==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 31-JUL-10 2XN9 . COMPND 2 MOLECULE: T CELL RECEPTOR ALPHA CHAIN C REGION; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.SALINE,K.E.J.RODSTROM,G.FISCHER,V.Y.OREKHOV,B.G.KARLSSON, . 1035 6 9 8 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 47850.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 678 65.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 2.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 351 33.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 0.7 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 . 2 0.2 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 . 98 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 84 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 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 5 0 0 3 2 0 0 0 1 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 0 0 4 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 11 15 6 6 10 3 4 1 2 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 3 3 4 2 1 1 0 0 1 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 2 A Q 0 0 98 0, 0.0 2,-0.5 0, 0.0 89,-0.1 0.000 360.0 360.0 360.0 114.5 17.1 -38.8 -19.9 2 3 A L - 0 0 66 96,-0.0 23,-0.5 2,-0.0 2,-0.5 -0.961 360.0-164.3-120.8 125.2 20.2 -39.5 -17.9 3 4 A L - 0 0 15 -2,-0.5 2,-0.5 96,-0.3 98,-0.2 -0.905 7.7-161.9-101.8 130.9 23.2 -37.2 -17.4 4 5 A E E -A 23 0A 149 19,-3.7 19,-3.4 -2,-0.5 2,-0.4 -0.954 2.9-156.5-113.8 130.5 26.4 -38.7 -16.0 5 6 A Q E -A 22 0A 21 -2,-0.5 17,-0.2 17,-0.2 96,-0.0 -0.862 17.1-128.0-105.7 140.4 29.1 -36.5 -14.6 6 7 A S E S+A 21 0A 67 15,-2.4 15,-3.2 -2,-0.4 2,-0.1 -0.993 77.0 22.0-137.4 132.8 32.7 -37.6 -14.4 7 8 A P - 0 0 46 0, 0.0 14,-0.1 0, 0.0 -1,-0.1 0.757 63.2-153.9 -82.7 171.2 34.7 -37.6 -12.0 8 9 A Q S S+ 0 0 146 1,-0.2 96,-2.8 95,-0.2 2,-0.3 0.859 82.5 15.0 -73.9 -39.5 32.6 -37.6 -8.8 9 10 A F E -e 104 0B 136 94,-0.2 2,-0.3 2,-0.0 -1,-0.2 -0.966 65.0-172.6-133.5 148.3 35.4 -36.0 -6.7 10 11 A L E -e 105 0B 45 94,-2.3 96,-3.0 -2,-0.3 2,-0.5 -0.949 3.3-171.3-146.0 127.9 38.6 -34.1 -7.7 11 12 A S E +e 106 0B 76 -2,-0.3 2,-0.3 94,-0.2 96,-0.2 -0.967 22.4 164.7-117.3 126.2 41.4 -32.9 -5.4 12 13 A I E -e 107 0B 22 94,-2.5 96,-3.0 -2,-0.5 2,-0.3 -0.985 35.9-113.0-149.7 151.6 44.0 -30.8 -7.0 13 14 A Q E > -e 108 0B 40 -2,-0.3 3,-1.7 94,-0.2 65,-0.2 -0.659 45.4 -95.8 -88.0 141.9 46.8 -28.4 -6.3 14 15 A E T 3 S+ 0 0 55 94,-2.5 65,-0.2 -2,-0.3 -1,-0.1 -0.250 109.9 38.0 -48.5 134.6 46.6 -24.7 -7.2 15 16 A G T 3 S+ 0 0 47 