==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 30-SEP-06 2DZU . COMPND 2 MOLECULE: TRYPTOPHAN SYNTHASE ALPHA CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS FURIOSUS; . AUTHOR K.OGASAHARA,Y.YAMAGATA,K.YUTANI,RIKEN STRUCTURAL . 489 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21204.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 370 75.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 76 15.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 17 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 64 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 192 39.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.0 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 0 0 0 2 0 2 6 5 4 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 4 10 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 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 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 M 0 0 19 0, 0.0 2,-0.3 0, 0.0 435,-0.1 0.000 360.0 360.0 360.0 -8.2 43.2 26.8 68.3 2 2 A F - 0 0 0 433,-0.3 32,-0.1 79,-0.1 2,-0.1 -0.868 360.0 -88.4-135.3 166.8 46.0 25.0 70.1 3 3 A K > - 0 0 76 -2,-0.3 3,-1.4 30,-0.2 432,-0.2 -0.406 53.2 -97.1 -71.7 148.8 49.8 24.5 70.0 4 4 A D T 3 S+ 0 0 39 430,-0.4 209,-0.2 1,-0.3 208,-0.1 -0.429 113.2 31.4 -65.8 139.4 51.2 21.8 67.8 5 5 A G T 3 S+ 0 0 43 207,-2.7 -1,-0.3 206,-0.3 208,-0.2 0.559 89.0 154.8 88.2 8.3 51.9 18.7 69.9 6 6 A S E < -a 213 0A 12 -3,-1.4 208,-2.9 206,-1.1 2,-0.5 -0.417 40.5-142.4 -73.5 142.0 49.0 19.5 72.2 7 7 A L E -ab 214 32A 4 24,-0.6 26,-2.2 206,-0.2 27,-0.7 -0.885 19.3-155.9 -99.5 133.3 47.2 16.8 74.2 8 8 A I E -a 215 0A 1 206,-3.6 208,-2.7 -2,-0.5 27,-0.2 -0.888 3.5-147.1-120.5 102.8 43.5 17.7 74.3 9 9 A P E -a 216 0A 1 0, 0.0 27,-3.0 0, 0.0 2,-0.5 -0.366 7.9-158.1 -67.0 140.8 41.4 16.3 77.2 10 10 A Y E +c 36 0A 4 206,-2.5 2,-0.3 25,-0.2 27,-0.2 -0.989 16.1 172.7-120.1 129.7 37.8 15.4 76.5 11 11 A L E -c 37 0A 1 25,-2.3 27,-3.4 -2,-0.5 2,-0.6 -0.971 32.3-122.1-135.1 149.0 35.3 15.3 79.5 12 12 A T E > -c 38 0A 2 -2,-0.3 3,-1.3 25,-0.2 27,-0.2 -0.817 36.9-114.7 -91.5 125.1 31.6 14.8 79.6 13 13 A A T 3 S+ 0 0 0 25,-3.7 5,-0.1 -2,-0.6 55,-0.1 -0.379 97.5 15.2 -61.0 128.3 29.9 17.7 81.4 14 14 A G T 3 S+ 0 0 3 3,-0.3 4,-0.3 1,-0.2 -1,-0.2 0.706 81.7 166.4 82.6 22.3 28.3 16.6 84.7 15 15 A