==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-JUL-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 22-JUN-11 3SKN . COMPND 2 MOLECULE: RL42 T CELL RECEPTOR, ALPHA CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.GRAS,P.G.WILMANN,C.ZHENJUN,H.HANIM,L.YU CHIH,L.KJER-NIELSE . 1752 8 20 16 4 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 77298.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1072 61.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 57 3.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 576 32.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 3 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 . 234 13.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 101 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 36 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 0.6 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 4 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 RESIDUES PER ALPHA HELIX . 9 0 0 3 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 . 12 19 29 6 15 13 13 1 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 . 2 6 9 4 11 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 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 K 0 0 203 0, 0.0 2,-0.9 0, 0.0 23,-0.0 0.000 360.0 360.0 360.0 162.6 -11.6 42.6 -18.7 2 3 A E + 0 0 69 95,-0.0 23,-1.2 2,-0.0 2,-1.0 -0.797 360.0 27.2 94.6 -98.4 -14.6 44.2 -16.8 3 4 A V E S-A 24 0A 16 -2,-0.9 95,-0.4 21,-0.2 21,-0.2 -0.815 88.4-178.9 -91.3 88.4 -13.1 45.3 -13.5 4 5 A E E +A 23 0A 52 19,-2.2 19,-1.6 -2,-1.0 2,-0.3 -0.542 1.6 178.0 -86.8 158.2 -9.5 45.7 -14.7 5 6 A Q E -A 22 0A 28 17,-0.3 17,-0.2 -2,-0.2 -2,-0.0 -0.949 39.0 -61.4-167.7 138.7 -6.8 46.8 -12.3 6 7 A D - 0 0 42 15,-1.6 14,-0.0 -2,-0.3 16,-0.0 0.249 57.6-131.6 -21.9 132.1 -3.1 47.5 -11.9 7 8 A P + 0 0 109 0, 0.0 94,-0.3 0, 0.0 3,-0.1 0.845 54.5 3.8 -66.3-113.7 -1.1 44.4 -12.7 8 9 A G S S- 0 0 41 1,-0.2 2,-0.2 92,-0.1 93,-0.1 0.490 90.8 -40.8 -72.3-158.4 1.7 42.9 -10.6 9 10 A P - 0 0 80 0, 0.0 2,-0.8 0, 0.0 93,-0.2 -0.484 41.8-144.9 -75.3 129.8 3.5 43.5 -7.3 10 11 A F E -d 