==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 06-MAR-06 2G9H . COMPND 2 MOLECULE: HLA CLASS II HISTOCOMPATIBILITY ANTIGEN, DR ALPHA . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.M.FERNANDEZ,R.GUAN,E.L.MALCHIODI,R.A.MARIUZZA . 594 4 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28206.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 397 66.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 197 33.2 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 . 7 1.2 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 . 51 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 71 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.7 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 0 0 1 1 0 1 0 0 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 1 1 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 . 5 3 6 4 3 7 0 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 . 2 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 4 A E 0 0 131 0, 0.0 2,-0.3 0, 0.0 196,-0.2 0.000 360.0 360.0 360.0 -50.7 50.1 6.5 21.7 2 5 A H E -A 196 0A 33 194,-1.7 194,-2.8 197,-0.2 2,-0.3 -0.985 360.0-166.4-139.5 154.6 48.8 3.8 19.2 3 6 A V E -A 195 0A 40 -2,-0.3 21,-2.3 192,-0.2 2,-0.5 -0.975 0.3-170.0-139.3 127.2 49.5 2.8 15.6 4 7 A I E -AB 194 23A 6 190,-2.3 190,-3.3 -2,-0.3 2,-0.5 -0.976 12.4-171.0-113.7 127.2 47.4 0.5 13.4 5 8 A I E -AB 193 22A 21 17,-2.1 17,-2.5 -2,-0.5 2,-0.7 -0.983 19.4-157.9-123.1 126.4 49.0 -0.6 10.1 6 9 A Q E -AB 192 21A 0 186,-2.7 186,-2.2 -2,-0.5 2,-0.5 -0.924 28.3-175.5 -92.4 113.1 47.5 -2.4 7.2 7 10 A A E +AB 191 20A 13 13,-2.4 13,-2.3 -2,-0.7 2,-0.3 -0.966 11.0 166.2-121.8 126.6 50.5 -4.0 5.5 8 11 A E E -AB 190 19A 4 182,-2.3 182,-3.0 -2,-0.5 2,-0.3 -0.895 7.3-176.6-129.1 158.7 50.5 -6.0 2.3 9 12 A F E -AB 189 18A 7 9,-1.6 9,-1.4 -2,-0.3 2,-0.4 -0.989 14.2-155.6-148.2 155.3 53.3 -7.1 -0.1 10 13 A Y E -AB 188 17A 19 178,-2.5 178,-2.2 -2,-0.3 2,-0.4 -0.998 15.2-162.2-125.5 141.1 53.7 -8.9 -3.4 11 14 A L E >> -AB 187 16A 0 5,-2.5 4,-1.7 -2,-0.4 5,-1.6 -0.979 12.8-127.2-129.2 125.6 56.9 -10.7 -4.3 12 15 A N E 45S+A 186 0A 19 174,-2.5 174,-2.5 -2,-0.4 -2,-0.0 -0.867 83.0 13.1-110.0 150.6 58.2 -11.9 -7.8 13 16 A P T 45S+ 0 0 38 0, 0.0 -1,-0.2 0, 0.0 172,-0.1 -0.974 125.8 59.2 -83.3 8.5 59.2 -14.4 -9.1 14 17 A D T 45S- 0 0 47 2,-0.1 -2,-0.2 1,-0.0 3,-0.1 0.748 90.5-146.7 -67.2 -27.1 57.8 -16.2 -6.0 15 18 A Q T <5 + 0 0 109 -4,-1.7 2,-0.4 1,-0.2 -3,-0.2 0.951 47.7 138.6 59.9 52.2 54.3 -14.9 -6.8 16 19 A S E < +B 11 0A 46 -5,-1.6 -5,-2.5 2,-0.0 