==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 16-JAN-01 1HXM . COMPND 2 MOLECULE: GAMMA-DELTA T-CELL RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.J.ALLISON,C.C.WINTER,J.J.FOURNIE,M.BONNEVILLE,D.N.GARBOCZI . 1744 8 16 16 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 81905.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1106 63.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 56 3.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 643 36.9 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 . 12 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 18 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 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 . 195 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 140 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 28 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 0.5 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 . 4 0 0 0 8 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 . 9 18 21 15 20 18 10 1 6 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 8 3 13 0 8 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 A 0 0 140 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -68.4 66.5 27.4 58.8 2 2 A I + 0 0 35 25,-0.1 2,-0.3 23,-0.0 25,-0.2 -0.810 360.0 169.2 -98.9 139.3 65.1 24.8 61.1 3 3 A E - 0 0 105 -2,-0.4 23,-3.3 25,-0.1 2,-0.4 -0.999 26.9-144.1-152.4 144.5 65.6 21.1 60.3 4 4 A L E -Ab 25 110A 6 105,-0.5 107,-0.7 -2,-0.3 21,-0.2 -0.926 17.4-171.2-111.2 135.7 65.2 17.6 61.8 5 5 A V E -A 24 0A 42 19,-3.3 19,-2.4 -2,-0.4 107,-0.1 -0.965 17.8-133.6-131.7 119.2 67.7 14.9 61.1 6 6 A P E -A 23 0A 19 0, 0.0 17,-0.3 0, 0.0 3,-0.1 -0.297 19.6-124.8 -66.6 152.0 67.3 11.2 62.1 7 7 A E S S+ 0 0 91 15,-2.0 2,-0.3 1,-0.2 16,-0.1 0.974 91.5 10.3 -60.7 -56.1 70.3 9.5 63.7 8 8 A H - 0 0 95 14,-0.3 -1,-0.2 1,-0.1 3,-0.1 -0.931 60.8-140.3-126.7 150.7 70.4 6.7 61.1 9 9 A Q S S+ 0 0 169 -2,-0.3 105,-2.9 1,-0.2 2,-0.4 0.954 97.3 24.3 -69.1 -50.7 68.5 6.1 57.9 10 10 A T E -e 114 0B 59 103,-0.2 -1,-0.2 79,-0.1 105,-0.2 -0.929 66.1-175.0-117.2 139.9 68.0 2.4 58.7 11 11 A V E -e 115 0B 20 103,-2.7 