D S < S- 0 0 1 -3,-1.3 -1,-0.2 2,-0.3 -3,-0.1 -0.894 89.3 -17.6-115.0 103.4 30.0 13.2 85.0 16 16 A P S S- 0 0 21 0, 0.0 2,-0.3 0, 0.0 -1,-0.3 -0.996 144.6 -23.4 -84.1 -14.5 29.4 12.4 87.8 17 17 A D > - 0 0 42 1,-0.1 4,-2.2 211,-0.0 3,-0.4 -0.983 59.5-108.6-155.7 152.8 28.5 16.0 88.7 18 18 A K H > S+ 0 0 65 -2,-0.3 4,-2.1 -4,-0.3 5,-0.2 0.843 117.1 55.7 -53.4 -37.4 29.3 19.4 87.4 19 19 A Q H > S+ 0 0 76 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.924 108.5 47.3 -63.6 -42.6 31.5 20.2 90.4 20 20 A S H > S+ 0 0 0 -3,-0.4 4,-2.8 2,-0.2 -1,-0.2 0.896 107.8 56.0 -65.1 -39.1 33.7 17.1 89.8 21 21 A T H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.937 108.0 48.9 -57.1 -45.9 33.9 18.0 86.1 22 22 A L H X S+ 0 0 13 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.907 110.0 51.8 -60.0 -43.0 35.3 21.4 87.1 23 23 A N H X S+ 0 0 58 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.922 109.7 49.1 -59.7 -46.1 37.8 19.7 89.5 24 24 A F H X S+ 0 0 1 -4,-2.8 4,-1.8 1,-0.2 -2,-0.2 0.934 110.3 51.0 -60.3 -46.5 39.0 17.4 86.7 25 25 A L H X S+ 0 0 1 -4,-2.6 4,-1.2 1,-0.2 3,-0.2 0.921 110.5 48.4 -57.9 -46.2 39.5 20.3 84.3 26 26 A L H < S+ 0 0 60 -4,-2.4 4,-0.4 1,-0.2 -1,-0.2 0.871 111.4 50.1 -63.4 -37.4 41.5 22.3 86.8 27 27 A A H < S+ 0 0 19 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.793 117.2 39.8 -72.7 -27.0 43.7 19.2 87.6 28 28 A L H >X S+ 0 0 2 -4,-1.8 3,-1.9 -3,-0.2 4,-0.9 0.517 88.1 93.1 -99.6 -7.3 44.4 18.5 83.9 29 29 A D G >< S+ 0 0 34 -4,-1.2 3,-1.2 1,-0.3 -1,-0.1 0.886 77.0 62.6 -53.7 -44.3 44.8 22.1 82.7 30 30 A E G 34 S+ 0 0 147 -4,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.656 110.9 40.3 -59.0 -14.3 48.6 22.1 83.1 31 31 A Y G <4 S+ 0 0 27 -3,-1.9 -24,-0.6 -25,-0.0 2,-0.3 0.535 99.1 98.1-108.1 -12.1 48.8 19.3 80.5 32 32 A A B << -b 7 0A 17 -3,-1.2 -24,-0.2 -4,-0.9 3,-0.1 -0.575 44.7-174.2 -88.9 140.7 46.2 20.6 78.1 33 33 A G S S- 0 0 13 -26,-2.2 2,-0.3 1,-0.5 -30,-0.2 0.653 86.7 -19.4 -94.4 -21.9 46.7 22.6 74.9 34 34 A A S S- 0 0 1 -27,-0.7 -1,-0.5 47,-0.1 2,-0.4 -0.942 70.0-125.4-170.2 170.4 42.9 22.9 74.7 35 35 A I E - d 0 83A 1 47,-2.4 49,-3.2 -2,-0.3 2,-0.6 -0.996 2.5-150.8-139.6 138.8 39.8 21.1 76.2 36 36 A E E -cd 10 84A 0 -27,-3.0 -25,-2.3 -2,-0.4 2,-0.6 -0.927 13.5-167.3-105.9 121.3 36.7 19.5 74.8 37 37 A L E -cd 11 85A 0 47,-2.7 49,-3.0 -2,-0.6 