==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER RECEPTOR 13-FEB-97 1AC6 . COMPND 2 MOLECULE: T-CELL RECEPTOR ALPHA; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR H.-M.LI,R.A.MARIUZZA . 220 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10760.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 143 65.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 11 5.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 91 41.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 . 21 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 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 . 0 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 1 4 6 1 1 2 0 0 0 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 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 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 1 A D 0 0 89 0, 0.0 2,-0.3 0, 0.0 25,-0.2 0.000 360.0 360.0 360.0 151.3 39.2 29.7 -1.5 2 2 A S E -A 25 0A 59 23,-1.9 23,-1.8 97,-0.1 2,-0.4 -0.998 360.0-150.2-155.1 154.4 40.5 26.7 0.4 3 3 A V E -A 24 0A 17 97,-0.4 2,-0.4 -2,-0.3 21,-0.2 -0.970 11.2-177.0-125.0 139.5 41.0 25.0 3.8 4 4 A T E +A 23 0A 103 19,-2.1 19,-2.4 -2,-0.4 2,-0.2 -0.960 13.8 167.0-138.4 118.5 43.9 22.6 4.8 5 5 A Q E -A 22 0A 16 -2,-0.4 2,-0.3 17,-0.2 17,-0.2 -0.727 51.1 -60.1-125.7 173.2 44.0 21.0 8.2 6 6 A T - 0 0 39 15,-1.6 2,-0.1 -2,-0.2 -1,-0.1 -0.389 64.3-141.6 -53.0 110.4 45.8 18.2 10.0 7 7 A E + 0 0 166 -2,-0.3 2,-0.4 97,-0.1 97,-0.1 -0.363 55.3 4.0 -81.4 159.2 44.8 15.2 7.9 8 8 A G S S- 0 0 50 95,-0.5 97,-2.7 -2,-0.1 2,-0.3 -0.559 105.0 -17.2 83.4-125.6 44.1 11.8 9.2 9 9 A Q E -d 105 0B 121 -2,-0.4 2,-0.4 95,-0.2 97,-0.2 -0.873 34.0-167.4-128.5 154.5 44.0 11.1 12.9 10 10 A V E -d 106 0B 30 95,-2.1 97,-2.1 -2,-0.3 2,-0.6 -0.977 17.4-163.9-139.3 109.8 45.1 12.5 16.2 11 11 A A E +d 107 0B 65 -2,-0.4 2,-0.2 95,-0.2 97,-0.2 -0.919 16.8 167.8-105.9 112.6 44.8 10.1 19.2 12 12 A L E -d 108 0B 27 95,-1.8 97,-1.7 -2,-0.6 2,-0.2 -0.675 29.3-125.1-115.4 173.1 45.0 11.6 22.7 13 13 A S E > -d 109 0B 48 95,-0.3 3,-1.7 -2,-0.2 66,-0.2 -0.694 48.4 -76.0-111.2 163.2 44.3 10.4 26.2 14 14 A E T 3 S+ 0 0 71 95,-1.8 66,-0.3 -2,-0.2 -1,-0.2 -0.233 119.7 