50.2 24 24 A S E -BC 9 36A 0 12,-2.4 12,-2.6 -2,-0.4 2,-0.4 -0.936 2.7-176.5-117.8 141.1 10.8 2.5 48.9 25 25 A V E -BC 8 35A 3 -17,-1.3 -17,-3.5 -2,-0.4 2,-0.3 -0.980 8.1-158.3-141.2 125.1 11.4 3.0 45.2 26 26 A G E -BC 7 34A 0 8,-1.6 7,-2.2 -2,-0.4 8,-1.0 -0.777 10.4-168.7-104.4 150.0 14.5 4.6 43.7 27 27 A Y E -BC 6 32A 14 -21,-2.8 -21,-2.0 -2,-0.3 2,-0.4 -0.943 15.4-157.7-135.6 156.7 14.7 6.1 40.2 28 28 A V E > S-BC 5 31A 0 3,-2.2 3,-2.2 -2,-0.3 -23,-0.2 -0.996 89.7 -10.6-133.8 126.1 17.3 7.3 37.8 29 29 A D T 3 S- 0 0 19 -25,-2.8 -24,-0.1 -2,-0.4 -1,-0.1 0.874 133.9 -55.8 48.0 37.7 16.2 9.8 35.1 30 30 A N T 3 S+ 0 0 128 -26,-0.3 2,-0.5 1,-0.2 -1,-0.3 0.662 112.3 125.1 70.5 20.8 12.8 8.8 36.3 31 31 A K E < -C 28 0A 69 -3,-2.2 -3,-2.2 18,-0.0 2,-0.3 -0.931 65.9-119.1-111.9 129.6 13.3 5.1 35.7 32 32 A E E +C 27 0A 36 -2,-0.5 -5,-0.3 -5,-0.2 3,-0.1 -0.507 41.7 162.5 -66.8 124.9 12.7 2.6 38.6 33 33 A F E + 0 0 0 -7,-2.2 15,-2.4 1,-0.4 16,-1.1 0.558 59.7 18.1-122.7 -13.0 16.0 0.9 39.3 34 34 A V E -CD 26 47A 1 -8,-1.0 -8,-1.6 13,-0.3 -1,-0.4 -0.977 62.2-170.0-152.9 158.3 15.6 -0.6 42.8 35 35 A R E -CD 25 46A 8 11,-1.1 11,-1.8 -2,-0.3 2,-0.4 -0.967 10.0-166.2-160.1 141.8 12.8 -1.4 45.1 36 36 A F E -C 24 0A 0 -12,-2.6 -12,-2.4 -2,-0.3 2,-0.4 -0.993 5.6-178.5-132.7 129.7 12.0 -2.5 48.7 37 37 A D E > -C 23 0A 28 -2,-0.4 3,-0.9 7,-0.3 7,-0.3 -0.994 18.3-155.4-127.0 122.7 8.7 -3.8 50.0 38 38 A S T 3 S+ 0 0 8 -16,-2.7 -15,-0.1 -2,-0.4 -1,-0.1 0.701 94.3 59.7 -70.6 -19.1 8.4 -4.7 53.7 39 39 A D T 3 S+ 0 0 66 -17,-0.3 -1,-0.2 3,-0.1 -16,-0.1 0.636 79.2 108.2 -85.2 -13.9 5.6 -7.1 52.9 40 40 A A S < S- 0 0 51 -3,-0.9 -4,-0.0 1,-0.1 0, 0.0 -0.152 85.8-110.1 -57.3 159.0 7.7 -9.3 50.6 41 41 A E S S+ 0 0 174 1,-0.3 -1,-0.1 2,-0.0 -3,-0.0 0.919 113.4 22.8 -59.2 -44.8 8.6 -12.7 52.1 42 42 A N S S- 0 0 130 2,-0.1 -1,-0.3 -5,-0.0 -3,-0.1 -0.771 91.4-140.0-126.5 84.7 12.2 -11.7 52.4 43 43 A P + 0 0 53 0, 0.0 2,-0.2 0, 0.0 -5,-0.1 -0.112 46.6 124.3 -45.6 129.7 12.5 -7.8 52.6 44 44 A R - 0 0 91 -7,-0.3 -7,-0.3 -9,-0.1 -2,-0.1 -0.832 65.4 -87.4 177.2 146.9 15.4 -6.5 50.6 45 45 A Y - 0 0 2 15,-0.4 -9,-0.2 -2,-0.2 19,-0.1 -0.407 45.7-157.3 -64.5 142.0 16.1 -4.0 47.8 46 46 A E E -D 35 0A 82 -11,-1.8 -11,-1.1 -2,-0.1 2,-0.2 -0.962 22.2-108.3-125.2 140.2 15.8 -5.6 44.4 47 47 A P E +D 34 0A 41 0, 0.0 -13,-0.3 0, 0.0 -14,-0.1 -0.507 34.1 176.7 -67.0 129.7 17.3 -4.5 41.2 48 48 A R + 0 0 90 -15,-2.4 -14,-0.2 -2,-0.2 -16,-0.1 0.457 65.3 56.9-110.0 -7.9 14.5 -3.2 39.0 49 49 A A S > S- 0 0 4 -16,-1.1 3,-1.5 1,-0.1 4,-0.2 -0.926 85.6-123.6-121.5 147.5 16.7 -2.1 36.1 50 50 A P G > S+ 0 0 77 0, 0.0 3,-1.5 0, 0.0 4,-0.2 0.834 107.4 61.8 -60.3 -34.1 19.1 -4.5 34.2 51 51 A W G 3 S+ 0 0 12 1,-0.3 3,-0.2 2,-0.1 125,-0.1 0.428 92.1 67.8 -74.3 2.7 22.2 -2.4 34.8 52 52 A M G X S+ 0 0 0 -3,-1.5 3,-1.2 1,-0.2 -1,-0.3 0.485 77.0 84.8 -97.3 -4.8 21.8 -2.9 38.6 53 53 A E T < S+ 0 0 149 -3,-1.5 -1,-0.2 1,-0.2 -2,-0.1 0.790 77.4 65.3 -66.1 -30.0 22.6 -6.6 38.3 54 54 A Q T 3 S+ 0 0 117 -4,-0.2 2,-0.4 -3,-0.2 -1,-0.2 0.556 76.2 107.7 -72.1 -7.4 26.3 -6.0 38.5 55 55 A E < - 0 0 10 -3,-1.2 5,-0.0 1,-0.1 -3,-0.0 -0.602 67.1-136.5 -75.1 128.2 26.0 -4.7 42.0 56 56 A G >> - 0 0 35 -2,-0.4 4,-1.4 1,-0.1 3,-0.8 -0.177 26.9 -87.2 -81.7 175.4 27.4 -7.3 44.5 57 57 A P H 3> S+ 0 0 117 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.777 123.7 58.2 -50.2 -38.1 26.2 -8.6 47.8 58 58 A E H 3> S+ 0 0 125 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.925 104.7 53.0 -62.7 -41.6 27.8 -5.9 49.8 59 59 A Y H <> S+ 0 0 18 -3,-0.8 4,-1.9 1,-0.2 -1,-0.2 0.921 111.7 42.7 -58.2 -50.1 25.8 -3.3 47.9 60 60 A W H X S+ 0 0 23 -4,-1.4 4,-3.0 1,-0.2 -15,-0.4 0.828 110.6 55.6 -69.7 -32.2 22.4 -4.8 48.5 61 61 A E H X S+ 0 0 101 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.919 109.4 47.4 -66.6 -41.1 23.1 -5.5 52.2 62 62 A R H X S+ 0 0 129 -4,-2.0 4,-1.6 -5,-0.2 -2,-0.2 0.915 115.8 44.8 -64.9 -43.6 23.9 -1.9 52.8 63 63 A E H X S+ 0 0 2 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.934 114.2 47.2 -65.7 -49.5 20.8 -0.7 50.9 64 64 A T H X S+ 0 0 17 