==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 28-MAY-10 2XFX . COMPND 2 MOLECULE: MHC CLASS 1; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR I.K.MACDONALD,M.HARKIOLAKI,L.HUNT,W.I.MORRISON,T.CONNELLEY, . 387 3 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19768.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 247 63.8 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 . 134 34.6 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 . 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 . 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 . 20 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 57 14.7 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 2 0 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 . 3 6 2 2 1 3 0 2 2 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 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 83 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 137.8 66.7 63.2 9.9 2 2 A S - 0 0 54 102,-0.1 2,-0.3 103,-0.1 102,-0.2 -0.458 360.0-163.1 -79.7 163.8 68.4 60.6 7.7 3 3 A H E -A 103 0A 38 100,-2.4 100,-2.8 -2,-0.1 2,-0.3 -0.974 5.9-147.9-148.8 161.5 67.7 56.9 8.1 4 4 A S E -A 102 0A 19 -2,-0.3 25,-1.7 98,-0.2 2,-0.5 -0.962 10.0-159.4-135.2 150.2 69.2 53.4 7.3 5 5 A L E +AB 101 28A 0 96,-2.6 96,-1.5 -2,-0.3 2,-0.4 -0.998 29.6 173.0-119.2 127.3 68.1 49.9 6.4 6 6 A R E -AB 100 27A 29 21,-2.6 21,-3.0 -2,-0.5 2,-0.4 -0.997 20.5-161.2-139.5 139.8 70.9 47.4 7.0 7 7 A Y E -AB 99 26A 4 92,-3.0 92,-2.0 -2,-0.4 2,-0.4 -0.940 6.4-159.6-115.3 151.8 71.3 43.7 7.0 8 8 A F E -AB 98 25A 27 17,-2.8 17,-2.2 -2,-0.4 2,-0.4 -0.990 6.4-169.9-134.7 116.8 74.1 41.7 8.6 9 9 A H E -AB 97 24A 2 88,-2.4 88,-2.1 -2,-0.4 2,-0.4 -0.881 2.5-173.9-106.9 142.2 75.0 38.1 7.5 10 10 A T E -AB 96 23A 2 13,-2.2 13,-2.4 -2,-0.4 2,-0.4 -0.995 1.0-175.6-134.5 122.7 77.3 35.9 9.4 11 11 A A E -AB 95 22A 0 84,-3.0 84,-2.7 -2,-0.4 2,-0.5 -0.991 3.5-173.5-117.7 132.2 78.3 32.5 8.0 12 12 A V E -AB 94 21A 6 9,-2.5 9,-2.4 -2,-0.4 82,-0.2 -0.959 19.6-134.2-129.6 116.0 80.5 30.2 10.1 13 13 A S - 0 0 20 80,-2.4 80,-0.1 -2,-0.5 62,-0.0 -0.477 13.8-157.8 -67.9 154.9 81.9 27.0 8.8 14 14 A R > - 0 0 63 3,-0.2 3,-2.3 -2,-0.1 5,-0.1 -0.777 16.5-134.5-142.7 86.1 81.6 24.0 11.1 15 15 A P T 3 S+ 0 0 60 0, 0.0 75,-0.1 