2,-0.4 -0.939 13.0-148.6-110.3 115.6 33.7 19.6 77.1 38 38 A G E -cd 12 86A 1 -27,-3.4 -25,-3.7 -2,-0.6 49,-0.2 -0.703 5.4-141.5 -92.4 135.3 30.9 17.4 76.0 39 39 A I - 0 0 3 47,-3.2 49,-0.3 -2,-0.4 -25,-0.1 -0.806 30.3-120.8 -89.7 120.3 27.3 18.1 76.6 40 40 A P - 0 0 7 0, 0.0 2,-0.3 0, 0.0 25,-0.1 -0.349 31.7-170.9 -66.0 141.6 25.5 14.8 77.5 41 41 A F - 0 0 31 1,-0.1 18,-0.1 11,-0.1 17,-0.1 -0.953 32.7-122.2-132.7 150.2 22.6 13.7 75.2 42 42 A S S S+ 0 0 67 -2,-0.3 -1,-0.1 1,-0.3 14,-0.0 0.861 108.7 34.6 -60.0 -36.0 20.1 10.9 75.5 43 43 A D + 0 0 96 -3,-0.0 2,-2.3 12,-0.0 -1,-0.3 -0.604 62.5 169.5-123.8 73.4 21.2 9.3 72.2 44 44 A P > + 0 0 1 0, 0.0 3,-1.6 0, 0.0 11,-0.1 -0.345 17.2 155.4 -79.9 61.9 24.9 9.7 71.6 45 45 A I T 3 + 0 0 135 -2,-2.3 7,-0.0 1,-0.3 -2,-0.0 0.561 65.4 59.2 -67.5 -9.7 24.9 7.3 68.7 46 46 A A T 3 S+ 0 0 53 -3,-0.2 -1,-0.3 2,-0.1 2,-0.2 0.564 95.5 82.7 -94.5 -9.5 28.0 8.8 67.1 47 47 A D S < S- 0 0 18 -3,-1.6 2,-0.1 1,-0.1 118,-0.0 -0.514 81.8-107.2 -95.4 162.7 30.1 8.0 70.2 48 48 A G > - 0 0 35 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.313 41.8 -94.8 -79.1 168.3 31.8 4.9 71.4 49 49 A K H > S+ 0 0 149 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.901 120.5 52.6 -48.9 -54.0 30.6 2.7 74.3 50 50 A T H > S+ 0 0 47 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.931 114.9 39.5 -51.9 -54.2 32.8 4.3 76.9 51 51 A I H > S+ 0 0 18 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.817 110.4 59.4 -70.6 -28.9 31.7 7.9 76.2 52 52 A Q H X S+ 0 0 46 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.893 105.1 50.9 -64.9 -37.0 28.1 6.9 75.6 53 53 A E H X S+ 0 0 74 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.805 104.3 56.6 -69.5 -28.8 28.0 5.6 79.2 54 54 A S H X S+ 0 0 0 -4,-1.1 4,-2.1 2,-0.2 -1,-0.2 0.827 106.8 50.8 -71.4 -29.6 29.4 8.8 80.5 55 55 A H H X S+ 0 0 4 -4,-1.4 4,-2.3 2,-0.2 5,-0.2 0.927 110.3 48.9 -70.2 -44.4 26.5 10.6 78.8 56 56 A Y H X S+ 0 0 96 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.927 111.5 49.8 -60.1 -46.5 24.1 8.1 80.5 57 57 A R H X S+ 0 0 64 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.955 110.9 49.0 -57.3 -52.3 25.7 8.7 83.9 58 58 A A H <>S+ 0 0 0 -4,-2.1 5,-2.3 1,-0.2 -1,-0.2 0.881 114.4 44.2 -56.1 -44.9 25.6 12.5 83.6 59 59 A L H ><5S+ 0 0 61 -4,-2.3 3,-2.3 3,-0.2 -1,-0.2 0.946 111.8 52.9 -67.5 -47.5 21.9 12.6 82.6 60 60 A K H 3<5S+ 0 0 183 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.914 106.7 52.9 -52.6 -46.2 21.0 10.0 85.3 61 61 A N T 3<5S- 0 0 105 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.302 129.9 -99.1 -74.2 10.3 22.6 12.2 87.9 62 62 A G T < 5 - 0 0 31 -3,-2.3 -3,-0.2 1,-0.2 -2,-0.2 0.822 52.9-178.3 80.6 34.4 20.5 15.0 86.6 63 63 A F < - 0 0 14 -5,-2.3 2,-0.4 -6,-0.1 -1,-0.2 -0.383 9.3-158.0 -66.6 144.3 22.8 17.1 84.3 64 64 A K > - 0 0 136 1,-0.1 3,-3.2 -2,-0.1 4,-0.5 -0.990 24.0-115.6-128.8 132.7 21.1 20.1 82.8 65 65 A L T > S+ 0 0 35 -2,-0.4 3,-2.2 1,-0.3 4,-0.3 0.761 111.1 47.1 -25.3 -69.0 22.2 21.9 79.6 66 66 A R T 3> S+ 0 0 124 1,-0.3 4,-1.3 2,-0.2 -1,-0.3 0.506 91.5 80.1 -63.9 -3.7 23.3 25.3 81.1 67 67 A E H <> S+ 0 0 53 -3,-3.2 4,-2.1 1,-0.2 -1,-0.3 0.769 85.2 64.7 -71.4 -23.1 25.3 23.6 83.9 68 68 A A H <> S+ 0 0 0 -3,-2.2 4,-2.1 -4,-0.5 -1,-0.2 0.879 100.0 49.1 -64.8 -38.2 27.9 23.2 81.1 69 69 A F H > S+ 0 0 12 -4,-0.3 4,-3.2 -3,-0.2 -1,-0.2 0.872 106.0 57.3 -68.6 -36.7 28.2 27.0 81.0 70 70 A W H X S+ 0 0 74 -4,-1.3 4,-2.7 1,-0.2 5,-0.3 0.956 107.2 48.9 -56.5 -50.1 28.6 27.1 84.7 71 71 A I H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.919 113.8 44.7 -55.0 -50.8 31.6 24.7 84.4 72 72 A V H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.926 112.7 52.3 -61.3 -45.8 33.2 26.8 81.7 73 73 A K H X S+ 0 0 107 -4,-3.2 4,-0.6 1,-0.2 -2,-0.2 0.916 112.5 43.5 -58.1 -48.4 32.5 30.1 83.6 74 74 A E H >< S+ 0 0 42 -4,-2.7 3,-0.8 -5,-0.2 4,-0.5 0.866 112.0 54.4 -66.4 -37.0 34.1 28.8 86.8 75 75 A F H >X S+ 0 0 0 -4,-2.1 3,-2.1 -5,-0.3 4,-1.6 0.919 100.1 61.6 -61.9 -43.6 37.0 27.3 84.9 76 76 A R H 3< S+ 0 0 59 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.691 89.6 69.0 -57.5 -22.2 37.7 30.7 83.3 77 77 A R T << S+ 0 0 152 -3,-0.8 -1,-0.3 -4,-0.6 -2,-0.2 0.801 115.7 25.9 -67.4 -26.8 38.4 32.2 86.7 78 78 A H T <4 S+ 0 0 129 -3,-2.1 2,-0.3 -4,-0.5 -2,-0.2 0.575 126.3 31.1-112.0 -15.1 41.5 30.1 86.8 79 79 A S < - 0 0 16 -4,-1.6 -1,-0.2 2,-0.1 -53,-0.0 -0.992 39.5-161.3-150.6 156.5 42.4 29.5 83.1 80 80 A S + 0 0 86 -2,-0.3 3,-0.1 -3,-0.1 -4,-0.1 0.060 46.9 142.5-117.3 19.8 42.4 30.8 79.6 81 81 A T - 0 0 12 1,-0.1 -47,-0.1 -47,-0.1 -48,-0.1 -0.460 64.0 -97.5 -65.1 127.5 42.9 27.4 78.0 82 82 A P - 0 0 8 0, 0.0 -47,-2.4 0, 0.0 2,-0.4 -0.139 