==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 28-JUL-07 2QRI . COMPND 2 MOLECULE: H-2 CLASS I HISTOCOMPATIBILITY ANTIGEN K-B ALPHA . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR V.E.MITAKSOV,D.H.FREMONT . 796 4 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 40150.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 506 63.6 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 . 270 33.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 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 . 53 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 57 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 117 14.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.1 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 0 0 0 0 0 0 2 0 0 2 0 0 0 2 0 0 0 0 0 0 0 0 0 0 2 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 . 4 13 5 4 0 8 0 6 3 3 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 4 4 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 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 1PA S 0 0 9 0, 0.0 289,-0.1 0, 0.0 290,-0.1 0.000 360.0 360.0 360.0 116.6 1.2 39.6 34.1 2 2PA I - 0 0 1 1,-0.1 221,-0.0 127,-0.1 147,-0.0 -0.310 360.0-102.5 -68.6 150.5 1.2 43.1 32.6 3 3PA I - 0 0 4 1,-0.1 2,-0.7 -2,-0.0 -1,-0.1 -0.285 30.8-109.3 -71.6 157.3 -0.8 45.9 34.3 4 4PA N - 0 0 94 188,-0.0 2,-0.1 189,-0.0 -1,-0.1 -0.832 46.6-127.8 -85.9 120.5 -4.2 47.1 33.0 5 5PA F - 0 0 13 -2,-0.7 2,-0.4 1,-0.0 191,-0.1 -0.391 9.4-139.6 -76.8 148.1 -3.3 50.6 31.6 6 6PA E - 0 0 71 -2,-0.1 264,-0.0 1,-0.1 -1,-0.0 -0.860 37.6 -98.4-103.1 135.9 -5.0 53.8 32.4 7 7PA K - 0 0 69 -2,-0.4 190,-0.1 1,-0.1 -1,-0.1 -0.228 19.7-144.5 -56.3 144.7 -5.5 56.1 29.5 8 8PA L S S+ 0 0 0 188,-0.2 261,-0.1 3,-0.0 -1,-0.1 0.793 78.0 64.4 -77.5 -33.4 -3.1 59.0 29.1 9 9PA G S S- 0 0 1 1,-0.1 191,-0.1 2,-0.1 4,-0.1 -0.413 83.4-121.3 -95.2 168.6 -5.7 61.4 27.8 10 10PA G - 0 0 64 2,-0.3 2,-0.6 -2,-0.1 3,-0.1 0.581 53.7-117.4 -80.3 -9.5 -8.8 63.1 29.2 11 11PA G S S+ 0 0 30 1,-0.3 -1,-0.1 188,-0.1 -2,-0.1 -0.564 85.6 91.7 110.9 -69.3 -10.8 61.5 26.5 12 12PA A - 0 0 88 -2,-0.6 -2,-0.3 1,-0.1 -1,-0.3 -0.354 57.2-170.7 -63.2 141.0 -12.2 64.5 24.5 13 13PA S + 0 0 61 -3,-0.1 2,-0.8 -4,-0.1 -1,-0.1 0.141 38.4 101.5-107.3-137.6 -10.0 65.5 21.6 14 14PA G + 0 0 52 1,-0.2 3,-0.3 3,-0.1 195,-0.1 -0.813 25.7 173.5 96.6-109.3 -10.0 68.5 19.3 15 15PA G - 0 0 47 -2,-0.8 -1,-0.2 1,-0.2 194,-0.1 0.971 53.8-110.5 60.8 54.0 -7.4 71.1 20.2 16 16PA G S S+ 0 0 91 193,-0.0 2,-0.2 2,-0.0 -1,-0.2 0.248 80.9 103.9 -18.0 85.1 -8.1 73.1 17.1 17 17PA G + 0 0 30 -3,-0.3 2,-0.3 193,-0.1 3,-0.1 -0.768 38.1 174.5-177.5 127.7 -4.9 72.5 15.2 18 18PA S + 0 0 90 -2,-0.2 192,-0.2 1,-0.1 193,-0.1 -0.958 68.1 21.6-137.8 156.0 -3.7 70.4 12.3 19 19PA G S S+ 0 0 56 -2,-0.3 2,-0.4 1,-0.1 191,-0.2 0.756 89.3 120.1 60.2 22.6 -0.5 70.0 10.4 20 20PA G + 0 0 42 189,-2.4 2,-0.2 -3,-0.1 -1,-0.1 -0.590 62.8 20.1-118.9 70.4 1.2 71.5 13.4 21 21PA G + 0 0 57 -2,-0.4 190,-0.2 -3,-0.0 2,-0.1 -0.854 41.8 154.2 155.7 170.1 3.7 69.0 14.7 22 22PA G - 0 0 61 -2,-0.2 2,-0.2 188,-0.1 194,-0.0 -0.343 30.4-126.4 144.9 133.9 5.9 65.9 14.1 23 23PA S - 0 0 52 -2,-0.1 219,-0.0 1,-0.1 -2,-0.0 -0.559 34.1 -75.6-106.4 170.4 9.1 64.6 15.7 24 1BA I - 0 0 144 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 -0.198 41.2-141.6 -59.5 144.6 12.6 63.5 14.7 25 2BA Q - 0 0 86 83,-0.1 2,-0.5 84,-0.1 -1,-0.1 -0.731 13.1-126.5-105.7 156.5 13.0 60.1 13.1 26 3BA K B -A 54 0A 60 28,-2.2 28,-1.7 -2,-0.3 83,-0.2 -0.916 18.6-125.6-113.3 132.6 16.0 57.8 13.8 27 4BA T - 0 0 80 -2,-0.5 2,-0.1 26,-0.2 24,-0.0 -0.510 29.2-112.9 -74.6 132.8 18.1 56.3 11.0 28 5BA P - 0 0 10 0, 0.0 2,-0.4 0, 0.0 24,-0.2 -0.362 19.4-145.1 -68.4 142.5 18.5 52.5 10.9 29 6BA Q E -B 51 0B 103 22,-2.8 22,-2.1 -2,-0.1 2,-0.4 -0.841 22.2-155.4-101.6 145.1 21.9 51.0 11.6 30 7BA I E +B 50 0B 29 -2,-0.4 2,-0.4 20,-0.2 20,-0.2 -0.968 19.8 180.0-131.7 140.8 22.6 47.8 9.5 31 8BA Q E -B 49 0B 35 18,-1.6 18,-2.5 -2,-0.4 2,-0.5 -0.999 6.9-167.8-134.5 134.7 24.8 44.8 9.8 32 9BA V E +B 48 0B 17 -2,-0.4 87,-0.5 16,-0.2 2,-0.3 -0.994 28.3 136.6-123.9 126.4 25.0 41.9 7.3 33 10BA Y E -B 47 0B 6 14,-1.8 14,-3.3 -2,-0.5 2,-0.2 -0.988 49.1-100.4-164.2 160.0 26.7 38.7 8.3 34 11BA S E -B 46 0B 13 -2,-0.3 12,-0.2 12,-0.2 -2,-0.0 -0.528 22.3-132.4 -89.0 156.2 26.5 34.9 8.2 35 12BA R S S+ 0 0 50 10,-2.7 -1,-0.1 -2,-0.2 11,-0.1 0.924 93.0 27.7 -70.1 -43.4 25.3 32.8 11.1 36 13BA H S S- 0 0 95 