24.4 -57.6 151.5 41.9 12.2 28.6 15 15 A E T 3 S+ 0 0 147 64,-2.6 -1,-0.2 1,-0.2 65,-0.1 0.344 95.0 135.1 72.7 -6.1 43.3 15.4 30.2 16 16 A D E < -I 79 0C 62 -3,-1.7 63,-3.1 63,-0.5 2,-0.5 -0.183 60.9-108.1 -69.7 166.5 45.6 15.8 27.2 17 17 A F E - 0 0 118 61,-0.2 2,-0.4 -3,-0.1 60,-0.2 -0.836 32.6-148.4 -98.9 128.7 46.2 19.1 25.3 18 18 A L E +I 76 0C 0 58,-3.4 58,-1.6 -2,-0.5 2,-0.3 -0.782 21.4 170.7-104.4 140.6 44.7 19.3 21.9 19 19 A T E -I 75 0C 45 -2,-0.4 2,-0.5 56,-0.2 56,-0.2 -0.916 4.7-180.0-145.3 112.5 46.0 21.2 18.9 20 20 A I E -I 74 0C 0 54,-2.4 54,-2.6 -2,-0.3 2,-0.2 -0.985 22.7-135.4-116.0 126.9 44.5 20.8 15.4 21 21 A H + 0 0 86 -2,-0.5 -15,-1.6 52,-0.2 2,-0.3 -0.539 25.9 170.2 -87.3 150.9 46.0 22.8 12.6 22 22 A a E +A 5 0A 0 -17,-0.2 50,-2.7 -2,-0.2 2,-0.3 -0.923 5.1 177.7-158.0 125.6 44.2 24.8 9.9 23 23 A N E -AB 4 71A 67 -19,-2.4 -19,-2.1 -2,-0.3 2,-0.3 -0.920 15.7-166.6-124.1 154.9 45.5 27.2 7.3 24 24 A Y E -A 3 0A 18 46,-2.6 2,-0.3 -2,-0.3 -21,-0.2 -0.851 20.5-148.2-139.6 174.1 43.4 28.9 4.6 25 25 A S E +A 2 0A 72 -23,-1.8 -23,-1.9 -2,-0.3 2,-0.3 -0.863 35.8 136.6-148.6 111.7 43.3 30.9 1.4 26 26 A A - 0 0 25 -2,-0.3 2,-0.2 -25,-0.2 -2,-0.1 -0.982 42.2-128.8-151.8 151.5 40.6 33.3 0.6 27 27 A S S S+ 0 0 104 -2,-0.3 67,-0.5 2,-0.1 2,-0.2 -0.651 77.7 24.5 -97.0 163.4 40.4 36.8 -0.8 28 28 A G S S- 0 0 69 -2,-0.2 -2,-0.1 1,-0.1 65,-0.0 -0.564 114.8 -52.9 83.5-150.9 38.4 39.5 1.0 29 29 A Y - 0 0 140 -2,-0.2 -1,-0.1 65,-0.0 -2,-0.1 -0.694 67.5-166.4-129.1 75.5 37.9 39.3 4.8 30 30 A P - 0 0 6 0, 0.0 2,-0.3 0, 0.0 63,-0.2 -0.061 20.2-120.6 -62.1 158.3 36.4 35.8 5.4 31 31 A A E -E 92 0B 6 61,-2.5 61,-1.7 176,-0.0 2,-0.4 -0.692 28.3-142.9 -93.1 153.8 34.7 34.5 8.6 32 32 A L E +EF 91 49B 1 17,-2.5 17,-2.4 -2,-0.3 59,-0.2 -0.966 21.4 179.3-123.5 139.3 36.4 31.4 10.1 33 33 A F E -EF 90 48B 0 57,-2.5 57,-1.5 -2,-0.4 2,-0.3 -0.767 23.4-150.8-129.4 175.4 34.6 28.5 11.8 34 34 A W E -EF 89 47B 0 13,-1.2 12,-2.3 -2,-0.2 13,-1.4 -0.953 19.9-172.8-148.3 126.9 35.1 25.1 13.5 35 35 A Y E -EF 88 45B 0 53,-1.9 53,-2.0 -2,-0.3 2,-0.4 -0.955 11.6-143.8-123.5 150.5 32.3 22.5 13.3 36 36 A V E -EF 87 44B 0 8,-3.1 8,-2.8 -2,-0.3 2,-0.4 -0.896 6.8-165.0-115.8 