==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MEMBRANE PROTEIN/IMMUNE SYSTEM 22-SEP-04 1XIW . COMPND 2 MOLECULE: T-CELL SURFACE GLYCOPROTEIN CD3 EPSILON CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.L.ARNETT,S.C.HARRISON,D.C.WILEY . 765 10 9 8 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33185.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 516 67.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 32 4.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 302 39.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 7 0.9 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 . 2 0.3 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 . 84 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 69 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 19 2.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 0.8 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 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 4 0 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 PARALLEL BRIDGES PER LADDER . 2 7 11 12 9 12 1 2 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 8 0 0 2 0 0 0 0 0 0 2 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 12 A Q 0 0 123 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 135.5 62.9 -4.7 9.9 2 13 A T - 0 0 76 1,-0.1 17,-0.2 3,-0.0 2,-0.1 -0.709 360.0-106.6-105.4 155.4 63.4 -6.6 13.2 3 14 A P - 0 0 40 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.438 37.8 -96.1 -80.3 159.8 60.6 -7.7 15.5 4 15 A Y - 0 0 6 -2,-0.1 2,-0.5 75,-0.1 13,-0.2 -0.458 40.0-124.3 -67.0 144.8 59.9 -6.1 18.9 5 16 A K E -A 16 0A 130 11,-2.3 11,-2.1 -2,-0.1 2,-0.6 -0.837 25.2-161.4 -93.3 130.9 61.6 -8.1 21.6 6 17 A V E -A 15 0A 30 -2,-0.5 2,-0.6 9,-0.2 9,-0.2 -0.935 10.1-178.9-119.8 111.6 59.1 -9.2 24.2 7 18 A S E +A 14 0A 45 7,-2.7 7,-3.0 -2,-0.6 2,-0.6 -0.913 3.1 177.1-113.1 108.9 60.4 -10.3 27.6 8 19 A I E +A 13 0A 28 -2,-0.6 2,-0.4 5,-0.2 5,-0.2 -0.950 13.0 159.1-112.9 113.9 57.9 -11.4 30.1 9 20 A S E > -A 12 0A 86 3,-2.4 3,-1.9 -2,-0.6 2,-0.3 -0.952 61.0 -44.7-139.7 116.7 59.6 -12.6 33.3 10 21 A G T 3 S- 0 0 51 -2,-0.4 80,-0.1 1,-0.3 0, 0.0 -0.477 121.5 -22.5 65.9-123.6 57.8 -12.7 36.7 11 22 A T T 3 S+ 0 0 80 -2,-0.3 44,-2.4 -3,-0.1 2,-0.4 0.354 120.9 87.8-103.4 6.0 55.9 -9.5 37.2 12 23 A T E < -A 9 0A 39 -3,-1.9 -3,-2.4 42,-0.2 2,-0.5 -0.891 54.9-163.3-113.4 132.7 57.9 -7.4 34.8 13 24 A V E -AB 8 52A 0 39,-2.6 39,-3.4 -2,-0.4 2,-0.5 -0.947 9.2-169.8-110.3 129.4 57.3 -7.0 31.1 14 25 A I E -AB 7 51A 54 -7,-3.0 -7,-2.7 -2,-0.5 2,-0.4 -0.981 1.1-167.0-123.0 120.3 60.2 -5.5 29.1 15 26 A L E -AB 6 50A 0 35,-2.6 35,-2.8 -2,-0.5 2,-0.5 -0.852 4.0-159.2-104.1 140.9 59.8 -4.5 25.4 16 27 A T E -AB 5 49A 15 -11,-2.1 -11,-2.3 -2,-0.4 33,-0.2 -0.981 20.8-122.5-124.1 124.4 62.7 -3.7 23.2 17 28 A a - 0 0 3 31,-2.9 31,-0.1 -2,-0.5 -13,-0.0 -0.281 19.4-131.2 -61.1 141.9 62.3 -1.6 20.1 18 29 A P S S- 0 0 23 0, 0.0 -1,-0.1 0, 0.0 2,-0.0 0.986 71.0 -5.8 -60.7 -65.4 63.4 -3.2 16.8 19 30 A Q S S+ 0 0 67 -17,-0.2 4,-0.1 1,-0.1 -2,-0.1 -0.024 77.9 94.2-112.5-148.4 65.6 -0.7 15.0 20 31 A Y > - 0 0 73 1,-0.2 3,-2.3 2,-0.1 -1,-0.1 0.820 53.5-171.5 64.9 35.2 66.9 2.8 15.2 21 32 A P T 3 S+ 0 0 122 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.338 72.3 25.2 -58.7 136.4 70.1 1.9 17.0 22 33 A G T 3 S+ 0 0 92 1,-0.3 2,-0.3 0, 0.0 -2,-0.1 0.359 103.8 104.2 91.9 -8.2 71.9 5.0 18.1 23 34 A S S < S- 0 0 58 -3,-2.3 -1,-0.3 -4,-0.1 2,-0.2 -0.801 79.7-109.7-107.3 150.1 68.7 7.1 18.2 24 35 A E - 0 0 22 -2,-0.3 45,-2.1 -3,-0.1 2,-0.4 -0.534 41.4-141.5 -70.2 145.8 66.7 8.2 21.3 25 36 A I E -D 68 0B 5 22,-0.4 2,-0.3 43,-0.2 22,-0.1 -0.919 16.3-166.4-118.3 141.1 63.5 6.1 21.3 26 37 A L E -D 67 0B 5 41,-2.8 41,-2.0 -2,-0.4 2,-0.3 -0.882 8.7-150.6-123.6 157.7 60.0 7.3 22.2 27 38 A W E -DE 66 34B 0 7,-0.8 7,-1.8 -2,-0.3 2,-0.3 -0.905 13.6-167.4-132.6 156.5 56.9 5.3 22.9 28 39 A Q E -DE 65 33B 18 37,-1.9 37,-1.8 -2,-0.3 2,-0.5 -0.991 7.5-160.5-137.1 143.6 53.1 5.3 22.8 29 40 A H E > S-DE 64 32B 23 3,-2.8 3,-1.6 -2,-0.3 35,-0.2 -0.987 82.8 -17.2-125.5 117.2 50.6 2.9 24.4 30 41 A N T 3 S- 0 0 73 33,-2.4 -1,-0.1 -2,-0.5 34,-0.1 0.934 130.6 -52.2 49.5 50.2 47.1 2.8 23.0 31 42 A D T 3 S+ 0 0 93 1,-0.2 2,-0.5 32,-0.2 -1,-0.3 0.587 115.6 118.2 64.0 14.9 47.8 6.2 21.4 32 43 A K E < -E 29 0B 140 -3,-1.6 -3,-2.8 0, 0.0 -1,-0.2 -0.933 69.0-117.1-113.3 131.6 49.0 7.7 24.7 33 44 A N E +E 28 0B 31 -2,-0.5 2,-0.3 -5,-0.2 -5,-0.2 -0.432 44.8 164.7 -63.9 134.0 52.6 9.0 25.2 34 45 A I E +E 27 0B 10 -7,-1.8 -7,-0.8 -2,-0.1 3,-0.1 -0.961 39.4 64.1-146.3 163.5 54.5 7.0 27.9 35 46 A G S S+ 0 0 5 -2,-0.3 10,-0.5 1,-0.3 -1,-0.1 0.363 81.3 99.8 103.5 -4.3 58.0 6.5 29.0 36 47 A G S S- 0 0 4 -9,-0.1 2,-1.1 8,-0.1 -1,-0.3 0.023 97.2 -60.1 -93.4-155.4 58.6 10.1 30.1 37 48 A D S S+ 0 0 55 261,-0.4 2,-0.1 -3,-0.1 4,-0.1 -0.308 82.5 144.0 -89.5 51.3 58.5 11.7 33.5 38 49 A E - 0 0 80 -2,-1.1 5,-0.1 2,-0.2 -4,-0.0 -0.353 65.8 -92.6 -86.7 171.1 54.9 10.8 34.3 39 50 A D S S+ 0 0 163 1,-0.1 2,-1.0 -2,-0.1 -1,-0.1 0.805 102.2 83.5 -49.9 -42.2 53.3 9.8 37.6 40 51 A D > - 0 0 80 1,-0.2 3,-1.3 2,-0.1 -2,-0.2 -0.558 53.7-176.5 -75.6 100.4 53.6 6.1 37.2 41 52 A K T 3 S+ 0 0 127 -2,-1.0 -1,-0.2 1,-0.3 -2,-0.1 0.308 75.0 74.9 -79.1 9.9 57.2 5.1 38.3 42 53 A N T 3 S+ 0 0 59 11,-0.1 11,-2.8 1,-0.1 2,-0.6 