==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 12-OCT-06 2IPK . COMPND 2 MOLECULE: HLA CLASS II HISTOCOMPATIBILITY ANTIGEN, DR . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.T.NGUYEN,L.J.STERN . 614 5 4 3 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28800.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 419 68.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 2.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 192 31.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 65 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 75 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.3 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 1 0 0 3 0 0 0 0 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 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 . 4 4 4 4 2 7 1 2 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 1 2 4 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 3 A E 0 0 138 0, 0.0 197,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 163.5 -48.2 64.8 13.2 2 4 A E + 0 0 114 195,-1.4 2,-0.3 1,-0.3 196,-0.2 0.622 360.0 14.2-131.3 -53.0 -45.4 67.2 14.1 3 5 A H E -A 197 0A 37 194,-2.0 194,-3.3 197,-0.1 2,-0.4 -0.978 47.6-165.9-138.4 150.8 -41.9 66.2 13.0 4 6 A V E -A 196 0A 19 -2,-0.3 21,-2.7 192,-0.2 2,-0.5 -0.994 1.2-168.8-134.6 129.7 -40.2 63.8 10.7 5 7 A I E -AB 195 24A 4 190,-2.4 190,-3.2 -2,-0.4 2,-0.4 -0.976 14.5-168.0-115.6 129.4 -36.5 62.8 10.5 6 8 A I E -AB 194 23A 23 17,-2.9 17,-2.5 -2,-0.5 2,-0.7 -0.963 20.0-160.5-124.7 131.7 -35.4 60.8 7.5 7 9 A Q E -AB 193 22A 0 186,-2.5 186,-2.2 -2,-0.4 2,-0.4 -0.936 29.8-177.5-101.3 113.5 -32.2 58.9 6.8 8 10 A A E +AB 192 21A 4 13,-3.0 13,-2.5 -2,-0.7 2,-0.3 -0.959 10.0 163.9-122.8 136.0 -32.2 58.6 3.0 9 11 A E E +AB 191 20A 1 182,-2.3 182,-2.1 -2,-0.4 2,-0.3 -0.944 6.2 176.5-142.3 160.0 -29.8 56.9 0.8 10 12 A F E -AB 190 19A 5 9,-1.9 9,-2.1 -2,-0.3 2,-0.4 -0.989 17.0-154.8-159.7 160.1 -29.5 55.6 -2.8 11 13 A Y E -AB 189 18A 0 178,-2.0 178,-2.0 -2,-0.3 2,-0.4 -0.993 16.3-160.7-137.5 136.1 -27.3 54.0 -5.3 12 14 A L E >> -AB 188 17A 0 5,-2.7 4,-1.7 -2,-0.4 5,-1.3 -0.975 15.3-121.2-126.6 128.4 -27.7 54.4 -9.1 13 15 A N E 45S+A 187 0A 