105,-0.8 -2,-0.4 2,-0.2 -0.887 14.0-153.3-136.7 102.6 68.0 0.9 62.1 12 12 A P E -e 116 0B 97 0, 0.0 2,-0.3 0, 0.0 105,-0.2 -0.515 17.3-177.2 -77.7 146.2 67.7 -2.9 62.3 13 13 A V E -e 117 0B 12 103,-2.8 105,-1.9 -2,-0.2 2,-0.4 -0.957 20.4-131.2-141.4 158.3 66.2 -4.4 65.4 14 14 A S E > -e 118 0B 51 3,-0.4 3,-2.0 -2,-0.3 106,-0.1 -0.870 40.1 -90.8-112.1 145.0 65.5 -7.9 66.8 15 15 A I T 3 S+ 0 0 28 103,-1.5 68,-0.2 -2,-0.4 -1,-0.1 -0.175 109.5 6.9 -52.8 139.1 62.1 -9.1 68.2 16 16 A G T 3 S+ 0 0 29 66,-2.0 -1,-0.3 1,-0.2 67,-0.1 0.354 101.4 117.3 70.5 -7.6 61.7 -8.5 71.9 17 17 A V < - 0 0 56 -3,-2.0 -3,-0.4 65,-0.1 -1,-0.2 -0.826 69.8-120.7-100.5 107.4 65.0 -6.6 72.0 18 18 A P + 0 0 87 0, 0.0 2,-0.3 0, 0.0 62,-0.2 -0.043 37.2 176.3 -44.7 133.4 64.6 -2.9 73.1 19 19 A A E - C 0 79A 20 60,-2.6 60,-4.0 -6,-0.1 2,-0.4 -0.975 16.8-143.7-141.0 151.5 65.8 -0.4 70.5 20 20 A T E - C 0 78A 33 -2,-0.3 2,-0.4 58,-0.3 58,-0.3 -0.946 0.8-152.9-125.1 143.2 65.7 3.4 70.4 21 21 A L E - C 0 77A 3 56,-3.5 56,-2.7 -2,-0.4 2,-0.3 -0.919 17.2-169.2-110.9 134.4 65.2 5.9 67.6 22 22 A R E - C 0 76A 82 -2,-0.4 -15,-2.0 54,-0.2 -14,-0.3 -0.852 10.3-175.4-122.7 161.2 66.7 9.3 67.8 23 23 A a E -AC 6 75A 1 52,-1.5 52,-2.6 -2,-0.3 2,-0.3 -0.862 12.9-150.0-160.1 116.3 66.3 12.5 65.8 24 24 A S E -AC 5 74A 28 -19,-2.4 -19,-3.3 -2,-0.3 2,-0.5 -0.648 9.4-136.3 -95.0 147.0 68.2 15.7 66.2 25 25 A M E -A 4 0A 12 48,-2.0 -21,-0.2 -2,-0.3 5,-0.1 -0.875 15.5-172.9-100.5 129.3 67.1 19.3 65.5 26 26 A K + 0 0 149 -23,-3.3 -22,-0.1 -2,-0.5 3,-0.1 -0.427 68.8 51.3-121.8 58.8 69.6 21.5 63.7 27 27 A G S S- 0 0 32 1,-0.5 2,-0.2 -25,-0.2 -25,-0.1 0.382 109.1 -12.0-150.1 -57.0 68.0 24.9 63.7 28 28 A E S S- 0 0 121 -25,-0.1 2,-0.5 45,-0.1 -1,-0.5 -0.420 92.1 -45.6-133.3-151.6 66.8 26.2 67.1 29 29 A A > - 0 0 40 -2,-0.2 3,-1.6 1,-0.1 4,-0.2 -0.794 39.9-137.3 -94.7 126.7 66.2 25.0 70.6 30 30 A I G > S+ 0 0 0 -2,-0.5 3,-0.9 1,-0.3 -1,-0.1 0.729 100.0 65.8 -52.3 -23.1 64.3 21.7 71.0 31 31 A G G 3 S+ 0 0 42 1,-0.2 -1,-0.3 39,-0.1 4,-0.0 0.811 88.5 60.5 -72.4 -31.9 62.3 23.3 73.8 32 32 A N G < S+ 0 0 89 -3,-1.6 65,-0.5 2,-0.0 2,-0.3 0.296 105.2 63.6 -80.0 