42.5-157.6 -48.0 134.5 40.9 27.1 74.8 83 83 A I E -d 35 0A 1 25,-0.3 27,-2.3 -49,-0.2 28,-1.9 -0.975 10.8-165.9-124.7 129.0 37.6 25.3 75.3 84 84 A V E -de 36 111A 1 -49,-3.2 -47,-2.7 -2,-0.4 2,-0.5 -0.950 15.4-143.8-112.1 125.5 35.5 23.6 72.7 85 85 A L E -de 37 112A 0 26,-2.5 28,-2.8 -2,-0.5 2,-0.5 -0.787 15.7-157.7 -88.4 126.2 31.9 22.7 73.6 86 86 A M E +de 38 113A 13 -49,-3.0 -47,-3.2 -2,-0.5 2,-0.3 -0.927 26.0 148.6-108.3 126.8 31.0 19.4 72.0 87 87 A T E - e 0 114A 1 26,-2.7 28,-2.2 -2,-0.5 29,-0.3 -0.964 46.3-108.3-152.2 167.2 27.3 18.6 71.5 88 88 A Y > - 0 0 3 -2,-0.3 4,-0.8 -49,-0.3 29,-0.0 -0.626 40.0-115.2 -91.7 157.6 24.6 17.0 69.5 89 89 A Y H >> S+ 0 0 19 -2,-0.2 4,-2.8 1,-0.2 3,-0.6 0.906 101.7 74.6 -61.9 -46.7 22.3 19.3 67.4 90 90 A N H 3> S+ 0 0 72 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.827 95.9 47.6 -34.2 -59.4 19.1 18.5 69.2 91 91 A P H 3> S+ 0 0 16 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.922 116.8 43.3 -54.2 -47.5 19.9 20.6 72.4 92 92 A I H S+ 0 0 18 -4,-0.2 4,-2.8 1,-0.2 5,-0.2 0.911 110.4 39.3 -43.9 -65.3 21.1 28.3 67.8 98 98 A R H > S+ 0 0 103 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.896 115.5 53.3 -57.3 -43.0 22.1 32.0 68.2 99 99 A N H > S+ 0 0 110 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.933 112.3 45.2 -57.5 -47.2 20.9 32.1 71.8 100 100 A F H X S+ 0 0 1 -4,-3.0 4,-2.5 -8,-0.2 -2,-0.2 0.942 113.8 48.0 -62.5 -49.2 23.0 29.1 72.6 101 101 A L H X S+ 0 0 0 -4,-2.8 4,-2.9 -5,-0.2 -2,-0.2 0.897 113.4 47.8 -59.5 -42.9 26.1 30.4 70.8 102 102 A A H X S+ 0 0 35 -4,-2.8 4,-2.9 -5,-0.2 -1,-0.2 0.942 113.4 47.4 -63.3 -46.9 25.8 33.8 72.4 103 103 A E H X S+ 0 0 67 -4,-2.5 4,-1.3 -5,-0.3 -2,-0.2 0.849 112.6 51.0 -63.2 -34.0 25.4 32.2 75.8 104 104 A A H X>S+ 0 0 1 -4,-2.5 5,-2.1 2,-0.2 4,-0.9 0.958 110.9 47.0 -67.6 -51.4 28.4 29.9 75.1 105 105 A K H ><5S+ 0 0 97 -4,-2.9 3,-1.9 1,-0.2 -2,-0.2 0.959 109.4 54.2 -53.1 -55.5 30.6 32.8 74.1 106 106 A A H 3<5S+ 0 0 88 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.803 106.5 52.8 -50.2 -34.8 29.6 34.8 77.1 107 107 A S H 3<5S- 0 0 10 -4,-1.3 -1,-0.3 -3,-0.4 -31,-0.3 0.670 128.3 -92.6 -79.0 -16.9 30.6 31.9 79.4 108 108 A G T <<5S+ 0 0 18 -3,-1.9 -25,-0.3 -4,-0.9 -3,-0.2 0.429 72.4 148.3 121.0 0.0 34.1 31.6 77.9 109 109 A V < - 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