9,-0.4 9,-0.1 1,-0.1 -2,-0.1 -0.734 110.0 -72.3-114.8 163.8 28.2 30.4 10.8 37 14BA P - 0 0 82 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.315 60.9-110.5 -55.2 132.7 31.7 30.9 9.4 38 15BA P + 0 0 43 0, 0.0 2,-0.5 0, 0.0 56,-0.0 -0.581 40.5 176.5 -74.4 120.8 31.3 31.2 5.6 39 16BA E > - 0 0 112 -2,-0.5 3,-2.4 3,-0.3 -3,-0.0 -0.994 37.3-112.5-123.5 121.2 32.7 28.2 3.7 40 17BA N T 3 S+ 0 0 75 -2,-0.5 56,-0.2 1,-0.3 54,-0.0 -0.300 102.6 16.9 -56.4 127.3 32.2 28.3 -0.0 41 18BA G T 3 S+ 0 0 55 54,-2.4 -1,-0.3 1,-0.2 55,-0.1 0.265 99.4 110.9 95.1 -11.8 29.8 25.5 -1.0 42 19BA K S < S- 0 0 117 -3,-2.4 -3,-0.3 53,-0.2 -1,-0.2 -0.857 72.8-116.6-102.1 124.8 28.4 25.0 2.5 43 20BA P + 0 0 108 0, 0.0 51,-0.3 0, 0.0 2,-0.2 -0.272 48.5 157.1 -57.1 140.7 24.8 26.0 3.2 44 21BA N E - C 0 93B 12 49,-3.6 49,-1.9 -6,-0.0 2,-0.4 -0.704 41.1-101.5-145.8-167.5 24.6 28.7 5.8 45 22BA I E - C 0 92B 23 47,-0.2 -10,-2.7 -2,-0.2 2,-0.5 -0.995 24.7-150.5-129.4 134.2 22.2 31.5 7.0 46 23BA L E -BC 34 91B 0 45,-2.9 45,-2.0 -2,-0.4 2,-0.3 -0.943 16.1-157.7-109.4 126.9 22.8 35.2 6.0 47 24BA N E -BC 33 90B 0 -14,-3.3 -14,-1.8 -2,-0.5 2,-0.4 -0.752 17.8-167.5-105.5 149.9 21.5 37.7 8.5 48 25BA a E -BC 32 89B 0 41,-2.9 41,-2.6 -2,-0.3 2,-0.6 -0.904 15.4-166.4-134.3 100.1 20.6 41.4 8.1 49 26BA Y E -BC 31 88B 37 -18,-2.5 -18,-1.6 -2,-0.4 2,-0.5 -0.824 3.9-169.7 -94.2 117.3 20.2 42.9 11.6 50 27BA V E +BC 30 87B 0 37,-2.9 37,-2.6 -2,-0.6 2,-0.2 -0.937 16.3 158.1-114.2 123.1 18.5 46.3 11.5 51 28BA T E +B 29 0B 21 -22,-2.1 -22,-2.8 -2,-0.5 35,-0.2 -0.766 40.7 40.9-133.6 175.7 18.4 48.4 14.6 52 29BA Q E S+ 0 0 56 -2,-0.2 2,-0.2 -24,-0.2 34,-0.1 0.619 76.0 137.0 59.2 23.4 18.0 52.0 16.0 53 30BA F E - C 0 85B 0 32,-1.4 32,-2.8 -24,-0.1 -26,-0.2 -0.658 37.1-148.1-104.6 156.6 15.2 53.1 13.7 54 31BA H B S+A 26 0A 6 -28,-1.7 -28,-2.2 -2,-0.2 30,-0.1 -0.863 72.6 46.2-165.1 133.8 12.0 55.0 14.3 55 32BA P S S- 0 0 32 0, 0.0 54,-0.1 0, 0.0 53,-0.1 0.483 84.0-128.7 -60.9 168.2 9.1 55.0 13.2 56 33BA P S S+ 0 0 14 0, 0.0 2,-0.3 0, 0.0 -3,-0.1 0.718 79.3 101.9 -68.5 -22.8 8.6 51.2 13.2 57 34BA H + 0 0 125 2,-0.0 51,-0.4 50,-0.0 2,-0.3 -0.488 49.5 152.7 -65.9 126.5 7.5 51.0 9.6 58 35BA I - 0 0 21 -2,-0.3 2,-0.5 49,-0.1 49,-0.2 -0.990 