0, 0.0 3,-0.1 -0.091 89.2 10.0 -42.3 126.2 84.1 21.3 10.4 16 16 A G T 3 S+ 0 0 84 1,-0.3 2,-0.3 73,-0.1 74,-0.0 0.614 102.6 106.8 71.7 13.5 82.3 17.9 10.4 17 17 A L S < S- 0 0 115 -3,-2.3 -1,-0.3 1,-0.1 -3,-0.2 -0.839 78.9-115.5-111.2 164.3 78.7 19.1 10.6 18 18 A R S S+ 0 0 213 -2,-0.3 -2,-0.1 1,-0.1 -1,-0.1 0.810 91.8 15.9 -66.0 -29.4 76.3 19.0 7.6 19 19 A E S S- 0 0 71 -5,-0.1 -1,-0.1 -4,-0.1 53,-0.0 -0.988 75.3-109.2-144.9 147.9 76.0 22.8 7.3 20 20 A P - 0 0 14 0, 0.0 2,-0.5 0, 0.0 -7,-0.2 -0.257 44.2-101.3 -59.7 164.7 77.5 26.1 8.3 21 21 A L E -B 12 0A 37 -9,-2.4 -9,-2.5 18,-0.0 2,-0.4 -0.811 42.1-171.3 -90.7 125.7 75.8 28.3 10.8 22 22 A F E +B 11 0A 1 -2,-0.5 16,-2.7 -11,-0.2 2,-0.4 -0.980 7.5 174.6-123.6 123.1 74.1 31.1 8.9 23 23 A I E -BC 10 37A 7 -13,-2.4 -13,-2.2 -2,-0.4 2,-0.4 -0.973 7.8-172.9-128.8 133.3 72.5 34.1 10.8 24 24 A T E -BC 9 36A 10 12,-2.2 12,-2.0 -2,-0.4 2,-0.3 -0.993 3.2-178.5-120.4 141.0 71.0 37.2 9.4 25 25 A V E -BC 8 35A 0 -17,-2.2 -17,-2.8 -2,-0.4 2,-0.4 -0.972 10.2-154.5-133.5 142.6 69.8 40.2 11.3 26 26 A G E -BC 7 34A 0 8,-2.0 7,-3.0 -2,-0.3 8,-1.1 -0.984 9.7-172.2-117.4 146.9 68.2 43.4 10.0 27 27 A Y E -BC 6 32A 32 -21,-3.0 -21,-2.6 -2,-0.4 2,-0.5 -0.951 21.5-157.2-135.4 143.4 68.1 46.8 11.4 28 28 A V E > S-BC 5 31A 0 3,-2.3 3,-2.4 -2,-0.3 -23,-0.2 -0.999 82.5 -43.4-114.1 119.6 66.4 50.1 10.7 29 29 A D T 3 S- 0 0 31 -25,-1.7 -23,-0.1 -2,-0.5 -26,-0.1 -0.314 126.2 -24.1 52.3-123.3 68.7 52.7 12.3 30 30 A D T 3 S+ 0 0 55 149,-0.1 2,-0.5 -3,-0.1 -1,-0.3 0.029 118.0 99.9-105.3 24.0 69.6 51.3 15.7 31 31 A T E < -C 28 0A 8 -3,-2.4 -3,-2.3 148,-0.0 2,-0.3 -0.949 66.1-139.6-113.4 122.4 66.5 49.0 16.0 32 32 A Q E +C 27 0A 34 -2,-0.5 -5,-0.3 -5,-0.2 3,-0.1 -0.596 28.3 167.6 -76.7 131.0 66.7 45.3 15.2 33 33 A F E + 0 0 0 -7,-3.0 15,-2.4 -2,-0.3 16,-0.6 0.656 55.1 17.3-123.2 -19.6 63.5 44.2 13.3 34 34 A V E -CD 26 47A 5 -8,-1.1 -8,-2.0 13,-0.3 -1,-0.3 -0.974 54.6-175.0-148.1 160.7 64.1 40.8 11.8 35 35 A R E -CD 25 46A 42 11,-1.8 11,-2.4 -2,-0.3 2,-0.3 -0.981 9.8-163.1-148.5 163.9 66.3 37.7 12.2 36 36 A F E -C 24 0A 4 -12,-2.0 -12,-2.2 -2,-0.3 2,-0.4 -0.981 8.0-171.5-140.7 137.9 66.9 34.3 10.6 37 37 A D E > -C 23 0A 42 7,-0.4 3,-2.3 -2,-0.3 -14,-0.2 -0.926 15.2-156.7-136.2 112.3 68.9 31.6 12.2 38 38 A S T 3 S+ 0 0 29 -16,-2.7 -15,-0.1 -2,-0.4 -1,-0.1 0.661 94.3 60.0 -60.3 -17.1 69.8 28.4 10.2 39 39 A D T 3 S+ 0 0 90 -17,-0.2 -1,-0.3 3,-0.1 -16,-0.1 0.573 77.8 113.1 -91.4 -6.3 70.1 26.5 13.4 40 40 A A S < S- 0 0 28 -3,-2.3 -4,-0.0 1,-0.1 0, 0.0 -0.220 82.3-110.2 -57.3 160.2 66.4 27.0 14.5 41 41 A R S S+ 0 0 256 1,-0.3 -1,-0.1 2,-0.0 -3,-0.0 0.934 114.8 12.3 -59.2 -46.0 64.2 23.9 14.5 42 42 A D S S- 0 0 110 2,-0.1 -1,-0.3 0, 0.0 -3,-0.1 -0.791 97.9-137.2-129.9 84.9 62.3 25.1 11.5 43 43 A P + 0 0 28 0, 0.0 2,-0.3 0, 0.0 -5,-0.1 -0.202 38.1 154.0 -57.9 129.1 64.3 28.1 10.3 44 44 A R - 0 0 71 -7,-0.2 -7,-0.4 23,-0.1 2,-0.4 -0.989 50.3-102.4-147.2 151.2 62.3 31.1 9.4 45 45 A T - 0 0 8 15,-0.5 -9,-0.2 -2,-0.3 19,-0.2 -0.649 49.5-169.6 -72.0 133.5 62.6 34.8 9.1 46 46 A E E -D 35 0A 62 -11,-2.4 -11,-1.8 -2,-0.4 2,-0.1 -0.915 23.0-108.7-131.6 151.7 61.0 36.2 12.3 47 47 A P E -D 34 0A 37 0, 0.0 -13,-0.3 0, 0.0 -14,-0.1 -0.426 19.2-172.8 -77.8 149.9 59.9 39.6 13.5 48 48 A R S S+ 0 0 88 -15,-2.4 -14,-0.2 1,-0.1 -16,-0.1 0.125 73.6 56.6-123.9 12.4 61.9 41.2 16.4 49 49 A Q S > S- 0 0 39 -16,-0.6 3,-1.8 1,-0.1 4,-0.3 -0.990 80.7-129.8-139.9 141.1 59.5 44.1 16.7 50 50 A P G > S+ 0 0 111 0, 0.0 3,-1.7 0, 0.0 4,-0.2 0.837 105.8 62.5 -57.9 -35.5 55.8 44.0 17.4 51 51 A W G > S+ 0 0 21 1,-0.3 3,-0.9 2,-0.2 -18,-0.0 0.568 86.7 72.8 -70.7 -14.7 55.0 46.4 14.5 52 52 A M G X S+ 0 0 0 -3,-1.8 3,-2.0 1,-0.2 -1,-0.3 0.608 75.9 81.3 -67.4 -11.4 56.5 43.9 12.0 53 53 A E G < S+ 0 0 132 -3,-1.7 -1,-0.2 -4,-0.3 -2,-0.2 0.747 72.5 79.2 -69.1 -14.5 53.3 41.9 12.6 54 54 A K G < S+ 0 0 125 -3,-0.9 2,-0.4 -4,-0.2 -1,-0.3 0.646 77.8 87.3 -59.8 -17.2 51.8 44.4 10.1 55 55 A E S < S- 0 0 10 -3,-2.0 5,-0.1 1,-0.1 -3,-0.0 -0.778 78.5-129.8 -91.9 136.0 53.5 42.3 7.3 56 56 A G >> - 0 0 36 -2,-0.4 4,-1.3 1,-0.1 3,-1.0 -0.042 30.8 -87.4 -78.6 174.5 51.5 39.4 6.0 57 57 A P H 3> S+ 0 0 103 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.652 121.4 62.1 -63.0 -18.5 52.5 35.8 5.5 58 58 A E H 3> S+ 0 0 169 2,-0.2 4,-2.5 3,-0.2 5,-0.2 0.864 101.2 53.9 -69.0 -40.4 53.9 36.4 2.0 59 59 A Y H <> S+ 0 0 17 -3,-1.0 4,-2.7 2,-0.2 5,-0.2 0.957 112.8 42.9 -53.1 -54.0 56.5 38.7 3.5 60 60 A W H X S+ 0 0 21 -4,-1.3 4,-2.3 2,-0.2 -15,-0.5 0.911 114.6 49.5 -62.2 -44.2 57.6 36.0 6.0 61 61 A D H X S+ 0 0 78 