22 174,-2.5 174,-2.5 -2,-0.4 -2,-0.0 -0.846 84.3 10.0-108.0 151.3 -26.4 52.2 -11.9 14 16 A P T 45S+ 0 0 36 0, 0.0 -1,-0.2 0, 0.0 172,-0.1 -0.967 124.9 59.7 -89.9 9.6 -24.7 52.5 -14.3 15 17 A D T 45S- 0 0 14 1,-0.1 -2,-0.2 2,-0.1 416,-0.2 0.757 89.4-143.1 -66.2 -20.3 -23.8 56.0 -13.1 16 18 A Q T <5 + 0 0 37 -4,-1.7 415,-0.5 1,-0.2 2,-0.4 0.857 45.7 151.8 61.9 32.5 -22.3 54.6 -9.9 17 19 A S E < -B 12 0A 35 -5,-1.3 -5,-2.7 413,-0.1 2,-0.3 -0.804 20.0-179.6 -98.9 140.6 -23.6 57.5 -8.0 18 20 A G E -B 11 0A 19 -2,-0.4 2,-0.3 -7,-0.2 -7,-0.2 -0.963 6.8-171.2-136.1 155.1 -24.5 57.1 -4.4 19 21 A E E -B 10 0A 19 -9,-2.1 -9,-1.9 -2,-0.3 2,-0.3 -0.997 10.1-174.7-149.5 149.6 -25.9 59.4 -1.7 20 22 A F E +B 9 0A 1 -2,-0.3 12,-2.1 12,-0.3 2,-0.3 -0.957 24.4 149.5-146.1 121.5 -26.5 59.3 2.1 21 23 A M E -BC 8 31A 0 -13,-2.5 -13,-3.0 -2,-0.3 2,-0.4 -0.981 37.0-130.8-152.8 161.8 -28.2 62.1 3.9 22 24 A F E -BC 7 30A 0 8,-2.4 7,-2.8 -2,-0.3 8,-1.0 -0.938 23.0-165.4-116.2 141.4 -30.4 63.1 6.9 23 25 A D E -BC 6 28A 6 -17,-2.5 -17,-2.9 -2,-0.4 2,-0.5 -0.977 9.1-162.8-131.0 137.9 -33.5 65.3 6.5 24 26 A F E > S-BC 5 27A 1 3,-3.2 3,-2.5 -2,-0.4 -19,-0.2 -0.974 79.0 -27.6-123.6 115.5 -35.6 67.1 9.1 25 27 A D T 3 S- 0 0 51 -21,-2.7 -1,-0.1 -2,-0.5 -20,-0.1 0.855 128.3 -45.9 48.7 40.3 -39.0 68.2 8.0 26 28 A G T 3 S+ 0 0 14 -22,-0.3 2,-0.4 1,-0.2 -1,-0.3 0.268 118.3 107.2 91.5 -14.8 -37.9 68.5 4.4 27 29 A D E < S-C 24 0A 2 -3,-2.5 -3,-3.2 305,-0.1 -1,-0.2 -0.832 72.8-114.1-103.0 139.0 -34.6 70.3 5.1 28 30 A E E -C 23 0A 5 -2,-0.4 -5,-0.3 303,-0.3 3,-0.1 -0.458 25.3-177.4 -70.8 131.8 -31.2 68.7 4.8 29 31 A I E - 0 0 0 -7,-2.8 13,-2.7 1,-0.4 14,-0.4 0.869 67.5 -39.0 -90.6 -49.4 -29.2 68.3 8.0 30 32 A F E -CD 22 41A 0 -8,-1.0 -8,-2.4 11,-0.3 -1,-0.4 -0.981 48.4-153.3-166.5 166.5 -26.2 66.8 6.4 31 33 A H E -CD 21 40A 36 9,-1.8 9,-3.1 -2,-0.3 2,-0.5 -0.905 28.2-110.3-140.4 167.4 -25.0 64.4 3.7 32 34 A V E - D 0 39A 5 -12,-2.1 2,-0.9 -2,-0.3 -12,-0.3 -0.906 17.2-134.6-109.0 127.4 -21.8 62.4 3.4 33 35 A D E >> - D 0 38A 47 5,-2.8 4,-1.8 -2,-0.5 5,-1.1 -0.687 17.6-160.3 -76.0 110.5 -19.1 63.2 0.8 34 36 A M T 45S+ 0 0 13 -2,-0.9 -1,-0.2 -16,-0.2 -15,-0.1 0.762 86.6 47.0 -64.6 -28.7 -18.4 59.7 -0.5 35 37 A A T 45S+ 0 0 37 1,-0.1 -1,-0.2 3,-0.1 -2,-0.1 0.891 121.0 33.4 -82.8 -42.4 -15.0 60.7 -2.0 36 38 A K T 45S- 0 0 117 2,-0.1 -2,-0.2 0, 0.0 -1,-0.1 0.630 100.0-135.1 -87.6 -12.2 -13.7 62.6 1.0 37 39 A K T <5 + 0 0 14 -4,-1.8 2,-0.3 1,-0.2 18,-0.2 0.946 61.8 117.9 59.2 50.1 -15.4 60.3 3.5 38 40 A E E < -D 33 0A 86 -5,-1.1 -5,-2.8 16,-0.2 2,-0.3 -0.982 68.6-100.8-146.5 158.2 -16.7 63.1 5.6 39 41 A T E -D 32 0A 24 -2,-0.3 2,-0.6 13,-0.3 -7,-0.2 -0.591 27.4-159.7 -78.7 134.9 -19.9 64.7 6.9 40 42 A V E -D 31 0A 54 -9,-3.1 -9,-1.8 -2,-0.3 2,-0.2 -0.947 11.8-148.1-119.1 109.9 -21.0 67.9 5.1 41 43 A W E -D 30 0A 54 -2,-0.6 -11,-0.3 -11,-0.2 -12,-0.1 -0.487 12.8-135.5 -78.0 145.1 -23.5 69.9 7.2 42 44 A R S S+ 0 0 54 -13,-2.7 2,-0.4 1,-0.2 -1,-0.1 0.906 96.7 27.5 -66.6 -41.7 -26.1 72.0 5.5 43 45 A L S >> S- 0 0 28 -14,-0.4 3,-1.0 1,-0.1 4,-0.7 -0.968 83.1-128.7-120.3 137.9 -25.5 75.0 7.7 44 46 A E T >4 S+ 0 0 135 -2,-0.4 3,-0.9 1,-0.2 4,-0.3 0.872 104.9 63.8 -51.1 -42.7 -22.0 75.5 9.3 45 47 A E T >> S+ 0 0 65 1,-0.2 3,-2.2 2,-0.2 4,-0.7 0.851 90.6 65.5 -52.8 -40.3 -23.6 75.9 12.8 46 48 A F H X> S+ 0 0 0 -3,-1.0 4,-1.6 1,-0.3 3,-1.4 0.876 92.6 61.1 -51.9 -43.6 -24.9 72.3 12.8 47 49 A G H << S+ 0 0 33 -3,-0.9 -1,-0.3 -4,-0.7 -2,-0.2 0.557 101.8 54.1 -63.7 -7.4 -21.4 70.9 12.8 48 50 A R H <4 S+ 0 0 154 -3,-2.2 -1,-0.3 -4,-0.3 -2,-0.2 0.631 113.2 40.0 -99.1 -17.6 -20.7 72.7 16.1 49 51 A F H << S+ 0 0 87 -3,-1.4 2,-0.3 -4,-0.7 -2,-0.2 0.580 123.4 17.0-106.2 -13.1 -23.7 71.2 17.9 50 52 A A < - 0 0 10 -4,-1.6 2,-0.3 323,-0.0 323,-0.2 -0.950 59.3-152.1-151.9 169.2 -23.6 67.6 16.6 51 53 A S B -h 373 0B 55 321,-1.7 323,-2.6 -2,-0.3 2,-0.3 -0.894 2.7-159.6-140.8 171.0 -21.4 65.1 14.9 52 54 A F - 0 0 21 -2,-0.3 2,-1.5 321,-0.2 -13,-0.3 -0.965 27.0-120.8-156.6 138.3 -21.7 62.0 12.7 53 55 A E > - 0 0 100 321,-0.5 3,-1.7 -2,-0.3 4,-0.5 -0.624 30.0-173.8 -81.8 88.8 -19.5 59.0 11.9 54 56 A A T >> S+ 0 0 8 -2,-1.5 3,-1.9 1,-0.3 4,-1.0 0.838 76.8 64.9 -52.3 -42.7 -19.2 59.5 8.1 55 57 A Q H 3> S+ 0 0 6 1,-0.3 4,-1.0 -18,-0.2 -1,-0.3 0.779 93.8 65.3 -56.6 -22.9 -17.3 56.2 7.4 56 58 A G H <> S+ 0 0 7 -3,-1.7 4,-1.3 1,-0.2 -1,-0.3 0.790 92.6 58.7 -70.6 -27.8 -20.5 54.5 8.6 57 59 A A H <> S+ 0 0 0 -3,-1.9 4,-2.2 -4,-0.5 -1,-0.2 0.886 99.9 58.9 -68.1 -35.3 -22.5 55.8 5.6 58 60 A L H X S+ 0 0 13 -4,-1.0 4,-1.7 1,-0.2 -1,-0.2 0.872 99.9 55.8 -61.6 -36.2 -20.0 54.1 3.3 59 61 A A H X S+ 0 0 23 -4,-1.0 4,-1.6 1,-0.2 -1,-0.2 0.937 109.5 47.1 -60.9 -45.1 -20.8 50.7 4.9 60 62 A N H X S+ 0 0 4 -4,-1.3 4,-3.0 1,-0.2 -2,-0.2 0.898 107.8 55.3 -62.9 -42.2 -24.5 51.2 4.0 61 63 A I H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.841 105.2 52.9 -62.1 -34.6 -23.8 52.3 0.5 62 64 A A H X S+ 0 0 9 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.920 111.7 45.1 -68.2 -42.1 -21.8 49.2 -0.2 63 65 A V H X S+ 0 0 23 -4,-1.6 4,-2.8 1,-0.2 -2,-0.2 0.918 111.2 55.1 -66.2 -39.1 -24.8 47.1 1.0 64 66 A D H X S+ 0 0 0 -4,-3.0 4,-2.6 1,-0.2 -2,-0.2 0.919 107.9 47.8 -59.8 -43.2 -27.1 49.4 -1.1 65 67 A K H X S+ 0 0 5 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.939 111.2 50.5 -63.9 -44.7 -25.2 48.7 -4.2 66 68 A A H X S+ 0 0 19 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.929 113.2 46.6 -58.7 -43.9 -25.2 44.9 -3.6 67 69 A N H X S+ 0 0 3 -4,-2.8 4,-2.7 1,-0.2 5,-0.2 0.877 105.9 58.9 -67.8 -35.3 -28.9 45.1 -3.1 68 70 A L H X S+ 0 0 0 -4,-2.6 4,-2.7 -5,-0.2 -1,-0.2 0.951 107.8 46.8 -57.8 -45.1 -29.4 47.2 -6.2 69 71 A E H X S+ 0 0 27 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.857 110.3 51.6 -66.3 -34.6 -27.9 44.4 -8.3 70 72 A I H X S+ 0 0 33 -4,-1.7 4,-2.4 -5,-0.2 -1,-0.2 0.936 115.0 43.4 -65.6 -44.8 -29.9 41.7 -6.6 71 73 A M H X S+ 0 0 0 -4,-2.7 4,-1.6 2,-0.2 -2,-0.2 0.867 109.5 55.9 -69.0 -38.0 -33.1 43.7 -7.3 72 74 A T H ><>S+ 0 0 8 -4,-2.7 5,-2.5 -5,-0.2 3,-0.6 0.970 113.1 42.2 -57.5 -51.8 -32.1 44.6 -10.8 73 75 A K H ><5S+ 0 0 146 -4,-2.1 3,-1.9 1,-0.2 -2,-0.2 0.917 111.5 55.1 -61.2 -44.8 -31.7 40.9 -11.6 74 76 A R H 3<5S+ 0 0 62 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.756 107.2 50.4 -62.6 -25.5 -34.9 39.9 -9.8 75 77 A S T <<5S- 0 0 17 -4,-1.6 -1,-0.3 -3,-0.6 -2,-0.2 0.334 118.8-110.4 -93.4 7.2 -36.9 42.4 -11.9 76 78 A N T < 5S- 0 0 141 -3,-1.9 -3,-0.2 1,-0.2 -2,-0.1 0.927 72.7 -58.8 61.9 43.5 -35.5 41.0 -15.1 77 79 A Y S - 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