102 0B 43 91,-2.9 93,-2.9 -2,-0.2 2,-0.9 -0.846 13.4-170.7 -93.3 106.5 4.4 47.0 -6.1 11 12 A N E +d 103 0B 100 -2,-0.8 93,-0.2 91,-0.2 91,-0.1 -0.822 20.7 168.4 -97.4 101.9 7.7 47.0 -4.2 12 13 A V E -d 104 0B 15 -2,-0.9 93,-2.3 91,-0.6 2,-0.1 -0.870 36.5-103.2-120.9 145.9 7.9 50.4 -2.6 13 14 A P E > -d 105 0B 71 0, 0.0 3,-2.4 0, 0.0 64,-0.2 -0.368 40.8-104.4 -70.1 144.2 10.2 52.0 0.1 14 15 A E T 3 S+ 0 0 53 91,-1.7 90,-0.1 1,-0.3 -2,-0.0 0.600 114.9 40.9 -41.1 -28.2 8.9 52.5 3.6 15 16 A G T 3 S+ 0 0 14 61,-0.1 61,-0.4 492,-0.1 -1,-0.3 0.617 92.6 101.8-101.4 -12.1 8.4 56.3 3.2 16 17 A A < - 0 0 2 -3,-2.4 61,-2.6 60,-0.2 2,-0.4 0.033 64.9-122.8 -73.7 173.9 7.0 56.7 -0.3 17 18 A T - 0 0 10 59,-0.2 2,-0.3 58,-0.2 58,-0.2 -0.953 26.0-156.6-117.9 141.6 3.4 57.2 -1.5 18 19 A V E - B 0 74A 15 56,-2.1 56,-1.3 -2,-0.4 2,-0.5 -0.829 9.1-145.3-120.7 158.8 1.6 54.9 -3.9 19 20 A A E - B 0 73A 14 -2,-0.3 2,-0.4 54,-0.2 54,-0.2 -0.980 9.5-164.2-125.2 120.0 -1.2 55.0 -6.4 20 21 A F E - B 0 72A 0 52,-3.1 52,-2.3 -2,-0.5 2,-0.3 -0.875 11.0-167.6 -99.0 134.7 -3.6 52.2 -7.1 21 22 A N E + B 0 71A 15 -2,-0.4 -15,-1.6 50,-0.2 2,-0.3 -0.887 11.3 174.1-120.1 157.0 -5.7 52.3 -10.3 22 23 A a E -AB 5 70A 1 48,-1.0 48,-2.6 -2,-0.3 2,-0.4 -0.925 14.1-153.4-160.9 129.0 -8.6 50.2 -11.4 23 24 A T E -AB 4 69A 35 -19,-1.6 -19,-2.2 -2,-0.3 2,-0.4 -0.883 4.6-160.6-110.1 141.7 -10.9 50.6 -14.4 24 25 A Y E -A 3 0A 3 44,-1.0 -21,-0.2 -2,-0.4 -2,-0.0 -0.962 7.2-159.2-122.6 141.1 -14.5 49.5 -14.8 25 26 A S + 0 0 61 -23,-1.2 2,-0.9 -2,-0.4 -1,-0.1 0.908 67.8 86.7 -86.1 -46.8 -16.3 49.0 -18.1 26 27 A N > - 0 0 70 1,-0.2 3,-2.1 2,-0.1 -1,-0.1 -0.415 62.6-158.4 -62.4 100.4 -20.0 49.2 -17.2 27 28 A S T 3 S+ 0 0 80 -2,-0.9 -1,-0.2 1,-0.3 41,-0.1 0.749 86.6 60.3 -46.5 -29.6 -20.8 52.9 -17.4 28 29 A A T 3 S+ 0 0 71 63,-0.1 -1,-0.3 -3,-0.0 63,-0.1 0.342 71.2 145.7 -92.9 7.4 -23.8 52.5 -15.1 29 30 A S < - 0 0 1 -3,-2.1 3,-0.1 62,-0.2 -5,-0.0 -0.059 35.3-155.3 -48.1 146.0 -22.0 51.1 -12.1 30 31 A Q + 0 0 94 1,-0.3 2,-0.3 0, 0.0 -1,-0.1 0.897 59.4 3.6 -99.2 -49.1 -23.6 52.2 -8.8 31 32 A S - 0 0 38 19,-0.1 59,-3.5 