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.911 114.0 44.6 -63.6 -43.9 57.6 33.2 3.5 62 62 A R H X S+ 0 0 95 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.915 113.0 49.3 -68.8 -44.9 59.6 35.1 0.9 63 63 A E H X S+ 0 0 8 -4,-2.7 4,-1.7 -5,-0.2 -1,-0.2 0.903 113.4 50.9 -61.5 -35.4 62.2 36.4 3.4 64 64 A T H X S+ 0 0 0 -4,-2.3 4,-2.4 -5,-0.2 -2,-0.2 0.940 108.8 49.6 -67.9 -43.5 62.5 32.8 4.6 65 65 A Q H X S+ 0 0 111 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.923 112.0 45.5 -66.7 -40.9 63.0 31.4 1.2 66 66 A I H X S+ 0 0 22 -4,-2.5 4,-2.7 2,-0.2 317,-0.3 0.851 109.8 56.7 -73.0 -27.5 65.7 33.8 0.2 67 67 A S H X S+ 0 0 6 -4,-1.7 4,-2.3 -5,-0.2 -2,-0.2 0.921 107.2 49.3 -66.2 -41.9 67.4 33.3 3.6 68 68 A K H X S+ 0 0 81 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.884 112.6 46.1 -62.6 -44.0 67.6 29.6 2.9 69 69 A E H X S+ 0 0 81 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.882 110.1 54.6 -65.8 -43.8 69.0 30.1 -0.5 70 70 A N H X S+ 0 0 2 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.890 104.3 55.7 -48.9 -43.4 71.5 32.7 1.0 71 71 A A H X S+ 0 0 18 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.905 108.8 47.0 -58.8 -45.7 72.6 30.0 3.4 72 72 A L H X S+ 0 0 75 -4,-1.8 4,-1.6 1,-0.2 -2,-0.2 0.916 110.2 52.5 -62.6 -38.7 73.4 27.7 0.5 73 73 A W H X S+ 0 0 2 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.923 108.5 50.5 -62.8 -47.0 75.2 30.5 -1.3 74 74 A Y H X S+ 0 0 1 -4,-2.4 4,-2.7 1,-0.2 5,-0.2 0.849 103.7 59.4 -62.2 -31.0 77.4 31.1 1.8 75 75 A R H X S+ 0 0 93 -4,-1.7 4,-1.7 1,-0.2 -1,-0.2 0.926 109.3 42.5 -65.0 -44.8 78.3 27.5 2.1 76 76 A E H X S+ 0 0 70 -4,-1.6 4,-2.6 -3,-0.2 -1,-0.2 0.908 112.9 54.1 -65.6 -44.2 79.8 27.5 -1.4 77 77 A A H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.926 105.7 52.6 -56.5 -44.3 81.5 30.9 -0.7 78 78 A L H X S+ 0 0 5 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.918 110.1 48.9 -61.1 -45.5 83.1 29.5 2.4 79 79 A N H X S+ 0 0 58 -4,-1.7 4,-1.6 -5,-0.2 -1,-0.2 0.925 111.3 49.1 -57.0 -44.4 84.5 26.6 0.4 80 80 A N H X S+ 0 0 44 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.922 109.5 51.1 -65.4 -48.4 85.9 28.9 -2.3 81 81 A L H X S+ 0 0 0 -4,-2.8 4,-1.6 1,-0.2 -1,-0.2 0.916 106.3 54.1 -56.7 -43.4 87.6 31.2 0.1 82 82 A R H <>S+ 0 0 34 -4,-2.2 