146.0 32.1 19.1 15.1 37 37 A Q E -E 86 0B 25 49,-2.1 49,-1.4 -2,-0.4 3,-0.1 -0.782 9.9-165.5-134.6 90.6 30.7 15.9 13.7 38 38 A Y > - 0 0 42 -2,-0.4 3,-1.5 4,-0.3 47,-0.1 -0.397 46.2 -71.6 -68.1 152.4 30.0 13.3 16.4 39 39 A P T 3 S+ 0 0 114 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.139 119.7 13.8 -54.1 123.5 29.5 9.7 15.2 40 40 A G T 3 S+ 0 0 79 1,-0.3 2,-0.2 -3,-0.1 -2,-0.1 0.636 112.7 85.1 88.1 18.8 26.1 9.3 13.5 41 41 A E S < S- 0 0 78 -3,-1.5 -1,-0.3 171,-0.0 172,-0.1 -0.781 75.4-102.8-137.8-179.9 25.4 13.0 13.0 42 42 A G - 0 0 7 169,-0.4 -4,-0.3 -2,-0.2 171,-0.1 -0.516 57.8 -69.7 -99.7 169.7 26.0 15.8 10.6 43 43 A P - 0 0 2 0, 0.0 168,-0.7 0, 0.0 2,-0.4 -0.342 53.3-159.8 -59.9 139.9 28.5 18.7 11.2 44 44 A Q E -F 36 0B 62 -8,-2.8 -8,-3.1 166,-0.1 2,-0.1 -0.980 25.2 -97.5-129.0 140.0 27.4 21.0 14.0 45 45 A F E +F 35 0B 42 -2,-0.4 -10,-0.2 164,-0.4 3,-0.1 -0.300 38.9 171.6 -54.0 124.7 28.5 24.6 14.7 46 46 A L E - 0 0 4 -12,-2.3 2,-0.3 1,-0.4 -11,-0.2 0.876 58.2 -43.3-100.8 -57.6 31.2 24.9 17.3 47 47 A F E -F 34 0B 8 -13,-1.4 -13,-1.2 9,-0.1 -1,-0.4 -0.974 45.7-137.9-165.9 169.6 32.2 28.6 17.1 48 48 A R E -F 33 0B 80 -2,-0.3 2,-0.4 -15,-0.2 9,-0.2 -0.964 3.3-163.9-137.9 148.5 33.1 31.5 14.7 49 49 A A E +F 32 0B 0 -17,-2.4 -17,-2.5 -2,-0.3 4,-0.0 -0.996 8.9 178.0-131.1 123.5 35.7 34.3 14.6 50 50 A S + 0 0 38 -2,-0.4 2,-0.3 -19,-0.2 -1,-0.1 0.704 59.5 53.8-100.8 -23.7 34.9 37.2 12.2 51 51 A R S > S- 0 0 175 -19,-0.1 3,-2.1 1,-0.0 14,-0.3 -0.794 92.4 -91.6-116.5 154.2 37.9 39.5 12.8 52 52 A D T 3 S+ 0 0 44 -2,-0.3 14,-0.2 1,-0.3 3,-0.1 -0.479 115.8 13.5 -61.9 125.6 41.7 39.2 12.6 53 53 A K T 3 S+ 0 0 126 12,-3.1 2,-0.3 1,-0.3 -1,-0.3 0.275 92.0 136.4 86.1 -3.0 42.9 38.3 16.1 54 54 A E < - 0 0 68 -3,-2.1 11,-2.5 10,-0.1 2,-0.7 -0.567 47.1-144.6 -75.8 132.1 39.4 37.4 17.3 55 55 A K E -J 64 0C 110 -2,-0.3 9,-0.3 9,-0.2 2,-0.1 -0.853 10.7-158.4-103.2 105.7 39.5 34.2 19.4 56 56 A G E +J 63 0C 5 7,-2.0 7,-2.1 -2,-0.7 2,-0.3 -0.401 17.7 174.8 -76.0 155.9 36.4 32.0 19.0 57 57 A S E +J 62 0C 69 5,-0.3 2,-0.3 -9,-0.2 5,-0.3 -0.960 14.6 159.3-165.0 143.1 35.6 29.5 21.7 58 58 A S E > S+J 61 0C 44 3,-2.0 3,-2.0 -2,-0.3 -11,-0.1 -0.877 70.6 3.7-165.7 