2,-0.3 -0.983 26.3 175.1-131.4 138.8 53.4 -14.7 -3.2 17 20 A G E -B 10 0A 16 -2,-0.4 2,-0.3 -7,-0.2 -7,-0.2 -0.948 9.7-162.2-138.4 161.7 51.6 -12.0 -1.3 18 21 A E E -B 9 0A 44 -9,-1.4 -9,-1.6 -2,-0.3 2,-0.4 -0.973 4.8-160.1-144.9 153.6 50.2 -11.3 2.2 19 22 A F E +B 8 0A 0 12,-0.4 12,-1.9 -2,-0.3 2,-0.3 -0.979 26.2 154.5-138.6 118.3 47.7 -9.0 3.8 20 23 A M E -BC 7 30A 3 -13,-2.3 -13,-2.4 -2,-0.4 2,-0.4 -0.959 35.4-135.3-142.8 162.7 47.7 -8.2 7.5 21 24 A F E -BC 6 29A 0 8,-2.4 7,-2.9 -2,-0.3 8,-1.0 -0.978 21.5-164.0-116.2 138.6 46.7 -5.7 10.2 22 25 A D E -BC 5 27A 8 -17,-2.5 -17,-2.1 -2,-0.4 2,-0.5 -0.939 6.7-163.7-122.9 133.2 49.2 -4.8 13.0 23 26 A F E > S-BC 4 26A 0 3,-3.4 3,-2.2 -2,-0.4 -19,-0.2 -0.969 77.3 -31.5-120.6 114.9 48.4 -3.1 16.3 24 27 A D T 3 S- 0 0 56 -21,-2.3 -20,-0.1 -2,-0.5 3,-0.1 0.805 128.9 -42.1 47.5 35.9 51.4 -1.7 18.2 25 28 A G T 3 S+ 0 0 15 1,-0.3 2,-0.4 -22,-0.2 -1,-0.3 0.315 119.5 103.1 102.3 -8.9 53.6 -4.5 16.8 26 29 A D E < S-C 23 0A 1 -3,-2.2 -3,-3.4 305,-0.1 2,-0.3 -0.887 74.9-113.0-111.1 141.5 51.2 -7.4 17.2 27 30 A E E -C 22 0A 7 -2,-0.4 -5,-0.3 303,-0.3 3,-0.1 -0.539 24.8-176.3 -71.9 124.9 49.2 -9.0 14.4 28 31 A I E - 0 0 0 -7,-2.9 13,-2.9 1,-0.4 14,-0.4 0.919 68.1 -35.1 -78.1 -54.9 45.4 -8.5 14.7 29 32 A F E -CD 21 40A 0 -8,-1.0 -8,-2.4 11,-0.2 -1,-0.4 -0.987 49.5-154.6-160.3 161.3 44.7 -10.7 11.7 30 33 A H E -CD 20 39A 39 9,-2.1 9,-2.8 -2,-0.3 2,-0.5 -0.908 26.4-115.0-132.6 165.0 45.9 -11.8 8.3 31 34 A V E - D 0 38A 6 -12,-1.9 2,-0.8 -2,-0.3 -12,-0.4 -0.915 18.0-135.3-102.7 129.1 44.1 -13.2 5.2 32 35 A D E >> - D 0 37A 45 5,-3.2 5,-1.4 -2,-0.5 4,-1.2 -0.761 17.8-164.1 -72.0 107.5 44.7 -16.8 4.1 33 36 A M T 45S+ 0 0 41 -2,-0.8 -1,-0.2 -16,-0.2 -15,-0.1 0.843 85.3 49.7 -69.3 -33.8 45.0 -16.2 0.4 34 37 A A T 45S+ 0 0 89 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.947 120.4 33.1 -66.7 -51.2 44.6 -19.9 -0.4 35 38 A K T 45S- 0 0 144 2,-0.1 -2,-0.2 1,-0.0 -1,-0.2 0.540 102.2-129.8 -84.9 -7.1 41.4 -20.5 1.7 36 39 A K T <5 + 0 0 127 -4,-1.2 2,-0.3 1,-0.2 -3,-0.2 0.919 64.4 125.0 56.2 47.9 40.1 -16.9 1.0 37 40 A E E < -D 32 0A 93 -5,-1.4 -5,-3.2 16,-0.1 2,-0.4 -0.983 66.1-110.5-143.4 153.4 39.5 -16.3 4.8 38 41 A T E -D 31 0A 27 -2,-0.3 2,-0.5 13,-0.3 -7,-0.2 -0.631 28.8-164.2 -76.7 127.6 40.3 -14.1 7.7 39 42 A V E -D 30 0A 47 -9,-2.8 -9,-2.1 -2,-0.4 2,-0.2 -0.968 10.8-144.9-120.0 112.3 42.5 -15.6 10.3 40 43 A W E -D 29 0A 43 -2,-0.5 -11,-0.2 -11,-0.2 3,-0.2 -0.526 12.7-134.8 -79.2 142.1 42.6 -13.9 13.7 41 44 A R S S+ 0 0 55 -13,-2.9 2,-0.5 1,-0.3 -12,-0.1 