63,-2.4 62,-0.4 1,-0.4 -1,-0.2 0.062 90.7 116.4 102.4 -19.5 48.2 -23.9 -10.6 16 17 A E < - 0 0 102 -3,-1.7 62,-2.9 62,-0.2 -1,-0.4 -0.533 61.5-130.0 -83.8 151.3 47.1 -27.1 -12.3 17 18 A N + 0 0 94 60,-0.2 2,-0.3 -2,-0.2 59,-0.2 -0.747 31.8 178.9 -89.0 144.5 44.7 -27.4 -15.3 18 19 A L E - B 0 75A 11 57,-2.0 57,-2.6 -2,-0.3 2,-0.4 -0.941 18.0-150.6-143.4 160.2 41.8 -29.9 -14.9 19 20 A T E - B 0 74A 45 -2,-0.3 2,-0.3 55,-0.2 55,-0.2 -0.998 7.7-168.2-132.7 137.6 38.8 -31.1 -17.0 20 21 A V E - B 0 73A 2 53,-2.6 53,-2.3 -2,-0.4 2,-0.3 -0.882 14.8-142.2-121.5 159.9 35.4 -32.3 -15.8 21 22 A Y E -AB 6 72A 106 -15,-3.2 -15,-2.4 -2,-0.3 2,-0.4 -0.914 17.2-166.6-133.1 148.3 32.8 -34.1 -18.0 22 23 A a E -AB 5 71A 0 49,-2.4 49,-2.7 -2,-0.3 2,-0.3 -0.994 24.5-178.0-131.3 122.4 29.1 -34.4 -18.5 23 24 A N E +AB 4 70A 69 -19,-3.4 -19,-3.7 -2,-0.4 2,-0.3 -0.927 11.5 168.5-128.9 148.6 27.8 -37.3 -20.6 24 25 A S - 0 0 17 45,-2.1 -21,-0.1 -2,-0.3 4,-0.1 -0.956 35.3-142.1-146.0 161.8 24.6 -38.6 -22.0 25 26 A S S S+ 0 0 107 -23,-0.5 2,-0.2 -2,-0.3 -1,-0.1 0.677 89.4 74.4 -91.6 -24.0 23.3 -41.2 -24.5 26 27 A S S S- 0 0 47 -24,-0.3 2,-0.3 43,-0.1 -2,-0.1 -0.476 90.3-110.5 -84.4 156.3 20.5 -38.8 -25.4 27 28 A V - 0 0 36 -2,-0.2 2,-0.4 42,-0.0 42,-0.2 -0.663 30.3-153.3 -83.2 137.9 20.9 -35.7 -27.5 28 29 A F - 0 0 5 40,-2.4 3,-0.1 -2,-0.3 42,-0.1 -0.894 15.0-158.9-109.1 147.6 20.5 -32.3 -25.6 29 30 A S S S+ 0 0 13 1,-0.4 2,-0.4 -2,-0.4 -1,-0.1 0.833 85.5 14.3 -88.4 -40.3 19.4 -29.1 -27.2 30 31 A S - 0 0 4 38,-0.1 61,-2.2 269,-0.0 2,-0.4 -0.994 68.3-167.9-133.1 145.9 20.9 -26.9 -24.5 31 32 A L E -FG 48 90B 2 17,-2.8 17,-2.9 -2,-0.4 2,-0.3 -0.993 7.9-163.9-135.1 141.2 23.4 -27.9 -21.8 32 33 A Q E -FG 47 89B 2 57,-3.7 57,-2.7 -2,-0.4 2,-0.4 -0.902 13.1-150.3-126.7 151.6 24.3 -25.9 -18.7 33 34 A W E -FG 46 88B 0 13,-2.1 12,-3.0 -2,-0.3 13,-1.1 -0.984 17.3-176.7-118.3 134.7 27.0 -25.7 -16.0 34 35 A Y E -FG 44 87B 0 53,-3.4 53,-2.9 -2,-0.4 2,-0.4 -0.918 14.4-147.6-120.8 150.9 26.3 -24.4 -12.5 35 36 A R E -FG 43 86B 51 8,-2.6 8,-2.6 -2,-0.3 2,-0.4 -0.952 16.2-166.3-114.8 138.7 28.7 -23.9 -9.5 36 37 A Q E - G 0 85B 8 49,-2.4 49,-2.4 -2,-0.4 5,-0.1 -0.987 13.5-152.7-130.8 129.4 27.5 -24.4 -5.9 37 38 A E > - 0 0 74 -2,-0.4 3,-1.5 4,-0.3 47,-0.1 -0.655 52.7 -77.6 -84.2 153.2 29.0 -23.4 -2.5 38 39 A P T 3 S+ 0 0 98 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.230 114.1 2.7 -59.4 135.5 27.9 -25.7 0.3 39 40 A G T 3 S+ 0 0 43 1,-0.2 2,-0.3 -3,-0.1 269,-0.1 0.786 114.1 100.2 62.0 28.8 24.4 -25.0 1.7 40 41 A E