==== 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 2DZP . 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) . 21381.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 372 76.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 74 15.1 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 . 1 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 . 22 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 60 12.3 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 . 9 1.8 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 0 0 0 2 0 2 6 7 4 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 1 1 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 24 0, 0.0 2,-0.3 0, 0.0 435,-0.1 0.000 360.0 360.0 360.0 -20.9 43.4 27.1 67.8 2 2 A F - 0 0 0 433,-0.3 32,-0.1 79,-0.1 3,-0.1 -0.905 360.0 -92.8-132.5 159.3 46.1 25.1 69.6 3 3 A K > - 0 0 71 -2,-0.3 3,-1.4 30,-0.3 432,-0.2 -0.281 50.3 -97.5 -66.3 151.1 49.8 24.6 69.5 4 4 A D T 3 S+ 0 0 41 430,-0.5 209,-0.2 427,-0.3 208,-0.1 -0.411 112.4 32.4 -68.0 147.9 51.3 21.8 67.3 5 5 A G T 3 S+ 0 0 47 207,-1.7 -1,-0.2 206,-0.3 208,-0.2 0.444 91.0 157.4 84.1 -0.5 52.0 18.7 69.3 6 6 A S E < -a 213 0A 10 -3,-1.4 208,-3.5 206,-1.0 2,-0.5 -0.245 40.5-143.9 -65.3 143.5 49.1 19.5 71.6 7 7 A L E -a 214 0A 7 24,-0.5 26,-2.0 206,-0.2 27,-0.8 -0.924 18.0-155.6-102.8 124.5 47.2 16.9 73.7 8 8 A I E -a 215 0A 4 206,-3.7 208,-1.9 -2,-0.5 27,-0.2 -0.787 4.9-149.1-112.3 92.5 43.6 17.9 73.7 9 9 A P E -a 216 0A 1 0, 0.0 27,-2.7 0, 0.0 2,-0.4 -0.248 11.1-160.7 -57.6 134.3 41.7 16.6 76.8 10 10 A Y E +b 36 0A 2 206,-2.1 2,-0.3 25,-0.2 27,-0.2 -0.972 14.4 170.2-120.1 138.1 38.0 15.8 76.2 11 11 A L E -b 37 0A 0 25,-2.2 27,-3.1 -2,-0.4 2,-0.5 -0.979 33.5-117.5-143.8 152.1 35.4 15.5 79.0 12 12 A T E > -b 38 0A 2 -2,-0.3 3,-0.8 25,-0.2 2,-0.3 -0.782 38.6-110.0 -93.1 132.5 31.7 15.2 79.1 13 13 A A T 3 S+ 0 0 0 25,-3.3 5,-0.2 -2,-0.5 55,-0.1 -0.456 100.2 15.3 -63.5 121.3 30.0 18.1 80.9 14 14 A G T 3 S+ 0 0 3 3,-0.4 4,-0.3 -2,-0.3 -1,-0.2 0.894 76.3 166.7 84.0 43.0 28.6 16.8 84.2 15 15 A D S < S- 0 0 3 -3,-0.8 -1,-0.2 2,-0.4 2,-0.1 -0.852 94.3 -17.1-131.3 96.1 30.4 13.4 84.7 16 16 A P S S- 0 0 18 0, 0.0 2,-0.3 0, 0.0 45,-0.1 -0.874 144.6 -23.0 -75.0 -40.0 29.7 13.0 87.5 17 17 A N >> - 0 0 36 -2,-0.1 4,-2.1 1,-0.1 3,-0.9 -0.938 58.1-108.3-135.1 158.5 28.7 16.6 88.2 18 18 A K H 3> S+ 0 0 83 -2,-0.3 4,-2.2 1,-0.3 5,-0.2 0.881 119.8 51.6 -49.2 -47.4 29.4 20.0 86.7 19 19 A Q H 3> S+ 0 0 87 1,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.831 110.3 51.0 -61.5 -31.2 31.6 21.1 89.7 20 20 A