12.5 60.4 25.9 71.8 33 33 A Y S < S- 0 0 37 -3,-0.9 2,-0.5 -4,-0.2 63,-0.2 -0.990 78.5-130.9-138.6 143.8 58.9 23.1 69.8 34 34 A Y E -F 95 0B 92 61,-1.9 61,-0.6 -2,-0.3 2,-0.4 -0.812 30.4-141.4 -89.6 128.2 56.6 20.2 70.6 35 35 A I E -F 94 0B 0 -2,-0.5 17,-2.4 59,-0.2 2,-0.3 -0.773 19.6-173.6 -97.4 140.7 58.0 17.0 69.1 36 36 A N E -FG 93 51B 0 57,-3.5 57,-2.7 -2,-0.4 2,-0.4 -0.924 12.3-149.4-127.7 153.2 55.8 14.3 67.5 37 37 A W E +FG 92 50B 1 13,-2.5 12,-3.1 -2,-0.3 13,-1.5 -0.990 18.2 171.7-127.2 130.0 56.5 10.8 66.2 38 38 A Y E -FG 91 48B 1 53,-2.7 53,-3.5 -2,-0.4 2,-0.3 -0.867 10.2-162.6-127.8 162.4 54.6 9.1 63.4 39 39 A R E -FG 90 47B 23 8,-1.8 8,-2.7 -2,-0.3 2,-0.5 -0.982 14.9-144.6-147.7 158.8 55.3 5.9 61.6 40 40 A K E +F 89 0B 38 49,-2.8 49,-2.6 -2,-0.3 2,-0.3 -0.983 28.0 165.2-127.2 116.4 54.4 4.0 58.4 41 41 A T E -F 88 0B 15 3,-2.3 47,-0.2 -2,-0.5 44,-0.1 -0.803 50.3 -73.7-123.5 166.6 54.0 0.3 58.5 42 42 A Q S S+ 0 0 103 45,-0.6 2,-1.4 -2,-0.3 45,-0.0 -0.393 118.8 7.0 -62.0 136.1 52.5 -2.2 56.1 43 43 A G S S+ 0 0 46 -2,-0.1 2,-0.6 -3,-0.0 -1,-0.2 -0.625 123.4 64.9 93.4 -76.8 48.8 -1.9 56.3 44 44 A N S S- 0 0 102 -2,-1.4 -3,-2.3 3,-0.0 2,-0.4 -0.729 73.4-159.4 -88.0 119.8 48.6 1.2 58.5 45 45 A T - 0 0 35 -2,-0.6 -5,-0.2 1,-0.2 275,-0.1 -0.832 60.0 -10.2-107.1 136.7 50.0 4.4 57.0 46 46 A M S S+ 0 0 5 -2,-0.4 274,-0.4 1,-0.2 2,-0.3 0.952 79.7 179.4 44.9 71.2 51.3 7.5 58.7 47 47 A T E -G 39 0B 35 -8,-2.7 -8,-1.8 -3,-0.3 2,-0.4 -0.755 30.5-111.8-101.7 148.9 49.9 6.7 62.2 48 48 A F E +G 38 0B 25 -2,-0.3 -10,-0.2 -10,-0.2 9,-0.1 -0.634 39.9 164.7 -80.0 131.0 50.4 9.0 65.2 49 49 A I E - 0 0 0 -12,-3.1 8,-1.5 -2,-0.4 2,-0.3 0.798 56.4 -1.2-111.3 -56.2 52.7 7.6 67.9 50 50 A Y E -GH 37 56B 9 -13,-1.5 -13,-2.5 6,-0.2 2,-0.4 -0.994 45.6-170.1-144.7 148.7 53.8 10.3 70.4 51 51 A R E > -GH 36 55B 8 4,-2.0 4,-1.5 -2,-0.3 -15,-0.2 -0.996 55.5 -64.1-138.6 131.2 53.4 14.0 71.1 52 52 A E T 4 S+ 0 0 23 -17,-2.4 -18,-0.1 -2,-0.4 -16,-0.1 0.359 111.5 13.9 -14.1 120.0 55.4 16.0 73.6 53 53 A K T 4 S- 0 0 142 1,-0.1 3,-0.1 2,-0.1 14,-0.1 0.971 131.2 -35.5 66.3 95.2 54.7 14.8 77.2 54 54 A D T 4 S+ 0 0 106 12,-0.2 