37.1-141.6-154.8 152.2 10.5 49.7 7.5 59 36BA E E -F 106 0C 87 47,-2.4 47,-2.9 -2,-0.3 2,-0.4 -0.985 19.8-174.4-123.1 125.4 11.1 47.7 4.3 60 37BA I E +F 105 0C 22 -2,-0.5 2,-0.4 45,-0.2 45,-0.2 -0.977 5.1 176.8-125.5 127.8 13.9 45.2 4.1 61 38BA Q E -F 104 0C 72 43,-2.6 43,-3.4 -2,-0.4 2,-0.5 -0.981 18.7-145.8-128.7 140.6 15.1 43.3 1.1 62 39BA M E -F 103 0C 0 7,-0.4 7,-3.0 -2,-0.4 2,-0.4 -0.907 20.0-155.5-106.8 134.2 18.1 40.9 0.7 63 40BA L E -FG 102 68C 4 39,-2.9 39,-2.2 -2,-0.5 2,-0.6 -0.907 15.5-163.6-116.1 138.2 19.9 40.9 -2.6 64 41BA K E > S-FG 101 67C 89 3,-2.7 3,-1.7 -2,-0.4 37,-0.2 -0.953 87.7 -21.8-117.0 109.6 22.0 38.3 -4.4 65 42BA N T 3 S- 0 0 86 35,-3.0 -1,-0.1 -2,-0.6 36,-0.1 0.846 129.8 -50.0 58.4 35.4 24.1 39.8 -7.2 66 43BA G T 3 S+ 0 0 58 1,-0.2 2,-0.4 34,-0.2 -1,-0.3 0.274 116.0 114.0 89.4 -10.3 21.7 42.8 -7.3 67 44BA K E < S-G 64 0C 155 -3,-1.7 -3,-2.7 1,-0.1 -1,-0.2 -0.793 74.1-105.2-101.1 137.1 18.5 40.6 -7.5 68 45BA K E -G 63 0C 129 -2,-0.4 -5,-0.2 -5,-0.2 -1,-0.1 -0.295 27.8-133.7 -58.0 129.6 15.8 40.4 -4.8 69 46BA I - 0 0 31 -7,-3.0 -7,-0.4 1,-0.2 3,-0.2 -0.800 15.7-154.9 -86.6 116.5 16.0 37.1 -2.9 70 47BA P S S+ 0 0 126 0, 0.0 2,-1.5 0, 0.0 -1,-0.2 0.915 78.8 58.2 -62.0 -52.1 12.4 35.9 -2.7 71 48BA K + 0 0 188 21,-0.1 2,-0.5 2,-0.0 21,-0.4 -0.525 67.0 149.2 -91.9 83.8 12.5 33.7 0.4 72 49BA V - 0 0 36 -2,-1.5 2,-0.3 -3,-0.2 19,-0.2 -0.923 32.5-148.9-113.2 126.3 13.6 36.1 3.2 73 50BA E E -D 90 0B 131 17,-3.1 17,-2.6 -2,-0.5 2,-0.4 -0.687 6.0-153.6 -95.9 149.2 12.3 35.5 6.7 74 51BA M E -D 89 0B 84 -2,-0.3 15,-0.2 15,-0.2 3,-0.1 -0.981 9.3-136.7-126.6 128.4 11.7 38.3 9.3 75 52BA S - 0 0 44 13,-3.0 2,-0.0 -2,-0.4 15,-0.0 -0.244 43.2 -86.6 -69.7 168.1 11.8 38.0 13.0 76 53BA D - 0 0 65 1,-0.1 12,-0.4 11,-0.1 2,-0.3 -0.357 53.6-105.0 -69.4 159.4 9.1 39.7 15.0 77 54BA M + 0 0 41 10,-0.1 2,-0.3 -3,-0.1 10,-0.2 -0.659 42.5 172.7 -92.9 148.0 9.9 43.3 15.7 78 55BA S E -E 86 0B 17 8,-2.0 8,-2.2 -2,-0.3 2,-0.3 -0.797 17.8-141.3-136.1 179.1 11.0 44.6 19.2 79 56BA F E -E 85 0B 3 6,-0.3 6,-0.2 -2,-0.3 2,-0.1 -0.985 14.1-132.6-146.1 152.6 12.3 47.8 20.6 80 57BA S > - 0 0 34 4,-2.6 3,-3.1 -2,-0.3 4,-0.0 -0.433 39.0 -80.7-103.2 178.8 14.9 48.7 23.1 81 58BA K T 3 S+ 0 0 