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.882 109.1 57.2 -60.3 -37.3 18.5 -3.2 52.5 65 65 A Q H X S+ 0 0 82 -4,-2.2 4,-1.9 -5,-0.3 -1,-0.2 0.898 106.4 48.0 -62.1 -40.4 20.0 -2.3 55.9 66 66 A K H X S+ 0 0 37 -4,-1.6 4,-2.8 2,-0.2 -1,-0.2 0.909 108.4 54.8 -66.4 -40.7 19.1 1.4 55.3 67 67 A A H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.901 107.1 50.8 -58.7 -41.6 15.5 0.4 54.3 68 68 A K H X S+ 0 0 91 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.908 110.8 49.2 -62.9 -40.1 15.2 -1.5 57.6 69 69 A G H X S+ 0 0 42 -4,-1.9 4,-1.7 1,-0.2 -2,-0.2 0.898 109.1 52.8 -65.2 -38.9 16.4 1.6 59.3 70 70 A Q H X S+ 0 0 4 -4,-2.8 4,-3.2 2,-0.2 5,-0.3 0.902 100.7 60.8 -63.1 -42.0 13.9 3.7 57.4 71 71 A E H X S+ 0 0 26 -4,-2.4 4,-3.1 1,-0.2 -1,-0.2 0.943 106.9 45.8 -50.5 -52.4 11.0 1.5 58.4 72 72 A Q H X S+ 0 0 96 -4,-1.4 4,-2.5 2,-0.2 -1,-0.2 0.898 111.5 51.7 -59.7 -42.0 11.6 2.3 62.1 73 73 A W H X S+ 0 0 18 -4,-1.7 4,-3.0 1,-0.2 313,-0.3 0.944 114.8 42.9 -59.8 -47.7 11.9 6.0 61.3 74 74 A F H X S+ 0 0 1 -4,-3.2 4,-2.8 2,-0.2 5,-0.2 0.874 111.0 55.5 -65.8 -38.4 8.6 5.9 59.5 75 75 A R H X S+ 0 0 76 -4,-3.1 4,-1.5 -5,-0.3 -1,-0.2 0.917 114.2 41.0 -59.9 -42.5 7.0 3.7 62.2 76 76 A V H X S+ 0 0 30 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.926 114.5 49.4 -72.5 -47.8 8.0 6.3 64.8 77 77 A S H X S+ 0 0 0 -4,-3.0 4,-3.4 2,-0.2 5,-0.3 0.932 108.2 53.8 -59.2 -45.7 7.1 9.4 62.8 78 78 A L H X S+ 0 0 9 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.938 109.9 49.9 -52.5 -46.3 3.7 8.0 61.9 79 79 A R H X S+ 0 0 137 -4,-1.5 4,-0.8 -5,-0.2 -2,-0.2 0.944 112.8 44.9 -57.2 -53.0 3.2 7.5 65.6 80 80 A N H >X S+ 0 0 35 -4,-2.8 4,-2.7 1,-0.2 3,-1.2 0.917 110.4 53.9 -60.2 -43.4 4.2 11.1 66.4 81 81 A L H 3X S+ 0 0 0 -4,-3.4 4,-1.6 1,-0.3 -1,-0.2 0.884 102.4 59.0 -57.8 -38.0 2.2 12.6 63.5 82 82 A L H 3<>S+ 0 0 42 -4,-2.1 5,-2.0 -5,-0.3 -1,-0.3 0.773 111.6 41.8 -62.0 -25.8 -0.9 10.8 64.9 83 83 A G H X<5S+ 0 0 43 -3,-1.2 3,-1.8 -4,-0.8 -2,-0.2 0.859 106.7 58.6 -88.5 -41.5 -0.2 12.7 68.1 84 84 A Y H 3<5S+ 0 0 54 -4,-2.7 -2,-0.2 