2,-0.8 1,-0.1 -1,-0.1 0.458 88.2 141.4 46.1 11.6 52.9 11.5 77.7 55 55 A I E < +H 51 0B 26 -4,-1.5 -4,-2.0 6,-0.0 2,-0.3 -0.719 24.7 171.9 -89.9 114.5 50.6 11.8 74.6 56 56 A Y E -H 50 0B 37 -2,-0.8 -6,-0.2 -6,-0.2 -7,-0.1 -0.818 30.7-120.8-119.3 154.9 50.3 8.4 73.0 57 57 A G >> - 0 0 4 -8,-1.5 3,-2.3 -2,-0.3 4,-0.6 -0.488 60.1 -63.0 -86.3 165.2 48.1 7.0 70.2 58 58 A P T 34 S+ 0 0 136 0, 0.0 -1,-0.2 0, 0.0 -10,-0.0 -0.244 124.5 2.3 -51.4 115.9 45.8 4.1 70.8 59 59 A G T 34 S+ 0 0 59 -3,-0.1 4,-0.4 -2,-0.1 5,-0.0 0.652 105.7 97.2 83.0 15.9 48.0 1.2 71.8 60 60 A F T <> + 0 0 22 -3,-2.3 4,-2.5 2,-0.1 -11,-0.0 0.619 65.6 70.7-109.3 -15.5 51.4 2.9 71.7 61 61 A K T < S+ 0 0 121 -4,-0.6 -1,-0.1 2,-0.2 -7,-0.0 0.870 98.0 51.7 -68.8 -35.9 51.9 3.7 75.4 62 62 A D T 4 S+ 0 0 125 1,-0.1 -1,-0.2 3,-0.0 -2,-0.1 0.945 124.0 24.2 -65.0 -51.1 52.4 0.0 76.2 63 63 A N T 4 S+ 0 0 40 -4,-0.4 17,-2.5 17,-0.1 18,-0.5 0.788 119.9 53.4 -88.7 -31.0 55.1 -0.7 73.6 64 64 A F E < -D 79 0A 5 -4,-2.5 2,-0.3 15,-0.2 15,-0.2 -0.683 54.6-167.5-109.2 162.9 56.6 2.7 73.0 65 65 A Q E -D 78 0A 89 13,-1.6 13,-2.6 -2,-0.2 2,-0.2 -0.838 8.1-161.5-151.0 108.3 58.1 5.5 75.1 66 66 A G E +D 77 0A 5 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.495 19.6 154.7 -88.0 159.0 58.9 9.0 73.8 67 67 A D E -D 76 0A 82 9,-2.2 9,-2.7 -2,-0.2 2,-0.4 -0.964 31.8-126.0-171.9 163.2 61.2 11.5 75.5 68 68 A I E -D 75 0A 24 -2,-0.3 2,-0.7 7,-0.2 7,-0.2 -0.976 3.0-153.3-127.1 139.4 63.4 14.5 74.8 69 69 A D E > > +D 74 0A 72 5,-2.3 3,-1.7 -2,-0.4 5,-1.5 -0.696 15.9 179.5-109.0 74.4 67.0 15.1 75.6 70 70 A I G > 5 + 0 0 106 -2,-0.7 3,-1.3 1,-0.3 -40,-0.2 0.734 69.8 82.6 -47.1 -27.2 67.1 18.9 75.8 71 71 A A G 3 5S+ 0 0 81 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.0 0.926 115.8 7.9 -44.7 -54.6 70.8 18.5 76.6 72 72 A K G < 5S- 0 0 168 -3,-1.7 -1,-0.3 2,-0.1 -47,-0.2 -0.371 109.6-100.6-128.7 55.4 71.5 18.3 72.9 73 73 A N T < 5 + 0 0 39 -3,-1.3 -48,-2.0 1,-0.1 2,-0.4 0.787 69.7 158.3 27.4 56.9 68.1 19.1 71.3 74 74 A L E < -CD 24 69A 40 -5,-1.5 -5,-2.3 -50,-0.2 2,-0.5 -0.842 35.6-152.6-109.4 142.6 67.4 15.4 70.7 75 75 A A E -CD 23 68A 0 -52,-2.6 -52,-1.5 -2,-0.4 2,-0.4 -0.956 22.5-171.4-111.0 125.7 64.0 13.8 70.1 76 76 A V E -CD 22 67A 27 -9,-2.7 -9,-2.2 -2,-0.5 2,-0.4 -0.921 19.5-176.2-125.2 149.3 63.9 10.1 71.2 77 77 A L E -CD 21 66A 0 -56,-2.7 -56,-3.5 -2,-0.4 2,-0.5 -0.967 15.0-156.0-139.8 117.2 61.5 7.3 70.9 78 78 A K E -CD 20 65A 82 -13,-2.6 -13,-1.6 -2,-0.4 2,-0.7 -0.833 4.7-152.3 -99.7 131.1 62.3 3.9 72.5 79 79 A I E -CD 19 64A 1 -60,-4.0 -60,-2.6 -2,-0.5 -15,-0.2 -0.915 12.7-173.6-100.2 117.9 60.7 0.8 71.2 80 80 A L S S+ 0 0 55 -17,-2.5 -1,-0.2 -2,-0.7 -16,-0.1 0.962 73.9 16.0 -78.3 -56.0 60.5 -1.6 74.2 81 81 A A S S- 0 0 47 -18,-0.5 -1,-0.2 -64,-0.1 -66,-0.1 -0.684 79.4-156.8-124.5 80.7 59.3 -4.9 72.6 82 82 A P + 0 0 3 0, 0.0 -66,-2.0 0, 0.0 2,-0.3 -0.089 19.4 168.4 -52.7 150.3 59.7 -4.8 68.8 83 83 A S > - 0 0 14 -68,-0.2 3,-1.4 1,-0.1 4,-0.2 -0.868 52.6 -82.8-150.4-178.9 57.6 -7.2 66.8 84 84 A E G > S+ 0 0 55 1,-0.3 3,-2.5 -2,-0.3 33,-0.2 0.958 125.0 59.9 -56.5 -51.3 56.6 -7.7 63.1 85 85 A R G 3 S+ 0 0 170 1,-0.3 -1,-0.3 -44,-0.1 -43,-0.0 0.644 96.5 63.6 -53.3 -15.8 54.0 -5.0 63.3 86 86 A D G < S+ 0 0 8 -3,-1.4 2,-0.4 -45,-0.1 -1,-0.3 0.467 74.2 109.2 -91.9 -0.4 56.7 -2.5 64.3 87 87 A E < + 0 0 87 -3,-2.5 -45,-0.6 -4,-0.2 2,-0.3 -0.625 53.3 72.9 -78.9 127.9 58.7 -2.7 61.0 88 88 A G E S-FI 41 115B 13 27,-1.5 27,-3.3 -2,-0.4 2,-0.4 -0.983 84.8 -45.0 164.2-159.8 58.3 0.4 58.9 89 89 A S E -FI 40 114B 31 -49,-2.6 -49,-2.8 -2,-0.3 2,-0.5 -0.814 43.5-153.2-104.3 145.1 59.5 4.0 58.7 90 90 A Y E -FI 39 113B 0 23,-2.2 23,-1.7 -2,-0.4 2,-0.4 -0.973 9.8-163.5-121.8 128.8 59.5 6.4 61.7 91 91 A Y E -F 38 0B 20 -53,-3.5 -53,-2.7 -2,-0.5 2,-0.5 -0.902 9.0-153.4-117.6 139.4 59.2 10.1 61.4 92 92 A a E +F 37 0B 0 -2,-0.4 18,-1.2 19,-0.3 2,-0.4 -0.910 19.5 177.0-108.8 131.2 59.9 12.9 63.8 93 93 A A E -FJ 36 109B 0 -57,-2.7 -57,-3.5 -2,-0.5 2,-0.2 -0.987 6.3-170.1-135.6 144.4 58.0 16.2 63.4 94 94 A C E -FJ 35 108B 0 14,-2.1 14,-2.0 -2,-0.4 2,-0.3 -0.709 3.1-176.1-124.9 177.2 58.0 19.4 65.5 95 95 A D E -F 34 0B 7 -61,-0.6 -61,-1.9 -2,-0.2 12,-0.1 -0.981 28.8 -88.5-168.6 162.7 56.0 22.6 65.7 96 96 A T - 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