5,-2.8 -5,-0.2 4,-0.4 0.907 107.7 52.9 -56.9 -37.8 89.3 28.4 1.9 83 83 A G H ><5S+ 0 0 45 -4,-1.6 3,-1.5 1,-0.2 -2,-0.2 0.961 106.7 51.3 -60.2 -47.5 90.7 27.3 -1.5 84 84 A Y H 3<5S+ 0 0 54 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.815 117.7 38.7 -58.5 -33.5 92.1 30.8 -2.2 85 85 A Y T 3<5S- 0 0 68 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.289 107.1-120.9-103.9 7.2 93.9 30.8 1.1 86 86 A N T < 5 + 0 0 155 -3,-1.5 2,-0.5 -4,-0.4 -3,-0.2 0.914 56.5 161.5 48.4 48.0 95.0 27.1 1.1 87 87 A Q < - 0 0 50 -5,-2.8 -1,-0.2 -6,-0.2 -2,-0.1 -0.855 40.4-116.1-103.1 131.1 93.0 26.6 4.3 88 88 A S > - 0 0 82 -2,-0.5 3,-1.5 1,-0.1 -1,-0.0 -0.275 13.6-127.5 -65.6 139.9 92.1 23.1 5.4 89 89 A E T 3 S+ 0 0 126 1,-0.2 -1,-0.1 -75,-0.0 -73,-0.1 0.675 104.7 76.9 -55.2 -20.9 88.4 22.1 5.7 90 90 A A T 3 S+ 0 0 81 -75,-0.1 2,-0.3 -76,-0.1 -1,-0.2 0.593 86.9 70.1 -64.7 -16.7 89.3 21.0 9.3 91 91 A G S < S- 0 0 29 -3,-1.5 2,-0.2 -77,-0.1 -77,-0.0 -0.808 82.4-121.0-110.5 146.0 89.4 24.6 10.5 92 92 A S - 0 0 44 -2,-0.3 2,-0.3 -78,-0.1 -78,-0.1 -0.610 29.9-178.9 -84.9 140.6 86.5 27.0 11.0 93 93 A H - 0 0 25 -2,-0.2 -80,-2.4 -80,-0.1 2,-0.4 -0.949 17.2-133.9-136.3 161.4 86.3 30.4 9.2 94 94 A T E -A 12 0A 2 -2,-0.3 25,-3.1 -82,-0.2 2,-0.5 -0.963 11.2-168.9-127.8 125.5 83.9 33.3 9.2 95 95 A L E -AE 11 118A 0 -84,-2.7 -84,-3.0 -2,-0.4 2,-0.3 -0.957 14.1-175.1-108.7 133.7 82.4 35.2 6.4 96 96 A Q E -AE 10 117A 0 21,-2.6 21,-2.8 -2,-0.5 2,-0.4 -0.958 6.5-173.2-129.6 147.5 80.5 38.4 7.2 97 97 A E E -AE 9 116A 0 -88,-2.1 -88,-2.4 -2,-0.3 2,-0.4 -0.997 6.4-173.5-141.5 136.0 78.5 40.8 5.0 98 98 A M E +AE 8 115A 26 17,-2.5 17,-2.8 -2,-0.4 2,-0.3 -0.990 21.0 155.1-125.9 136.1 76.9 44.1 5.7 99 99 A Y E +AE 7 114A 3 -92,-2.0 -92,-3.0 -2,-0.4 2,-0.3 -0.984 10.2 97.0-155.3 157.6 74.7 45.8 3.1 100 100 A G E -AE 6 113A 0 13,-1.9 13,-2.3 -2,-0.3 2,-0.3 -0.956 52.7 -76.7 153.6-160.4 71.8 48.3 2.8 101 101 A a E -AE 5 112A 0 -96,-1.5 -96,-2.6 -2,-0.3 2,-0.4 -0.954 16.4-146.4-139.7 146.2 70.9 51.8 2.1 102 102 A D E -AE 4 111A 30 9,-2.8 8,-3.0 -2,-0.3 9,-1.6 -0.926 19.1-165.6-107.3 139.8 70.9 55.3 3.7 103 103 A V E -AE 3 109A 9 -100,-2.8 -100,-2.4 -2,-0.4 6,-0.2 -0.947 12.8-132.6-126.5 146.9 68.2 57.8 2.8 104 104 A G > - 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