1,-0.3 -3,-0.2 0.783 116.1 38.2 -57.8 -27.9 0.6 16.1 66.5 85 85 A Y T 3<5S- 0 0 73 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.232 106.7-125.9-108.2 11.9 -2.9 15.9 64.9 86 86 A N T < 5 + 0 0 151 -3,-1.8 -3,-0.2 1,-0.2 2,-0.2 0.821 51.8 163.4 46.2 39.6 -4.7 14.4 67.9 87 87 A Q < - 0 0 54 -5,-2.0 2,-0.2 -6,-0.2 -1,-0.2 -0.519 35.3-115.3 -85.0 155.3 -6.0 11.6 65.7 88 88 A S - 0 0 101 -2,-0.2 3,-0.2 1,-0.1 -1,-0.1 -0.522 25.6-111.2 -91.2 158.7 -7.4 8.3 67.1 89 89 A A S S+ 0 0 87 -2,-0.2 -1,-0.1 1,-0.2 3,-0.1 -0.146 87.6 65.4 -77.5 177.6 -6.0 4.8 66.8 90 90 A G S S+ 0 0 63 1,-0.3 2,-0.2 -76,-0.1 -1,-0.2 0.754 87.7 99.2 79.3 24.9 -7.5 2.0 64.9 91 91 A G S S- 0 0 28 -3,-0.2 2,-0.4 -77,-0.1 -1,-0.3 -0.630 71.5-107.4-129.5-171.6 -7.0 3.7 61.6 92 92 A S + 0 0 68 -2,-0.2 2,-0.3 -78,-0.2 -78,-0.2 -0.987 32.7 179.8-126.2 130.2 -4.8 3.8 58.5 93 93 A H - 0 0 24 -2,-0.4 -80,-2.5 -80,-0.1 2,-0.5 -0.963 16.7-141.3-134.0 150.2 -2.4 6.7 57.7 94 94 A T E +A 12 0A 4 -2,-0.3 25,-3.2 -82,-0.2 26,-0.4 -0.924 14.3 179.2-116.8 130.8 0.1 7.5 55.0 95 95 A L E -AE 11 118A 0 -84,-2.3 -84,-2.1 -2,-0.5 2,-0.3 -0.994 13.2-175.5-125.9 128.1 3.5 9.2 55.3 96 96 A Q E -AE 10 117A 0 21,-3.3 21,-2.3 -2,-0.4 2,-0.3 -0.899 10.5-167.5-127.5 157.1 5.7 9.8 52.2 97 97 A Q E -AE 9 116A 0 -88,-2.3 -88,-2.5 -2,-0.3 2,-0.4 -0.998 4.8-163.3-142.4 142.4 9.2 11.1 51.4 98 98 A M E +AE 8 115A 12 17,-2.2 17,-1.7 -2,-0.3 2,-0.3 -0.994 17.8 170.9-126.7 125.7 10.9 12.2 48.2 99 99 A S E +AE 7 114A 1 -92,-1.7 -92,-2.1 -2,-0.4 2,-0.3 -0.935 17.2 96.6-132.4 157.0 14.7 12.5 48.1 100 100 A G E -AE 6 113A 0 13,-1.6 13,-2.4 -2,-0.3 2,-0.3 -0.976 49.6-100.5 159.2-171.3 17.2 13.0 45.4 101 101 A a E -AE 5 112A 0 -96,-1.2 -96,-1.7 -2,-0.3 2,-0.4 -0.996 18.2-140.2-149.2 144.6 19.4 15.3 43.4 102 102 A D E -AE 4 111A 34 9,-2.3 8,-3.1 -2,-0.3 9,-0.9 -0.871 17.3-164.6-106.8 140.3 19.2 16.9 39.9 103 103 A L E -AE 3 109A 0 -100,-3.3 -100,-3.2 -2,-0.4 6,-0.2 -0.947 16.6-126.6-123.9 146.3 22.2 17.2 37.7 104 104 A G > - 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