265,-0.0 2,-0.3 -0.981 57.6-150.6-146.5 154.4 -21.0 52.1 -5.9 32 39 A F E +EF 49 89B 5 17,-0.9 17,-1.6 -2,-0.3 2,-0.3 -0.948 11.6 179.5-133.8 146.3 -17.3 51.4 -5.4 33 40 A F E -EF 48 88B 3 55,-3.0 55,-3.4 -2,-0.3 2,-0.5 -0.988 21.3-144.4-142.1 150.3 -15.1 50.1 -2.7 34 41 A W E -EF 47 87B 0 13,-2.5 12,-2.3 -2,-0.3 13,-1.8 -0.970 22.2-168.8-108.0 133.9 -11.5 49.3 -1.9 35 42 A Y E -EF 45 86B 0 51,-2.0 51,-3.3 -2,-0.5 2,-0.3 -0.975 10.6-145.0-119.9 138.0 -11.0 46.3 0.3 36 43 A R E -EF 44 85B 54 8,-2.9 8,-3.4 -2,-0.4 2,-0.3 -0.785 14.7-172.8 -98.8 146.3 -7.7 45.4 1.9 37 44 A Q E - F 0 84B 15 47,-2.4 47,-2.2 -2,-0.3 2,-0.2 -0.820 13.0-145.6-146.5 105.5 -6.6 41.7 2.3 38 45 A D > - 0 0 44 4,-0.4 3,-2.3 -2,-0.3 2,-0.5 -0.418 46.8 -71.0 -69.9 133.5 -3.6 40.5 4.3 39 46 A S T 3 S+ 0 0 65 1,-0.4 -1,-0.1 -2,-0.2 3,-0.1 -0.544 119.0 6.1 -61.1 117.3 -1.7 37.5 3.0 40 47 A R T 3 S+ 0 0 78 -2,-0.5 -1,-0.4 1,-0.1 2,-0.2 -0.027 112.1 56.3-133.1 102.1 -3.4 35.3 3.6 41 48 A K S < S- 0 0 102 -3,-2.3 262,-0.1 1,-0.1 261,-0.1 -0.677 75.0 -28.1-153.2-158.8 -6.9 36.0 4.9 42 49 A E - 0 0 30 -2,-0.2 -4,-0.4 260,-0.2 2,-0.3 -0.241 56.1-103.8 -76.3 152.6 -10.2 37.8 4.5 43 50 A P - 0 0 2 0, 0.0 257,-0.6 0, 0.0 2,-0.4 -0.578 35.7-165.8 -66.8 127.6 -11.1 41.0 2.6 44 51 A K E -E 36 0B 89 -8,-3.4 -8,-2.9 -2,-0.3 255,-0.1 -0.986 26.3-109.6-118.6 130.6 -11.7 43.9 5.0 45 52 A L E +E 35 0B 62 -2,-0.4 -10,-0.2 253,-0.3 3,-0.1 -0.176 40.2 167.4 -52.9 147.2 -13.3 47.0 3.8 46 53 A L E + 0 0 50 -12,-2.3 2,-0.3 1,-0.4 -11,-0.2 0.610 59.2 5.8-125.9 -52.3 -11.1 50.0 3.6 47 54 A M E -E 34 0B 16 -13,-1.8 -13,-2.5 13,-0.0 2,-0.7 -0.997 49.6-144.3-142.0 138.9 -12.8 52.8 1.6 48 55 A S E -E 33 0B 20 -2,-0.3 2,-0.4 -15,-0.2 -15,-0.3 -0.933 34.1-139.9 -97.4 109.1 -16.2 53.5 0.1 49 56 A V E +E 32 0B 2 -17,-1.6 -17,-0.9 -2,-0.7 2,-0.3 -0.555 26.3 176.8 -76.7 125.9 -15.3 55.4 -3.0 50 57 A Y > - 0 0 37 -2,-0.4 3,-1.3 11,-0.3 13,-0.7 -0.845 40.6-110.7-123.0 164.7 -17.5 58.3 -3.9 51 58 A S T 3 S+ 0 0 72 -2,-0.3 12,-0.4 1,-0.3 3,-0.1 0.894 112.2 62.0 -61.6 -43.4 -17.4 60.9 -6.7 52 59 A S T 3 S- 0 0 110 1,-0.2 -1,-0.3 1429,-0.1 