0.934 102.7 24.2 -62.3 -47.2 45.8 -13.8 15.7 42 45 A L S >> S- 0 0 28 -14,-0.4 3,-2.3 1,-0.1 4,-0.5 -0.990 86.6-133.5-113.5 129.0 43.9 -14.8 18.9 43 46 A E G >4 S+ 0 0 177 -2,-0.5 3,-1.1 1,-0.3 4,-0.3 0.778 102.3 65.5 -51.2 -35.4 40.6 -16.6 18.1 44 47 A E G >4 S+ 0 0 82 1,-0.2 3,-1.1 2,-0.2 4,-0.4 0.727 87.6 69.8 -62.4 -24.4 38.6 -14.5 20.6 45 48 A F G X> S+ 0 0 0 -3,-2.3 3,-1.5 1,-0.2 4,-1.0 0.884 92.8 59.7 -54.4 -41.3 39.3 -11.4 18.3 46 49 A G G << S+ 0 0 32 -3,-1.1 -1,-0.2 -4,-0.5 -2,-0.2 0.589 94.2 63.7 -67.6 -14.7 36.9 -13.1 15.8 47 50 A R G <4 S+ 0 0 181 -3,-1.1 -1,-0.3 -4,-0.3 -2,-0.2 0.659 112.8 32.7 -80.0 -15.8 34.1 -13.1 18.3 48 51 A F T <4 S+ 0 0 94 -3,-1.5 2,-0.3 -4,-0.4 -2,-0.2 0.517 122.4 29.2-119.0 -10.7 34.0 -9.2 18.4 49 52 A A < - 0 0 7 -4,-1.0 2,-0.3 216,-0.1 323,-0.2 -0.945 57.3-155.6-148.6 161.0 35.0 -8.2 14.8 50 53 A S B -h 372 0B 51 321,-2.0 323,-3.7 -2,-0.3 2,-0.3 -0.956 1.2-164.0-137.1 156.7 34.9 -9.3 11.2 51 54 A F - 0 0 17 -2,-0.3 2,-0.9 321,-0.2 -13,-0.3 -0.958 26.3-125.4-139.4 131.3 36.8 -8.7 8.0 52 55 A E > - 0 0 111 321,-0.5 3,-1.6 -2,-0.3 4,-0.5 -0.631 20.9-157.5 -74.2 103.1 35.7 -9.5 4.5 53 56 A A T >> S+ 0 0 6 -2,-0.9 3,-1.5 1,-0.3 4,-1.3 0.792 83.4 69.6 -53.3 -37.4 38.5 -11.6 3.1 54 57 A Q H 3> S+ 0 0 141 1,-0.3 4,-2.3 2,-0.2 -1,-0.3 0.794 89.7 64.1 -56.1 -30.3 37.8 -10.9 -0.6 55 58 A G H <> S+ 0 0 14 -3,-1.6 4,-1.9 1,-0.2 -1,-0.3 0.806 100.7 51.1 -62.7 -32.5 38.9 -7.3 -0.1 56 59 A A H <> S+ 0 0 0 -3,-1.5 4,-2.4 -4,-0.5 -1,-0.2 0.893 109.4 49.9 -67.3 -43.5 42.4 -8.6 0.6 57 60 A L H X S+ 0 0 43 -4,-1.3 4,-1.7 2,-0.2 -2,-0.2 0.868 110.8 49.5 -64.4 -39.9 42.4 -10.7 -2.5 58 61 A A H X S+ 0 0 55 -4,-2.3 4,-1.5 2,-0.2 -1,-0.2 0.925 111.8 48.4 -64.5 -47.1 41.3 -7.7 -4.6 59 62 A N H X S+ 0 0 4 -4,-1.9 4,-1.7 1,-0.2 -2,-0.2 0.888 109.2 53.9 -58.8 -40.7 44.0 -5.5 -3.1 60 63 A I H X S+ 0 0 18 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.879 103.2 56.3 -64.3 -36.3 46.6 -8.3 -3.8 61 64 A A H X S+ 0 0 62 -4,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.922 109.6 45.5 -59.9 -45.1 45.6 -8.4 -7.5 62 65 A V H X S+ 0 0 31 -4,-1.5 4,-1.9 2,-0.2 319,-0.2 0.822 111.6 53.2 -63.2 -37.1 46.4 -4.7 -7.8 63 66 A D H X S+ 0 0 0 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.878 107.9 50.6 -67.4 -43.4 49.7 -5.2 -5.8 64 67 A K H X S+ 0 0 72 -4,-2.6 4,-1.6 2,-0.2 -2,-0.2 0.940 112.4 45.4 -59.8 -51.9 50.8 -7.9 -8.2 65 68 A A H X S+ 0 0 50 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.865 113.3 51.0 -60.2 -38.1 50.1 -5.8 -11.3 66 69 A N H X S+ 0 0 4 -4,-1.9 4,-2.6 2,-0.2 -1,-0.2 0.836 103.9 57.3 -70.3 -35.3 51.8 -2.8 -9.7 67 70 A L H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.918 106.4 50.3 -58.1 -44.5 54.9 -4.8 -8.8 68 71 A E H X S+ 0 0 82 -4,-1.6 4,-1.4 2,-0.2 -2,-0.2 0.900 109.0 51.6 -61.8 -41.6 55.2 -5.6 -12.5 69 72 A I H X S+ 0 0 43 -4,-1.7 4,-2.3 1,-0.2 3,-0.2 0.945 113.9 43.6 -56.7 -49.4 54.9 -1.9 -13.4 70 73 A M H X S+ 0 0 1 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.837 106.1 60.5 -69.5 -35.4 57.7 -1.0 -10.9 71 74 A T H <>S+ 0 0 14 -4,-2.6 5,-2.9 1,-0.2 6,-0.3 0.883 114.2 37.8 -56.6 -38.2 60.0 -3.8 -12.0 72 75 A K H ><5S+ 0 0 136 -4,-1.4 3,-1.6 -3,-0.2 -2,-0.2 0.865 112.0 55.6 -81.9 -40.9 60.0 -2.3 -15.5 73 76 A R H 3<5S+ 0 0 63 -4,-2.3 -2,-0.2 1,-0.3 -3,-0.2 0.851 108.4 50.0 -62.5 -34.2 60.1 1.3 -14.4 74 77 A S T 3<5S- 0 0 11 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.380 119.0-111.8 -83.5 5.0 63.2 0.7 -12.4 75 78 A N T < 5S- 0 0 141 -3,-1.6 -3,-0.2 1,-0.2 -2,-0.1 0.922 73.6 -54.2 59.0 45.9 64.8 -1.1 -15.4 76 79 A Y S - 0 0 96 -2,-0.5 3,-2.2 3,-0.4 82,-0.0 -0.960 40.3 -90.6-120.4 136.3 60.4 -25.5 34.9 96 99 A L T 3 S- 0 0 76 -2,-0.4 57,-0.2 1,-0.3 55,-0.0 -0.167 107.1 -10.2 -44.9 118.1 61.2 -29.2 34.7 97 100 A R T 3 S+ 0 0 178 55,-1.9 -1,-0.3 1,-0.2 56,-0.1 0.733 98.0 126.8 54.7 33.7 58.2 -30.9 33.0 98 101 A E S < S- 0 0 112 -3,-2.2 -3,-0.4 52,-0.0 -1,-0.2 -0.980 71.6-105.4-110.9 117.9 55.9 -27.9 33.0 99 102 A P + 0 0 114 0, 0.0 2,-0.2 0, 0.0 52,-0.2 -0.040 52.8 163.4 -44.8 136.9 54.7 -27.3 29.4 100 103 A N E - K 0 150D 11 50,-2.6 50,-2.4 48,-0.1 2,-0.4 -0.792 31.8-118.2-142.9-175.1 56.3 -24.2 27.9 101 104 A V E - K 0 149D 33 48,-0.3 -10,-1.2 -2,-0.2 2,-0.4 -0.993 13.0-143.2-140.5 127.3 56.8 -22.7 24.4 102 105 A L E -JK 90 148D 0 46,-3.1 46,-2.1 -2,-0.4 2,-0.5 -0.774 18.0-154.1 -87.2 129.2 60.0 -22.1 22.5 103 106 A I E -JK 89 147D 1 -14,-3.5 -14,-2.1 -2,-0.4 2,-0.6 -0.916 9.9-166.1-108.6 127.3 60.0 -19.0 20.4 104 107 A a E -JK 88 146D 0 42,-2.7 42,-2.2 -2,-0.5 2,-0.6 -0.961 14.3-165.3-108.7 109.2 62.2 -18.6 17.4 105 108 A F E -JK 87 145D 40 -18,-3.1 -18,-1.9 -2,-0.6 2,-0.5 -0.865 4.6-166.9-101.3 120.5 62.2 -14.9 16.5 106 109 A I E +JK 86 144D 0 38,-3.1 38,-2.2 -2,-0.6 2,-0.3 -0.925 19.6 173.3-111.3 129.0 63.5 -14.0 13.0 107 110 A D E +JK 85 143D 15 -22,-2.3 -22,-2.5 -2,-0.5 36,-0.2 -0.909 40.2 20.6-141.9 153.6 64.1 -10.3 12.5 108 111 A K E S+ 0 0 75 34,-0.5 2,-0.3 -2,-0.3 -1,-0.1 0.851 82.5 129.5 61.4 44.1 65.5 -7.5 10.2 109 112 A F E - 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