==== 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 05-SEP-05 2AXJ . COMPND 2 MOLECULE: SF4 T CELL RECEPTOR BETA CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR H.LI,S.VAN VRANKEN,Y.ZHAO,Z.LI,Y.GUO,L.EISELE,Y.LI . 484 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23383.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 294 60.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 2.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 178 36.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 56 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 14 2.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 2 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 . 2 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 0 0 0 PARALLEL BRIDGES PER LADDER . 4 6 10 2 2 0 6 2 2 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 4 2 2 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 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 3 A D 0 0 211 0, 0.0 406,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 45.5 37.7 90.4 -22.5 2 4 A G + 0 0 35 1,-0.1 2,-0.2 2,-0.0 23,-0.0 0.939 360.0 117.5 84.7 79.2 40.3 90.9 -25.2 3 5 A G - 0 0 32 21,-0.1 23,-1.2 99,-0.0 2,-0.4 -0.569 62.7 -55.1-145.0-151.1 40.2 94.5 -26.6 4 6 A I E -A 25 0A 25 99,-0.2 2,-0.5 21,-0.2 101,-0.3 -0.852 36.5-166.9-106.4 139.8 42.1 97.7 -26.9 5 7 A T E +A 24 0A 58 19,-3.1 19,-2.9 -2,-0.4 2,-0.2 -0.991 18.4 164.7-124.5 121.1 43.7 99.6 -24.1 6 8 A Q E -A 23 0A 6 -2,-0.5 17,-0.2 1,-0.3 3,-0.1 -0.660 43.5 -56.1-126.2-175.2 44.9 103.1 -24.7 7 9 A S S S- 0 0 4 15,-1.3 -1,-0.3 -2,-0.2 440,-0.1 -0.044 77.2 -69.8 -54.5 162.1 46.0 106.2 -22.7 8 10 A P - 0 0 8 0, 0.0 100,-0.2 0, 0.0 -1,-0.1 -0.075 48.9-103.2 -54.1 158.0 43.5 107.7 -20.1 9 11 A K S S+ 0 0 65 394,-0.6 99,-2.5 98,-0.2 2,-0.4 0.763 106.9 29.3 -54.4 -30.0 40.3 109.4 -21.3 10 12 A Y E S+c 108 0B 40 97,-0.2 2,-0.3 142,-0.1 99,-0.2 -0.999 70.2 175.7-137.5 136.9 41.9 112.9 -20.6 11 13 A L E -c 109 0B 14 97,-2.2 99,-2.5 -2,-0.4 2,-0.4 -0.951 23.0-128.1-138.2 157.9 45.5 114.0 -20.7 12 14 A F E -c 110 0B 7 -2,-0.3 2,-0.4 202,-0.2 99,-0.2 -0.867 18.2-177.5-108.7 140.8 47.5 117.2 -20.3 13 15 A R E -c 111 0B 6 97,-2.0 99,-1.9 -2,-0.4 2,-0.2 -0.972 15.7-149.0-136.9 115.5 50.2 118.5 -22.7 14 16 A K > - 0 0 85 -2,-0.4 3,-0.8 97,-0.2 99,-0.2 -0.605 42.9 -79.6 -84.8 148.6 52.1 