10,-0.0 0.329 113.7-116.9 -68.2 12.1 -16.6 63.9 -4.4 53 60 A G < - 0 0 9 -3,-1.3 9,-0.3 10,-0.1 2,-0.2 0.147 32.1 -95.0 66.7 163.9 -13.4 62.1 -3.5 54 66 A N - 0 0 19 7,-2.5 -5,-0.1 1,-0.1 -7,-0.0 -0.499 24.4-154.3-111.0-174.8 -12.7 60.9 0.0 55 68 A E + 0 0 51 1,-0.2 3,-0.4 -2,-0.2 -1,-0.1 0.661 39.4 99.9-122.5 -93.7 -10.8 62.3 3.0 56 69 A D - 0 0 59 1,-0.2 -1,-0.2 2,-0.1 888,-0.1 -0.182 67.8 -20.8 -60.0 147.0 -9.2 60.4 5.9 57 70 A G S S- 0 0 15 886,-0.1 -1,-0.2 3,-0.1 3,-0.1 -0.181 95.3 -46.6-166.6 90.1 -6.6 59.6 6.6 58 78 A R S S+ 0 0 28 -3,-0.4 17,-2.4 1,-0.1 2,-0.5 -0.082 116.8 86.5 92.4 -22.5 -3.2 58.9 5.0 59 79 A F E -C 74 0A 34 15,-0.2 2,-0.4 -4,-0.1 15,-0.2 -0.942 61.2-176.3-111.2 122.4 -5.5 57.1 2.6 60 80 A T E +C 73 0A 59 13,-2.8 13,-3.6 -2,-0.5 2,-0.3 -0.919 3.8 175.1-115.8 145.0 -7.1 59.0 -0.3 61 81 A A E +C 72 0A 0 -2,-0.4 -7,-2.5 11,-0.2 2,-0.3 -0.993 1.7 169.5-145.7 139.0 -9.6 57.6 -2.9 62 82 A Q E -C 71 0A 35 9,-1.2 9,-2.3 -2,-0.3 2,-0.4 -0.979 19.4-140.6-146.4 163.3 -11.6 59.2 -5.7 63 83 A L E -C 70 0A 8 -13,-0.7 2,-0.6 -12,-0.4 7,-0.2 -0.972 3.6-163.3-126.9 134.4 -13.7 58.3 -8.7 64 84 A N E >> -C 69 0A 50 5,-2.3 4,-1.5 -2,-0.4 5,-1.3 -0.835 6.2-176.6-115.1 93.2 -14.0 59.7 -12.2 65 84AA R T 45S+ 0 0 103 -2,-0.6 -1,-0.1 1,-0.2 -36,-0.1 0.769 81.0 62.0 -59.8 -26.3 -17.2 58.4 -13.7 66 84BA A T 45S+ 0 0 87 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.983 117.4 24.1 -61.6 -61.4 -16.3 60.2 -16.9 67 84CA S T 45S- 0 0 46 -3,-0.1 -1,-0.2 2,-0.1 -2,-0.2 0.501 109.2-123.9 -83.5 -4.3 -13.1 58.2 -17.6 68 85 A Q T <5 + 0 0 42 -4,-1.5 -44,-1.0 1,-0.2 2,-0.3 0.989 58.7 146.4 53.0 68.8 -14.5 55.4 -15.5 69 86 A Y E < -BC 23 64A 27 -5,-1.3 -5,-2.3 -46,-0.2 2,-0.4 -0.977 36.6-161.7-134.0 144.9 -11.5 55.2 -13.1 70 87 A I E -BC 22 63A 0 -48,-2.6 -48,-1.0 -2,-0.3 2,-0.3 -0.993 17.4-172.9-127.7 124.5 -11.1 54.3 -9.5 71 88 A S E -BC 21 62A 3 -9,-2.3 -9,-1.2 -2,-0.4 2,-0.4 -0.881 10.7-166.2-121.5 150.5 -7.9 55.4 -7.7 72 89 A L E -BC 20 61A 0 -52,-2.3 -52,-3.1 -2,-0.3 2,-0.5 -0.999 5.6-164.5-133.1 137.1 -6.4 54.8 -4.2 73 90 A L E -BC 19 60A 18 -13,-3.6 -13,-2.8 -2,-0.4 