160 1,-0.3 140,-0.0 2,-0.1 -1,-0.0 0.740 126.7 55.3 -45.9 -34.9 15.3 50.9 26.2 82 59BA D T 3 S- 0 0 72 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.329 117.0-113.2 -85.8 9.1 16.0 54.0 24.0 83 60BA W S < S+ 0 0 11 -3,-3.1 2,-0.3 1,-0.3 -2,-0.1 0.493 73.9 131.2 78.4 -1.2 12.7 53.4 22.1 84 61BA S - 0 0 0 -30,-0.1 -4,-2.6 1,-0.1 -1,-0.3 -0.678 53.6-123.8 -86.9 144.3 14.2 52.6 18.8 85 62BA F E -CE 53 79B 4 -32,-2.8 -32,-1.4 -2,-0.3 2,-0.3 -0.430 24.1-171.5 -86.5 158.3 13.1 49.4 17.0 86 63BA Y E + E 0 78B 62 -8,-2.2 -8,-2.0 -35,-0.2 2,-0.3 -0.991 6.1 173.8-149.3 150.2 15.1 46.4 15.8 87 64BA I E -C 50 0B 10 -37,-2.6 -37,-2.9 -2,-0.3 2,-0.5 -0.986 23.0-134.2-155.5 151.5 14.5 43.4 13.7 88 65BA L E -C 49 0B 14 -12,-0.4 -13,-3.0 -2,-0.3 2,-0.4 -0.958 16.3-170.5-114.8 125.1 16.4 40.5 12.2 89 66BA A E +CD 48 74B 0 -41,-2.6 -41,-2.9 -2,-0.5 2,-0.3 -0.897 16.0 171.9-109.7 142.2 15.9 39.4 8.5 90 67BA H E -CD 47 73B 42 -17,-2.6 -17,-3.1 -2,-0.4 2,-0.3 -0.998 15.6-175.5-152.8 151.8 17.5 36.2 7.4 91 68BA T E -C 46 0B 8 -45,-2.0 -45,-2.9 -2,-0.3 2,-0.2 -0.968 31.8-108.2-143.9 156.3 17.6 33.9 4.4 92 69BA E E +C 45 0B 160 -21,-0.4 2,-0.3 -2,-0.3 -47,-0.2 -0.596 48.5 157.7 -82.9 150.6 19.3 30.5 3.7 93 70BA F E -C 44 0B 14 -49,-1.9 -49,-3.6 -2,-0.2 -2,-0.0 -0.978 42.1-135.7-167.2 159.5 22.2 30.6 1.3 94 71BA T - 0 0 60 -2,-0.3 -54,-0.1 -51,-0.3 -2,-0.0 -0.895 35.7-138.1-125.7 97.8 25.3 28.8 0.2 95 72BA P - 0 0 0 0, 0.0 -54,-2.4 0, 0.0 2,-0.3 -0.132 19.2-166.1 -56.7 147.1 28.1 31.3 -0.3 96 73BA T - 0 0 58 3,-0.2 -56,-0.0 -56,-0.2 0, 0.0 -0.800 35.6-102.6-128.5 169.8 30.4 31.2 -3.2 97 74BA E S S+ 0 0 121 -2,-0.3 -1,-0.1 1,-0.2 -57,-0.0 0.914 117.3 24.5 -61.6 -40.5 33.7 32.9 -4.0 98 75BA T S S+ 0 0 113 2,-0.1 2,-0.3 -3,-0.0 -1,-0.2 0.551 89.1 108.4-108.4 -5.9 32.2 35.4 -6.3 99 76BA D - 0 0 34 -35,-0.0 2,-0.4 1,-0.0 -3,-0.2 -0.565 54.8-150.7 -73.5 127.7 28.5 35.9 -5.4 100 77BA T - 0 0 68 -2,-0.3 -35,-3.0 -5,-0.1 2,-0.3 -0.785 11.2-167.1-100.1 143.6 27.8 39.3 -3.7 101 78BA Y E +F 64 0C 8 -2,-0.4 17,-2.8 17,-0.3 2,-0.3 -0.930 9.3 172.1-125.5 153.7 25.0 39.7 -1.2 102 79BA A E -FH 63 117C 2 -39,-2.2 -39,-2.9 -2,-0.3 2,-0.4 -0.946 25.6-134.6-152.7 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