121.7 -21.9 15 17 A E T 3 S+ 0 0 139 1,-0.2 -1,-0.1 -2,-0.2 65,-0.1 -0.204 118.8 10.8 -49.2 126.6 53.2 123.9 -24.8 16 18 A G T 3 S+ 0 0 44 64,-0.4 2,-0.4 66,-0.3 -1,-0.2 0.914 98.9 133.0 68.9 44.3 56.4 122.4 -26.2 17 19 A Q < - 0 0 46 -3,-0.8 2,-0.5 62,-0.2 -1,-0.2 -0.973 53.6-129.1-128.5 142.2 56.1 119.1 -24.4 18 20 A N + 0 0 93 -2,-0.4 2,-0.4 61,-0.1 61,-0.2 -0.789 30.2 178.4 -92.4 128.0 56.5 115.5 -25.7 19 21 A V E -I 78 0C 1 59,-2.4 59,-3.8 -2,-0.5 2,-0.5 -0.983 16.2-151.8-131.7 141.6 53.8 113.1 -24.7 20 22 A T E -I 77 0C 41 -2,-0.4 2,-0.6 57,-0.3 57,-0.3 -0.950 3.7-156.3-115.8 130.4 53.2 109.4 -25.6 21 23 A L E -I 76 0C 0 55,-3.8 55,-2.5 -2,-0.5 53,-0.0 -0.917 19.0-141.2-105.4 115.9 49.8 107.8 -25.8 22 24 A S - 0 0 4 -2,-0.6 -15,-1.3 53,-0.2 2,-0.2 -0.245 19.5-177.9 -71.1 163.0 49.9 104.1 -25.3 23 25 A a E +A 6 0A 0 -17,-0.2 51,-2.4 2,-0.0 2,-0.4 -0.756 6.7 169.3-164.4 113.9 47.8 101.6 -27.3 24 26 A E E -AB 5 73A 32 -19,-2.9 -19,-3.1 -2,-0.2 2,-0.4 -0.973 8.4-175.2-133.0 145.9 47.7 97.9 -26.8 25 27 A Q E -A 4 0A 6 47,-2.0 3,-0.3 -2,-0.4 -21,-0.2 -0.997 20.3-160.7-140.2 143.1 45.6 95.0 -28.0 26 28 A N S S+ 0 0 94 -23,-1.2 -22,-0.1 -2,-0.4 46,-0.1 -0.368 71.9 96.6-115.0 48.7 45.4 91.3 -27.2 27 29 A L S S- 0 0 46 2,-0.1 -1,-0.2 -24,-0.1 3,-0.1 0.345 91.4-123.9-113.6 -1.5 43.5 90.4 -30.4 28 30 A N + 0 0 115 -3,-0.3 2,-0.3 1,-0.2 -2,-0.1 0.858 52.1 165.0 59.3 35.6 46.7 89.5 -32.3 29 31 A H - 0 0 17 1,-0.1 -1,-0.2 42,-0.1 66,-0.2 -0.633 32.7-152.8 -82.5 142.3 45.7 91.9 -35.0 30 32 A D S S+ 0 0 36 65,-0.3 2,-0.3 64,-0.3 65,-0.2 0.914 75.5 61.2 -81.2 -45.8 48.5 92.8 -37.3 31 33 A A E +D 94 0B 1 63,-1.7 63,-3.0 64,-0.4 2,-0.3 -0.648 60.4 176.8 -90.8 138.0 47.3 96.3 -38.3 32 34 A M E -DE 93 49B 0 17,-1.8 17,-2.4 -2,-0.3 2,-0.3 -0.977 7.2-163.9-136.4 148.4 46.9 99.2 -35.9 33 35 A Y E -DE 92 48B 13 59,-3.7 59,-2.4 -2,-0.3 2,-0.4 -0.922 14.4-152.6-134.4 159.5 45.9 102.8 -36.4 34 36 A W E -DE 91 47B 0 13,-2.1 12,-3.2 -2,-0.3 13,-1.2 -0.997 20.5-175.0-131.3 124.6 45.9 106.2 -34.8 35 37 A Y E -DE 90 45B 39 55,-3.5 55,-2.2 -2,-0.4 2,-0.4 -0.834 15.0-151.4-118.3 157.3 43.3 108.8 -35.7 36 38 A R E -DE 89 44B 20 8,-2.2 8,-1.9 -2,-0.3 2,-0.9 -0.994 18.0-134.8-125.6 133.4 42.7 112.4 -34.7 37 39 A Q E -DE 88 43B 94 51,-2.7 51,-0.7 -2,-0.4 6,-0.2 -0.809 20.7-171.1 -94.8 107.1 39.2 113.8 -34.6 38 40 A D E > - E 0 42B 15 4,-2.1 4,-1.8 -2,-0.9 3,-0.2 -0.876 28.1-131.7 -98.9 120.2 39.2 117.2 -36.3 39 41 A P T 4 S+ 0 0 139 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.741 104.8 59.1 -37.7 -31.5 35.8 119.1 -35.8 40 42 A G T 4 S+ 0 0 61 1,-0.2 -3,-0.0 2,-0.1 0, 0.0 0.997 125.0 5.3 -66.7 -67.1 36.1 119.7 -39.5 41 43 A Q T 4 S- 0 0 119 1,-0.4 -1,-0.2 -3,-0.2 2,-0.0 0.077 92.5-131.2-110.5 23.8 36.2 116.2 -41.2 42 44 A G E < S+E 38 0B 27 -4,-1.8 -4,-2.1 -5,-0.1 -1,-0.4 -0.332 74.4 19.0 64.6-144.6 35.7 113.9 -38.2 43 45 A L E -E 37 0B 67 -6,-0.2 2,-0.4 -8,-0.1 -6,-0.2 -0.379 67.6-178.4 -65.5 131.2 38.2 111.0 -37.9 44 46 A R E -E 36 0B 82 -8,-1.9 -8,-2.2 -2,-0.2 2,-0.2 -0.993 29.2-114.2-134.7 127.7 41.5 111.4 -39.8 45 47 A L E +E 35 0B 52 -2,-0.4 15,-0.9 -10,-0.2 14,-0.6 -0.391 31.2 173.5 -64.9 124.4 44.4 108.9 -40.0 46 48 A I E - 0 0 0 -12,-3.2 12,-1.8 1,-0.4 2,-0.3 0.884 68.9 -8.9 -91.6 -56.7 47.6 110.0 -38.4 47 49 A Y E -EF 34 57B 17 -13,-1.2 -13,-2.1 10,-0.2 -1,-0.4 -0.973 59.4-165.3-143.8 157.0 49.6 106.8 -38.6 48 50 A Y E -EF 33 56B 66 8,-1.6 8,-3.1 -2,-0.3 2,-0.4 -0.996 4.0-160.2-147.5 143.4 49.0 103.2 -39.6 49 51 A S E -E 32 0B 0 -17,-2.4 -17,-1.8 -2,-0.3 6,-0.2 -0.968 7.9-173.6-133.2 118.2 51.0 100.0 -39.2 50 52 A Q S S- 0 0 71 -2,-0.4 2,-0.3 1,-0.2 -1,-0.1 0.852 74.0 -14.4 -75.8 -40.8 50.4 96.8 -41.3 51 53 A I S > S- 0 0 65 3,-0.3 3,-2.1 -19,-0.1 -1,-0.2 -0.958 99.5 -44.1-155.8 169.4 52.8 94.6 -39.4 52 54 A V T 3 S+ 0 0 58 -2,-0.3 17,-0.2 1,-0.3 19,-0.1 -0.004 122.4 8.1 -42.0 134.2 55.6 94.7 -36.8 53 55 A N T 3 S+ 0 0 114 15,-2.1 2,-0.4 1,-0.2 -1,-0.3 0.481 105.9 106.6 70.4 5.4 58.2 97.4 -37.4 54 56 A D < + 0 0 31 -3,-2.1 2,-0.3 14,-0.2 -3,-0.3 -0.947 37.6 167.8-119.4 135.9 56.3 99.1 -40.2 55 57 A F - 0 0 88 -2,-0.4 2,-0.4 -6,-0.2 -6,-0.3 -0.941 17.8-156.0-150.2 125.8 54.4 102.4 -40.2 56 58 A Q E -F 48 0B 78 -8,-3.1 -8,-1.6 -2,-0.3 -2,-0.0 -0.852 25.3-121.2-101.1 129.9 52.9 104.4 -43.0 57 59 A K E -F 47 0B 157 -2,-0.4 -10,-0.2 -10,-0.2 2,-0.2 -0.244 22.2-146.5 -65.8 156.1 52.3 108.2 -42.5 58 60 A G > - 0 0 19 -12,-1.8 3,-0.6 -14,-0.1 -12,-0.2 -0.399 36.8 -87.9-107.9-169.6 48.9 109.6 -42.8 59 61 A D T 3 S+ 0 0 161 -14,-0.6 3,-0.2 1,-0.2 -13,-0.1 0.804 127.7 38.7 -74.1 -28.8 48.0 113.1 -44.2 60 62 A I T 3 S+ 0 0 17 -15,-0.9 -1,-0.2 1,-0.2 -14,-0.1 0.212 75.3 121.1-106.0 16.0 48.3 114.8 -40.8 61 63 A A X + 0 0 9 -3,-0.6 3,-1.6 -15,-0.2 