2,-0.6 -0.973 10.1-173.5-126.3 125.5 -3.6 56.6 -2.5 74 91 A I E -BC 18 59A 0 -56,-1.3 -56,-2.1 -2,-0.5 3,-0.3 -0.951 15.9-166.5-107.8 109.2 -1.5 55.6 0.5 75 92 A R + 0 0 51 -17,-2.4 -58,-0.2 -2,-0.6 -59,-0.1 -0.585 67.5 19.3 -83.9 156.6 0.8 58.4 1.5 76 93 A D S S- 0 0 6 -61,-0.4 -1,-0.2 -2,-0.2 -60,-0.2 0.917 91.2-139.5 52.1 61.3 3.7 57.8 3.9 77 94 A S - 0 0 8 -61,-2.6 2,-0.3 -3,-0.3 3,-0.1 0.127 19.4-166.0 -46.5 158.1 3.8 54.0 3.6 78 95 A K > - 0 0 59 1,-0.1 3,-0.8 28,-0.0 26,-0.2 -0.895 35.0-116.6-134.0 164.9 4.3 51.6 6.5 79 96 A L G > S+ 0 0 42 -2,-0.3 3,-2.9 1,-0.2 25,-0.3 0.869 114.3 71.5 -65.7 -37.8 5.2 47.9 6.5 80 97 A S G 3 S+ 0 0 68 1,-0.3 -1,-0.2 -3,-0.1 -3,-0.0 0.729 88.0 67.8 -42.9 -24.8 1.8 47.5 8.1 81 98 A D G < + 0 0 1 -3,-0.8 -1,-0.3 2,-0.0 21,-0.2 0.551 66.8 115.9 -85.7 -9.4 0.5 48.3 4.7 82 99 A S < + 0 0 44 -3,-2.9 2,-0.3 22,-0.1 21,-0.2 -0.439 46.1 94.8 -61.9 132.1 1.8 45.2 2.9 83 100 A A E S- G 0 102B 7 19,-1.5 19,-3.0 -2,-0.1 2,-0.4 -0.929 77.9 -72.4 165.8 179.0 -1.3 43.3 1.7 84 101 A T E -FG 37 101B 40 -47,-2.2 -47,-2.4 -2,-0.3 2,-0.5 -0.853 39.9-149.0-104.8 138.4 -3.4 42.9 -1.4 85 102 A Y E -FG 36 100B 1 15,-2.4 15,-2.2 -2,-0.4 2,-0.5 -0.928 10.2-155.2-116.1 128.2 -5.8 45.7 -2.4 86 103 A L E -F 35 0B 8 -51,-3.3 -51,-2.0 -2,-0.5 2,-0.6 -0.869 11.3-146.0-114.0 129.2 -9.1 45.0 -4.2 87 104 A a E -F 34 0B 0 -2,-0.5 10,-1.9 -53,-0.2 2,-0.5 -0.806 22.4-169.5 -86.1 118.6 -11.2 47.2 -6.4 88 105 A V E -FH 33 96B 0 -55,-3.4 -55,-3.0 -2,-0.6 2,-0.5 -0.957 4.3-175.0-115.7 119.8 -14.8 46.4 -5.8 89 106 A V E -FH 32 95B 0 6,-2.1 6,-4.0 -2,-0.5 -57,-0.2 -0.943 9.8-163.2-117.7 129.6 -17.4 47.8 -8.2 90 107 A R > + 0 0 27 -59,-3.5 3,-0.5 -2,-0.5 5,-0.5 0.839 29.3 146.6 -73.4-102.9 -21.2 47.3 -7.7 91 108 A A T 3 S- 0 0 15 1,-0.2 2,-0.8 -63,-0.1 -62,-0.2 0.993 91.7 -26.6 60.2 63.7 -23.1 48.1 -10.8 92 109 A G T 3 S+ 0 0 42 1,-0.1 -1,-0.2 -64,-0.1 -2,-0.1 -0.682 147.1 5.9 105.5 -74.6 -25.9 45.5 -10.3 93 110 A K S < S- 0 0 73 -2,-0.8 -1,-0.1 -3,-0.5 -2,-0.1 0.276 104.3-104.9-128.7 8.7 -24.5 42.8 -8.2 94 111 A L - 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