136.0 33.0 27.0 22.8 59 59 A R T 3 S- 0 0 115 1,-0.3 3,-0.1 -2,-0.3 -13,-0.0 0.740 132.9 -51.2 59.4 30.1 32.9 24.0 25.1 60 60 A G T 3 S+ 0 0 49 1,-0.4 17,-0.4 16,-0.0 -1,-0.3 0.437 117.0 116.5 89.0 -1.8 36.5 24.6 26.1 61 61 A F E < +J 58 0C 0 -3,-2.0 -3,-2.0 15,-0.1 -1,-0.4 -0.691 37.8 169.0 -96.2 151.4 37.6 24.8 22.5 62 62 A E E -JK 57 75C 69 13,-1.3 13,-1.9 -2,-0.3 2,-0.3 -0.985 16.4-171.9-161.4 154.5 39.1 28.0 21.0 63 63 A A E -JK 56 74C 2 -7,-2.1 -7,-2.0 -2,-0.3 2,-0.5 -0.983 18.2-136.5-149.8 141.8 40.8 29.3 18.0 64 64 A T E -J 55 0C 69 9,-0.5 2,-0.7 -2,-0.3 9,-0.3 -0.902 20.9-125.8-107.4 127.6 42.4 32.6 17.1 65 65 A Y - 0 0 0 -11,-2.5 -12,-3.1 -2,-0.5 2,-0.6 -0.639 34.4-177.3 -67.9 107.4 41.9 34.2 13.7 66 66 A N B > +C 71 0A 63 5,-1.9 5,-1.7 -2,-0.7 -14,-0.1 -0.935 12.7 175.3-115.6 108.5 45.5 34.8 12.6 67 67 A K T 5S+ 0 0 113 -2,-0.6 -1,-0.1 3,-0.2 5,-0.0 0.734 75.0 59.7 -86.3 -24.0 45.8 36.6 9.3 68 68 A E T 5S+ 0 0 160 1,-0.2 -1,-0.2 3,-0.1 -2,-0.0 0.904 121.3 28.5 -70.3 -37.1 49.5 37.0 9.0 69 69 A A T 5S- 0 0 47 2,-0.1 -1,-0.2 -46,-0.0 -2,-0.2 0.354 103.6-134.7-101.4 4.7 50.0 33.3 9.2 70 70 A T T 5 + 0 0 49 1,-0.2 -46,-2.6 -47,-0.1 2,-0.3 0.831 60.1 131.0 38.7 46.5 46.5 32.6 7.6 71 71 A S B < -BC 23 66A 8 -5,-1.7 -5,-1.9 -48,-0.3 -48,-0.3 -0.853 47.4-169.2-126.4 161.9 45.7 30.0 10.2 72 72 A F - 0 0 0 -50,-2.7 2,-0.1 -2,-0.3 -7,-0.1 -0.411 24.8-176.2-143.7 58.6 42.9 29.0 12.5 73 73 A H - 0 0 56 -9,-0.3 -9,-0.5 -51,-0.2 2,-0.3 -0.368 17.0-136.0 -68.1 140.5 44.3 26.3 14.9 74 74 A L E +IK 20 63C 0 -54,-2.6 -54,-2.4 -11,-0.1 2,-0.3 -0.710 25.4 177.2 -97.7 140.5 42.1 24.6 17.4 75 75 A Q E -IK 19 62C 77 -13,-1.9 -13,-1.3 -2,-0.3 2,-0.3 -0.937 17.4-178.9-143.4 156.3 43.2 24.0 21.0 76 76 A K E -I 18 0C 26 -58,-1.6 -58,-3.4 -2,-0.3 3,-0.3 -0.879 22.7-145.3-155.4 121.7 41.8 22.6 24.2 77 77 A A E S+ 0 0 70 -17,-0.4 2,-0.3 -2,-0.3 -1,-0.1 0.811 91.5 19.7 -59.6 -33.1 43.8 22.4 27.4 78 78 A S E S- 0 0 64 -18,-0.2 -1,-0.2 -61,-0.1 -61,-0.2 -0.758 74.4-158.9-148.1 100.8 42.3 19.2 28.5 79 79 A V E -I 16 0C 0 -63,-3.1 -64,-2.6 -3,-0.3 -63,-0.5 -0.418 10.3-164.5 -79.6 147.3 40.5 16.7 26.2 80 80 A Q > - 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