0.382 84.2 77.4 -98.4 1.6 56.7 1.5 37.3 43 54 A I E < +C 52 0A 34 -3,-1.3 2,-0.4 9,-0.2 9,-0.2 -0.951 64.3 174.4-113.4 115.5 57.0 2.5 33.6 44 55 A G E -C 51 0A 20 7,-2.8 7,-3.9 -2,-0.6 2,-0.5 -0.974 20.2-162.7-129.6 140.5 60.6 3.2 32.5 45 56 A S E +C 50 0A 13 -10,-0.5 2,-0.3 -2,-0.4 5,-0.2 -0.976 19.0 162.9-118.4 126.4 62.2 3.9 29.2 46 57 A D E > -C 49 0A 86 3,-2.5 3,-2.6 -2,-0.5 2,-0.1 -0.947 62.0 -43.9-146.3 122.4 66.0 3.5 28.8 47 58 A E T 3 S- 0 0 159 -2,-0.3 -22,-0.4 1,-0.3 -31,-0.0 -0.370 125.5 -20.4 56.6-127.7 67.8 3.2 25.5 48 59 A D T 3 S+ 0 0 56 -2,-0.1 -31,-2.9 -24,-0.1 2,-0.3 0.324 120.7 96.9 -93.4 10.4 65.7 1.0 23.2 49 60 A H E < -BC 16 46A 61 -3,-2.6 -3,-2.5 -33,-0.2 2,-0.5 -0.779 51.8-164.3-106.6 144.9 63.9 -0.6 26.2 50 61 A L E -BC 15 45A 0 -35,-2.8 -35,-2.6 -2,-0.3 2,-0.5 -0.984 16.6-158.7-121.7 116.5 60.5 0.0 27.8 51 62 A S E -BC 14 44A 22 -7,-3.9 -7,-2.8 -2,-0.5 2,-0.7 -0.875 9.7-171.3-104.7 125.4 60.1 -1.6 31.3 52 63 A L E > -BC 13 43A 0 -39,-3.4 -39,-2.6 -2,-0.5 3,-0.7 -0.874 13.0-164.8-115.7 94.3 56.7 -2.2 32.7 53 64 A K T 3 S+ 0 0 115 -11,-2.8 -41,-0.2 -2,-0.7 3,-0.1 -0.526 72.7 11.5 -80.6 148.8 57.1 -3.3 36.3 54 65 A E T 3 S- 0 0 138 -2,-0.2 -1,-0.2 -43,-0.2 -42,-0.2 0.928 95.7-150.2 47.2 49.4 54.2 -5.0 38.2 55 66 A F < - 0 0 9 -44,-2.4 2,-0.6 -3,-0.7 31,-0.2 -0.197 8.5-148.4 -52.0 132.9 52.6 -5.3 34.8 56 67 A S > - 0 0 37 1,-0.2 4,-3.3 -3,-0.1 5,-0.3 -0.933 4.7-156.8-110.7 114.5 48.8 -5.2 34.8 57 68 A E H > S+ 0 0 65 -2,-0.6 4,-1.5 1,-0.2 -1,-0.2 0.905 93.7 49.8 -52.9 -47.7 47.0 -7.2 32.1 58 69 A L H 4 S+ 0 0 161 1,-0.2 -1,-0.2 2,-0.2 27,-0.0 0.860 123.6 27.7 -63.0 -40.1 43.8 -5.2 32.3 59 70 A E H 4 S+ 0 0 144 -3,-0.2 -2,-0.2 1,-0.1 -1,-0.2 0.698 126.4 41.8 -98.0 -20.2 45.5 -1.8 32.1 60 71 A Q H < S+ 0 0 19 -4,-3.3 -3,-0.2 24,-0.1 -2,-0.2 0.475 83.5 100.7-111.5 -0.2 48.7 -2.6 30.1 61 72 A S < + 0 0 17 -4,-1.5 2,-0.3 -5,-0.3 22,-0.2 -0.362 60.8 67.3 -72.4 163.4 47.6 -4.9 27.4 62 73 A G E S- F 0 82B 4 20,-3.0 20,-2.9 -2,-0.1 2,-0.4 -0.841 85.6 -14.3 128.6-164.5 47.1 -3.2 24.1 63 74 A Y E - F 0 81B 28 -2,-0.3 -33,-2.4 18,-0.2 2,-0.4 -0.657 50.0-178.0 -85.9 132.6 49.1 -1.5 21.3 64 75 A Y E +DF 29 80B 2 16,-2.6 16,-3.0 -2,-0.4 2,-0.3 -0.958 3.3 176.2-124.6 146.2 52.6 -0.4 21.8 65 76 A V E -D 28 0B 0 -37,-1.8 -37,-1.9 -2,-0.4 2,-0.3 -0.992 10.8-161.5-150.6 141.8 54.8 1.5 19.3 66 77 A a E +D 27 0B 4 12,-0.4 -39,-0.2 -2,-0.3 12,-0.2 -0.889 11.2 175.0-121.5 155.2 58.2 3.0 19.4 67 78 A Y E -D 26 0B 4 -41,-2.0 -41,-2.8 -2,-0.3 2,-0.1 -0.982 31.7-101.6-156.1 152.4 59.8 5.5 17.1 68 79 A P E > -D 25 0B 14 0, 0.0 3,-2.4 0, 0.0 -43,-0.2 -0.418 46.9 -90.7 -78.6 151.4 63.1 7.5 16.9 