2,-0.7 0.437 38.2 125.4 -59.3 1.0 51.3 112.8 -39.5 62 64 A E T 3 S+ 0 0 159 1,-0.3 3,-0.1 -3,-0.2 -3,-0.0 -0.516 79.2 10.4 -68.0 108.1 53.1 116.1 -39.2 63 65 A G T 3 S+ 0 0 17 -2,-0.7 16,-1.8 1,-0.4 19,-0.4 0.361 109.8 95.1 107.1 -6.0 54.4 116.3 -35.6 64 66 A Y E < -J 78 0C 9 -3,-1.6 -1,-0.4 14,-0.2 2,-0.3 -0.804 48.2-168.6-117.2 161.0 53.7 112.8 -34.5 65 67 A S E -J 77 0C 50 12,-1.7 12,-3.1 -2,-0.3 2,-0.3 -0.985 3.6-171.1-144.8 150.5 55.9 109.7 -34.4 66 68 A V E -J 76 0C 14 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.934 6.4-160.1-139.9 162.9 55.1 106.0 -33.8 67 69 A S - 0 0 39 8,-0.8 3,-0.1 -2,-0.3 -13,-0.1 -0.948 8.0-165.1-139.6 157.2 56.9 102.7 -33.3 68 70 A R + 0 0 0 -2,-0.3 -15,-2.1 6,-0.1 -14,-0.2 -0.210 29.8 148.4-141.9 47.9 55.9 99.1 -33.7 69 71 A E S S+ 0 0 137 -17,-0.2 2,-0.3 -16,-0.1 -1,-0.1 0.848 74.8 26.2 -48.7 -42.9 58.5 97.1 -31.8 70 72 A K S S- 0 0 112 3,-0.5 3,-0.4 -3,-0.1 -17,-0.1 -0.880 79.0-120.2-125.8 159.1 55.9 94.5 -31.0 71 73 A K S S+ 0 0 45 -2,-0.3 -42,-0.1 1,-0.2 -1,-0.1 0.839 109.5 52.6 -63.9 -35.6 52.6 93.3 -32.5 72 74 A E S S+ 0 0 90 -48,-0.1 -47,-2.0 -44,-0.1 2,-0.4 0.755 104.8 58.6 -74.7 -26.8 50.5 94.2 -29.4 73 75 A S B +B 24 0A 13 -3,-0.4 -3,-0.5 -49,-0.2 -49,-0.2 -0.895 43.1 171.0-118.9 138.6 51.6 97.8 -29.0 74 76 A F - 0 0 0 -51,-2.4 2,-0.2 -2,-0.4 -6,-0.1 -0.657 21.7-164.4-139.4 77.1 51.5 100.9 -31.2 75 77 A P - 0 0 23 0, 0.0 -8,-0.8 0, 0.0 2,-0.5 -0.464 5.8-150.9 -70.5 130.3 52.5 104.0 -29.2 76 78 A L E -IJ 21 66C 0 -55,-2.5 -55,-3.8 -2,-0.2 2,-0.5 -0.875 7.9-158.7-102.2 125.1 51.7 107.4 -30.5 77 79 A T E -IJ 20 65C 27 -12,-3.1 -12,-1.7 -2,-0.5 2,-0.9 -0.908 6.6-157.0-107.3 126.5 54.0 110.2 -29.6 78 80 A V E -IJ 19 64C 0 -59,-3.8 -59,-2.4 -2,-0.5 -14,-0.2 -0.880 23.4-151.3-100.4 103.3 52.8 113.8 -29.8 79 81 A T > - 0 0 28 -16,-1.8 3,-2.5 -2,-0.9 -62,-0.2 -0.303 27.4-108.6 -73.7 158.2 56.1 115.8 -30.1 80 82 A S T 3 S+ 0 0 57 1,-0.3 -64,-0.4 -64,-0.2 -63,-0.1 0.755 118.0 70.7 -56.7 -24.1 56.5 119.4 -28.9 81 83 A A T 3 S+ 0 0 66 -18,-0.1 2,-0.3 -65,-0.1 -1,-0.3 0.756 73.7 104.7 -64.2 -25.6 56.6 120.2 -32.6 82 84 A Q < - 0 0 16 -3,-2.5 -66,-0.3 -19,-0.4 -65,-0.2 -0.427 52.7-171.0 -61.5 119.1 52.9 119.4 -32.7 83 85 A K + 0 0 174 -2,-0.3 -1,-0.1 -68,-0.1 -3,-0.1 0.122 37.2 131.7-100.2 20.7 51.0 122.7 -32.8 84 86 A N - 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