S < S- 0 0 110 -3,-1.5 -1,-0.2 267,-0.0 266,-0.1 -0.834 80.3 -84.9-131.6 175.1 23.8 -22.3 -1.0 41 42 A G - 0 0 14 -2,-0.3 -4,-0.3 262,-0.2 -6,-0.1 -0.619 46.8-109.0 -81.3 135.7 22.0 -22.0 -4.3 42 43 A P - 0 0 4 0, 0.0 261,-0.6 0, 0.0 2,-0.4 -0.322 30.2-144.4 -59.0 147.4 23.8 -23.0 -7.5 43 44 A V E -F 35 0B 94 -8,-2.6 -8,-2.6 259,-0.1 2,-0.2 -0.972 18.8-112.7-117.1 130.9 24.8 -20.2 -9.8 44 45 A L E +F 34 0B 32 -2,-0.4 -10,-0.3 257,-0.3 3,-0.1 -0.410 29.9 179.2 -58.9 130.5 24.7 -20.5 -13.5 45 46 A L E - 0 0 54 -12,-3.0 2,-0.3 1,-0.4 -11,-0.2 0.828 62.3 -28.8 -93.5 -47.5 28.1 -20.4 -15.2 46 47 A V E -F 33 0B 12 -13,-1.1 -13,-2.1 2,-0.0 -1,-0.4 -0.973 45.6-140.6-166.5 156.8 27.2 -20.8 -18.9 47 48 A T E -F 32 0B 28 -2,-0.3 2,-0.4 -15,-0.2 -15,-0.2 -0.996 16.0-163.2-129.3 131.3 24.6 -22.3 -21.3 48 49 A V E +F 31 0B 0 -17,-2.9 -17,-2.8 -2,-0.4 3,-0.1 -0.933 14.5 170.0-115.9 140.8 25.7 -23.9 -24.6 49 50 A V + 0 0 17 -2,-0.4 2,-0.4 -19,-0.2 -1,-0.1 0.361 55.4 61.7-136.0 0.4 23.1 -24.6 -27.3 50 51 A T S > S- 0 0 6 413,-0.0 3,-1.9 471,-0.0 14,-0.2 -0.995 85.9-103.7-135.6 137.4 25.0 -25.6 -30.5 51 52 A G T 3 S+ 0 0 0 -2,-0.4 472,-0.8 1,-0.3 471,-0.6 -0.350 107.6 19.4 -61.3 140.6 27.2 -28.7 -31.1 52 53 A G T 3 S+ 0 0 11 12,-2.1 -1,-0.3 13,-0.4 14,-0.2 0.389 86.8 153.4 79.4 -2.7 30.9 -27.9 -31.1 53 54 A E < - 0 0 12 -3,-1.9 11,-2.6 12,-0.2 2,-0.4 -0.424 25.6-166.0 -59.4 125.3 30.3 -24.5 -29.3 54 55 A V E -C 63 0A 25 9,-0.2 2,-0.4 -2,-0.1 9,-0.2 -0.988 5.7-175.4-111.4 126.7 33.3 -23.4 -27.2 55 56 A K E -C 62 0A 44 7,-2.5 7,-3.1 -2,-0.4 2,-0.5 -0.977 7.6-159.6-122.2 142.1 32.7 -20.6 -24.7 56 57 A K E +C 61 0A 117 -2,-0.4 2,-0.5 5,-0.2 5,-0.2 -0.982 12.6 176.7-129.3 115.0 35.6 -19.1 -22.7 57 58 A L E > -C 60 0A 83 3,-2.9 3,-2.1 -2,-0.5 2,-0.2 -0.869 63.7 -70.3-123.3 95.7 34.9 -17.2 -19.5 58 59 A K T 3 S- 0 0 211 -2,-0.5 -1,-0.1 1,-0.3 18,-0.0 -0.375 120.8 -3.2 54.3-116.1 38.3 -16.1 -18.0 59 60 A R T 3 S+ 0 0 62 -2,-0.2 17,-2.2 -3,-0.1 2,-0.4 0.649 121.3 87.6 -81.6 -9.9 40.1 -19.3 -16.8 60 61 A L E < -CD 57 75A 22 -3,-2.1 -3,-2.9 15,-0.2 2,-0.4 -0.726 53.9-171.2 -97.6 137.1 37.1 -21.5 -17.7 61 62 A T E -CD 56 74A 30 13,-2.5 13,-3.2 -2,-0.4 2,-0.4 -0.993 5.2-168.9-128.0 118.6 36.5 -23.1 -21.0 62 63 A F E -CD 55 73A 2 -7,-3.1 -7,-2.5 -2,-0.4 2,-0.4 -0.894 4.6-171.6-109.1 137.2 33.2 -24.9 -21.8 63 64 A Q E -CD 54 72A 85 9,-2.2 9,-1.8 -2,-0.4 2,-0.5 -0.997 16.9-146.7-134.3 137.0 32.6 -27.1 -24.8 64 65 A F E - D 0 71A 0 -11,-2.6 -12,-2.1 -2,-0.4 7,-0.2 -0.911 35.7-111.5 -96.8 119.3 29.5 -28.7 -26.3 