69 80 A R T 3 S+ 0 0 11 -45,-2.1 3,-0.1 1,-0.3 -45,-0.1 -0.345 118.2 41.6 -55.9 138.1 63.4 11.1 18.0 70 81 A G T 3 S+ 0 0 8 1,-0.5 -1,-0.3 -3,-0.1 2,-0.2 0.102 100.9 93.6 106.7 -24.0 62.8 13.2 14.9 71 82 A S S < S- 0 0 47 -3,-2.4 -1,-0.5 183,-0.1 -4,-0.1 -0.539 72.1-122.6 -98.0 169.0 59.8 11.0 13.8 72 83 A K >> - 0 0 1 -2,-0.2 3,-1.4 1,-0.1 4,-0.7 -0.890 11.2-133.8-114.0 138.7 56.1 11.3 14.5 73 84 A P G >4 S+ 0 0 3 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 0.926 107.2 63.1 -56.3 -40.7 53.9 8.7 16.3 74 85 A E G 34 S+ 0 0 97 1,-0.3 298,-0.0 297,-0.1 -3,-0.0 0.767 102.0 50.5 -54.2 -27.4 51.3 9.3 13.5 75 86 A D G <4 S+ 0 0 59 -3,-1.4 -1,-0.3 2,-0.0 -4,-0.0 0.631 81.3 114.6 -87.8 -14.8 53.8 8.0 11.0 76 87 A A << + 0 0 16 -3,-1.7 3,-0.1 -4,-0.7 -9,-0.1 -0.331 36.0 174.4 -57.6 134.3 54.7 4.8 12.9 77 88 A N + 0 0 73 1,-0.1 72,-2.9 71,-0.1 2,-0.5 0.297 55.5 75.9-126.5 5.2 53.5 1.8 10.9 78 89 A F E + g 0 149B 16 -12,-0.2 -12,-0.4 70,-0.2 2,-0.2 -0.890 61.2 177.1-126.4 102.7 54.8 -1.1 13.0 79 90 A Y E - g 0 150B 13 70,-2.5 72,-3.0 -2,-0.5 2,-0.5 -0.660 25.4-139.5-105.5 155.8 52.9 -1.9 16.2 80 91 A L E -Fg 64 151B 0 -16,-3.0 -16,-2.6 -2,-0.2 2,-0.7 -0.944 11.6-158.3-109.9 132.1 53.0 -4.5 18.9 81 92 A Y E -Fg 63 152B 33 70,-3.4 72,-2.7 -2,-0.5 2,-0.5 -0.929 17.9-168.3-113.7 105.4 49.7 -5.9 20.1 82 93 A L E +Fg 62 153B 0 -20,-2.9 -20,-3.0 -2,-0.7 2,-0.4 -0.844 22.1 167.4-104.1 125.6 50.4 -7.3 23.6 83 94 A R E + g 0 154B 26 70,-2.4 72,-2.2 -2,-0.5 2,-0.3 -0.899 26.6 154.1-133.2 99.5 48.0 -9.4 25.6 84 95 A A E - g 0 155B 0 -2,-0.4 2,-0.4 70,-0.2 72,-0.2 -0.961 32.9-157.6-136.1 150.0 49.9 -10.9 28.5 85 96 A R - 0 0 57 70,-2.3 72,-0.1 -2,-0.3 2,-0.1 -0.944 11.0-152.0-119.8 142.0 49.2 -12.3 31.9 86 97 A V + 0 0 36 -2,-0.4 2,-0.1 -31,-0.2 3,-0.1 -0.350 34.8 161.1-112.3 52.3 52.0 -12.4 34.5 87 98 A C > - 0 0 70 1,-0.1 3,-1.0 -2,-0.1 4,-0.1 -0.450 50.0 -94.2 -73.7 144.0 50.7 -15.4 36.5 88 99 A E T 3 S+ 0 0 172 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.0 -0.310 110.9 5.6 -57.1 133.2 53.1 -17.3 38.8 89 100 A N T 3 S+ 0 0 137 -3,-0.1 -1,-0.3 1,-0.1 -2,-0.1 0.947 81.9 166.6 52.1 51.3 54.6 -20.3 37.0 90 101 A b < 0 0 8 -3,-1.0 -2,-0.1 1,-0.2 -1,-0.1 0.929 360.0 360.0 -59.4 -50.4 52.9 -19.2 33.8 91 102 A M 0 0 187 -4,-0.1 -1,-0.2 66,-0.1 66,-0.1 -0.201 360.0 360.0 47.6 360.0 54.9 -21.5 31.6 92 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 93 1 B M 0 0 174 0, 0.0 2,-0.4 0, 0.0 56,-0.3 0.000 360.0 360.0 360.0-164.8 47.6 3.1 11.2 94 2 B K - 0 0 48 54,-0.1 56,-0.1 -16,-0.1 -16,-0.1 -0.850 360.0-117.9-103.7 137.7 47.4 0.2 13.5 95 3 B I - 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