65 66 A G > - 0 0 4 5,-3.3 3,-2.0 -2,-0.5 -13,-0.4 -0.171 25.7-116.4 -45.0 142.7 30.2 -32.1 -28.0 66 67 A D T 3 S+ 0 0 73 -15,-0.3 -15,-0.2 1,-0.3 -1,-0.1 0.788 116.2 45.3 -56.4 -30.8 29.8 -32.0 -31.8 67 68 A A T 3 S- 0 0 41 561,-0.1 -1,-0.3 -16,-0.0 -2,-0.1 0.057 114.2-114.2-106.7 21.1 27.0 -34.5 -31.6 68 69 A R S < S+ 0 0 0 -3,-2.0 -40,-2.4 2,-0.1 -2,-0.1 0.652 87.6 109.2 63.9 19.4 25.2 -32.8 -28.7 69 70 A K S S+ 0 0 78 -42,-0.2 -45,-2.1 1,-0.1 2,-0.3 0.531 75.7 17.9-104.9 -9.2 25.9 -35.8 -26.3 70 71 A D E -B 23 0A 60 -47,-0.2 -5,-3.3 -42,-0.1 2,-0.3 -0.985 54.2-154.7-156.1 162.7 28.5 -34.4 -23.9 71 72 A S E -BD 22 64A 1 -49,-2.7 -49,-2.4 -2,-0.3 2,-0.4 -0.996 8.3-151.4-140.9 148.7 30.1 -31.3 -22.5 72 73 A S E -BD 21 63A 22 -9,-1.8 -9,-2.2 -2,-0.3 2,-0.5 -0.923 3.0-157.6-116.2 150.1 33.4 -30.5 -20.9 73 74 A L E -BD 20 62A 0 -53,-2.3 -53,-2.6 -2,-0.4 2,-0.4 -0.986 16.3-169.7-120.0 117.0 34.4 -27.9 -18.3 74 75 A H E -BD 19 61A 56 -13,-3.2 -13,-2.5 -2,-0.5 2,-0.5 -0.916 6.0-160.9-110.1 131.3 38.2 -27.0 -18.4 75 76 A I E -BD 18 60A 0 -57,-2.6 -57,-2.0 -2,-0.4 3,-0.4 -0.969 6.0-154.1-111.6 124.5 39.9 -24.9 -15.7 76 77 A T S S- 0 0 61 -17,-2.2 -59,-0.2 -2,-0.5 -60,-0.1 -0.773 77.3 -3.8 -89.9 137.2 43.3 -23.3 -16.5 77 78 A A S S- 0 0 36 -62,-0.4 -1,-0.2 -2,-0.4 -60,-0.2 0.907 91.3-138.1 46.0 61.5 45.6 -22.5 -13.5 78 79 A A - 0 0 0 -62,-2.9 -63,-2.4 -3,-0.4 -62,-0.2 -0.130 19.8-160.2 -47.7 143.0 43.0 -23.7 -10.9 79 80 A Q > - 0 0 89 -65,-0.2 3,-2.3 -64,-0.1 4,-0.2 -0.870 31.1-108.4-128.0 156.8 42.7 -21.5 -7.8 80 81 A P G > S+ 0 0 28 0, 0.0 3,-2.1 0, 0.0 27,-0.4 0.850 116.8 62.8 -57.3 -38.5 41.3 -22.3 -4.3 81 82 A G G 3 S+ 0 0 57 1,-0.3 -3,-0.0 -3,-0.0 0, 0.0 0.590 88.4 71.2 -58.6 -13.8 38.3 -20.1 -5.0 82 83 A D G < S+ 0 0 16 -3,-2.3 -1,-0.3 2,-0.0 23,-0.1 0.565 74.0 120.6 -77.3 -7.0 37.4 -22.5 -7.8 83 84 A T < + 0 0 51 -3,-2.1 2,-0.3 -4,-0.2 23,-0.2 -0.345 42.7 81.5 -60.2 131.8 36.5 -25.0 -5.0 84 85 A G E S- H 0 105B 10 21,-2.5 21,-3.3 -47,-0.1 2,-0.6 -0.956 81.1 -55.9 160.8-174.6 32.9 -26.1 -5.1 85 86 A L E -GH 36 104B 33 -49,-2.4 -49,-2.4 -2,-0.3 2,-0.6 -0.881 41.3-153.3-100.4 126.0 30.3 -28.5 -6.7 86 87 A Y E -GH 35 103B 4 17,-3.0 17,-2.3 -2,-0.6 2,-0.5 -0.877 13.7-168.1-101.4 112.9 30.0 -28.3 -10.4 87 88 A L E -G 34 0B 0 -53,-2.9 -53,-3.4 -2,-0.6 2,-0.4 -0.908 8.9-154.1-108.5 125.8 26.6 -29.3 -11.7 88 89 A a E -G 33 0B 0 -2,-0.5 12,-3.0 -55,-0.2 2,-0.4 -0.824 13.9-171.0 -87.2 137.5 25.7 -30.1 -15.3 89 90 A A E -GI 32 99B 0 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