S H <> S+ 0 0 3 -3,-0.9 4,-2.2 2,-0.2 -1,-0.2 0.859 105.9 53.3 -74.0 -37.1 33.5 17.8 89.2 21 21 A T H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.945 108.2 51.4 -61.9 -46.2 34.1 18.4 85.5 22 22 A L H X S+ 0 0 7 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.874 108.0 53.5 -57.2 -38.9 35.5 21.9 86.4 23 23 A N H X S+ 0 0 64 -4,-1.3 4,-0.6 2,-0.2 -1,-0.2 0.926 109.7 46.2 -63.6 -46.4 37.8 20.1 88.9 24 24 A F H >X S+ 0 0 1 -4,-2.2 3,-0.9 2,-0.2 4,-0.9 0.930 111.8 51.6 -62.3 -47.2 39.2 17.7 86.3 25 25 A L H >X S+ 0 0 6 -4,-2.6 4,-1.4 1,-0.3 3,-1.4 0.934 109.1 48.8 -55.1 -51.8 39.8 20.5 83.7 26 26 A L H 3< S+ 0 0 67 -4,-2.3 -1,-0.3 1,-0.3 4,-0.3 0.644 111.8 54.0 -64.3 -13.2 41.7 22.6 86.1 27 27 A A H << S+ 0 0 17 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.586 113.0 38.6 -96.2 -14.1 43.7 19.5 86.9 28 28 A L H XX S+ 0 0 3 -3,-1.4 3,-1.9 -4,-0.9 4,-1.6 0.484 87.3 94.9-113.1 -7.1 44.7 18.7 83.3 29 29 A D G >< S+ 0 0 36 -4,-1.4 3,-0.6 1,-0.3 -3,-0.1 0.910 75.0 64.5 -51.0 -50.6 45.3 22.2 82.1 30 30 A E G 34 S+ 0 0 143 1,-0.3 -1,-0.3 -4,-0.3 -2,-0.1 0.646 114.1 33.9 -50.7 -17.7 49.1 22.1 82.7 31 31 A Y G <4 S+ 0 0 27 -3,-1.9 -24,-0.5 -25,-0.0 -1,-0.3 0.625 102.2 95.4-110.0 -23.0 49.3 19.3 80.1 32 32 A A << - 0 0 18 -4,-1.6 -24,-0.2 -3,-0.6 3,-0.1 -0.306 46.0-171.6 -74.9 153.2 46.6 20.5 77.7 33 33 A G S S- 0 0 11 -26,-2.0 -30,-0.3 1,-0.6 2,-0.3 0.474 85.3 -7.8-111.4 -17.6 47.0 22.6 74.6 34 34 A A - 0 0 2 -27,-0.8 -1,-0.6 47,-0.1 2,-0.4 -0.952 69.2-129.2-170.6 159.4 43.3 22.9 74.3 35 35 A I E - c 0 83A 2 47,-2.1 49,-2.5 -2,-0.3 2,-0.5 -0.960 8.3-156.9-125.8 142.2 40.1 21.5 76.0 36 36 A E E -bc 10 84A 3 -27,-2.7 -25,-2.2 -2,-0.4 2,-0.6 -0.968 9.4-164.8-120.2 118.8 37.0 19.9 74.5 37 37 A L E -bc 11 85A 2 47,-2.6 49,-3.3 -2,-0.5 2,-0.3 -0.900 9.1-148.9-108.9 121.1 33.8 19.9 76.5 38 38 A G E -bc 12 86A 1 -27,-3.1 -25,-3.3 -2,-0.6 49,-0.2 -0.639 6.1-142.0 -92.3 144.6 30.9 17.7 75.5 39 39 A I - 0 0 1 47,-1.8 49,-0.3 -2,-0.3 16,-0.1 -0.901 28.7-123.7-102.7 110.0 27.3 18.4 76.0 40 40 A P - 0 0 7 0, 0.0 2,-0.3 0, 0.0 48,-0.1 -0.218 34.4-174.9 -54.9 140.1 25.4 15.2 77.0 41 41 A F - 0 0 27 1,-0.1 18,-0.1 11,-0.1 17,-0.0 -0.950 34.7-117.7-138.4 156.2 22.5 14.2 74.7 42 42 A S S S+ 0 0 72 -2,-0.3 -1,-0.1 1,-0.2 14,-0.0 0.926 106.8 33.5 -61.3 -48.3 19.8 11.6 74.5 43 43 A D + 0 0 102 -3,-0.1 2,-2.0 1,-0.1 -1,-0.2 -0.654 61.3 169.6-116.3 80.1 20.9 9.9 71.3 44 44 A P > + 0 0 2 0, 0.0 3,-0.7 0, 0.0 11,-0.1 -0.437 17.1 153.6 -83.2 63.4 24.7 10.0 70.9 45 45 A I T 3 + 0 0 140 -2,-2.0 7,-0.0 1,-0.2 -2,-0.0 0.586 67.2 58.0 -70.3 -10.2 24.6 7.7 67.9 46 46 A A T 3 S+ 0 0 51 -3,-0.2 -1,-0.2 2,-0.1 2,-0.1 0.751 93.5 80.9 -90.7 -26.5 27.8 9.2 66.6 47 47 A D S < S- 0 0 21 -3,-0.7 2,-0.1 1,-0.1 118,-0.0 -0.300 80.5-106.8 -82.2 164.4 29.9 8.4 69.6 48 48 A G > - 0 0 37 116,-0.1 4,-2.1 -2,-0.1 5,-0.2 -0.290 43.0 -90.1 -80.4 170.9 31.7 5.3 70.7 49 49 A K H > S+ 0 0 153 1,-0.2 4,-1.8 2,-0.2 3,-0.3 0.916 121.6 47.6 -45.6 -63.6 30.6 3.1 73.6 50 50 A T H > S+ 0 0 49 1,-0.2 4,-1.1 2,-0.2 3,-0.3 0.911 114.6 44.8 -50.2 -52.5 32.5 4.7 76.4 51 51 A I H > S+ 0 0 19 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.819 107.9 58.5 -66.0 -29.7 31.5 8.3 75.5 52 52 A Q H X S+ 0 0 42 -4,-2.1 4,-2.2 -3,-0.3 -1,-0.2 0.885 105.2 51.4 -66.0 -35.1 27.9 7.3 75.0 53 53 A E H X S+ 0 0 82 -4,-1.8 4,-1.8 -3,-0.3 -1,-0.2 0.784 103.4 57.5 -71.6 -26.8 27.9 6.1 78.6 54 54 A S H X S+ 0 0 0 -4,-1.1 4,-2.8 2,-0.2 -1,-0.2 0.864 109.1 46.2 -70.7 -34.8 29.3 9.4 79.9 55 55 A H H X S+ 0 0 4 -4,-1.5 4,-2.7 2,-0.2 5,-0.3 0.931 110.1 53.0 -69.4 -46.4 26.3 11.1 78.3 56 56 A Y H X S+ 0 0 101 -4,-2.2 4,-1.2 2,-0.2 -2,-0.2 0.855 114.3 44.5 -56.2 -36.5 24.0 8.5 79.8 57 57 A R H >X S+ 0 0 63 -4,-1.8 4,-2.7 2,-0.2 3,-0.8 0.987 110.0 51.2 -71.4 -61.8 25.6 9.3 83.2 58 58 A A H 3< S+ 0 0 1 -4,-2.8 -2,-0.2 1,-0.3 -3,-0.2 0.878 113.4 47.2 -40.7 -51.1 25.6 13.1 82.9 59 59 A L H >< S+ 0 0 67 -4,-2.7 3,-1.2 1,-0.2 4,-0.4 0.853 110.6 52.4 -63.0 -36.2 21.9 13.0 82.0 60 60 A K H << S+ 0 0 177 -4,-1.2 -2,-0.2 -3,-0.8 -1,-0.2 0.971 105.4 53.9 -62.5 -53.3 21.2 10.6 84.9 61 61 A N T 3< S- 0 0 93 -4,-2.7 -1,-0.3 -47,-0.2 -2,-0.2 0.292 129.6 -95.8 -66.2 11.9 22.9 12.9 87.4 62 62 A G < - 0 0 40 -3,-1.2 2,-0.3 -5,-0.2 -3,-0.2 0.983 55.3-178.6 70.8 84.7 20.6 15.7 86.2 63 63 A F - 0 0 19 -4,-0.4 2,-0.4 -46,-0.1 -1,-0.1 -0.857 10.2-159.7-115.3 150.5 22.3 17.8 83.5 64 64 A K >> - 0 0 128 -2,-0.3 3,-3.4 1,-0.1 4,-0.5 -0.991 31.7-113.5-132.9 139.6 20.9 20.9 81.7 65 65 A L T 34 S+ 0 0 30 -2,-0.4 3,-0.3 1,-0.3 4,-0.2 0.674 115.9 48.3 -39.8 -29.4 22.0 22.5 78.4 66 66 A R T 3> S+ 0 0 128 1,-0.2 4,-0.7 2,-0.1 -1,-0.3 0.301 86.8 81.7-101.3 10.4 23.2 25.6 80.2 67 67 A E H <> S+ 0 0 35 -3,-3.4 4,-1.4 1,-0.2 -1,-0.2 0.693 85.1 65.7 -82.7 -18.0 25.2 23.9 83.0 68 68 A A H X S+ 0 0 0 -4,-0.5 4,-1.6 -3,-0.3 -1,-0.2 0.874 95.5 53.6 -69.2 -40.0 28.0 23.6 80.4 69 69 A F H > S+ 0 0 9 -4,-0.2 4,-3.7 1,-0.2 -1,-0.2 0.874 104.4 56.6 -63.4 -36.7 28.5 27.4 80.2 70 70 A W H X S+ 0 0 74 -4,-0.7 4,-2.8 1,-0.2 5,-0.3 0.935 104.1 52.9 -58.3 -47.5 28.9 27.5 83.9 71 71 A I H X S+ 0 0 0 -4,-1.4 4,-1.5 1,-0.2 -1,-0.2 0.885 115.9 40.3 -54.0 -42.9 31.7 25.0 83.6 72 72 A V H X S+ 0 0 2 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.883 111.3 55.3 -74.8 -43.0 33.4 27.3 81.0 73 73 A K H X S+ 0 0 109 -4,-3.7 4,-0.8 1,-0.2 -2,-0.2 0.927 114.6 41.0 -56.4 -46.1 32.6 30.5 82.8 74 74 A E H < S+ 0 0 44 -4,-2.8 3,-0.2 -5,-0.2 -1,-0.2 0.827 110.3 56.9 -72.2 -35.6 34.3 29.2 86.0 75 75 A F H >X S+ 0 0 0 -4,-1.5 3,-2.0 -5,-0.3 4,-1.7 0.920 101.4 57.8 -62.7 -43.1 37.2 27.6 84.1 76 76 A R H 3< S+ 0 0 62 -4,-2.3 -1,-0.2 31,-0.3 -2,-0.2 0.833 87.7 74.7 -55.1 -36.2 38.1 31.0 82.5 77 77 A R T 3< S+ 0 0 152 -4,-0.8 -1,-0.3 1,-0.2 -2,-0.2 0.567 116.5 20.9 -55.7 -5.8 38.5 32.5 86.0 78 78 A H T <4 S+ 0 0 122 -3,-2.0 2,-0.3 1,-0.3 -1,-0.2 0.522 126.0 38.3-135.9 -21.3 41.7 30.5 86.0 79 79 A S < - 0 0 15 -4,-1.7 -1,-0.3 2,-0.1 -53,-0.0 -0.974 39.2-163.8-142.9 155.3 42.6 29.8 82.4 80 80 A S + 0 0 83 -2,-0.3 3,-0.1 -3,-0.1 -4,-0.1 0.370 47.3 141.3-109.1 -3.8 42.7 31.1 78.8 81 81 A T - 0 0 14 1,-0.1 -47,-0.1 -47,-0.1 -2,-0.1 -0.147 66.0 -99.0 -44.2 124.2 43.2 27.7 77.3 82 82 A P - 0 0 9 0, 0.0 -47,-2.1 0, 0.0 2,-0.4 -0.163 41.1-152.7 -48.6 139.1 41.1 27.6 74.1 83 83 A I E -c 35 0A 4 25,-0.3 28,-2.0 -49,-0.2 27,-1.9 -0.980 10.2-165.9-123.4 128.9 37.8 25.8 74.7 84 84 A V E -cd 36 111A 4 -49,-2.5 -47,-2.6 -2,-0.4 2,-0.5 -0.953 14.2-144.2-113.2 129.4 35.8 23.9 72.1 85 85 A L E -cd 37 112A 0 26,-2.2 28,-3.1 -2,-0.5 2,-0.4 -0.827 13.3-156.1 -95.2 124.6 32.2 23.0 72.9 86 86 A M E +cd 38 113A 11 -49,-3.3 -47,-1.8 -2,-0.5 2,-0.3 -0.840 27.0 142.2-103.0 139.5 31.1 19.7 71.5 87 87 A T E - d 0 114A 3 26,-2.2 28,-2.0 -2,-0.4 29,-0.3 -0.990 47.9-105.2-164.2 168.2 27.4 18.9 70.8 88 88 A Y > - 0 0 3 -2,-0.3 4,-0.8 -49,-0.3 29,-0.1 -0.710 41.4-114.1 -96.7 153.3 24.7 17.4 68.7 89 89 A Y H >> S+ 0 0 18 -2,-0.3 4,-2.3 1,-0.2 3,-1.1 0.924 103.8 74.6 -54.1 -49.5 22.6 19.7 66.6 90 90 A N H 3> S+ 0 0 74 1,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.779 93.9 48.2 -30.6 -61.9 19.3 19.0 68.5 91 91 A P H 3> S+ 0 0 10 0, 0.0 4,-1.8 0, 0.0 -1,-0.3 0.904 116.9 44.2 -51.8 -44.7 20.2 21.1 71.7 92 92 A I H S+ 0 0 17 1,-0.2 4,-3.3 2,-0.2 5,-0.3 0.919 112.4 40.3 -45.5 -65.1 21.6 28.9 67.0 98 98 A R H > S+ 0 0 102 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.861 118.1 51.1 -57.0 -36.0 22.4 32.6 67.3 99 99 A N H > S+ 0 0 114 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.938 113.7 43.3 -65.9 -47.5 21.1 32.5 70.9 100 100 A F H X S+ 0 0 2 -4,-3.6 4,-2.1 -8,-0.2 5,-0.2 0.946 114.6 49.5 -63.3 -50.2 23.2 29.5 71.8 101 101 A L H X S+ 0 0 0 -4,-3.3 4,-2.2 -5,-0.2 -2,-0.2 0.915 110.4 49.5 -56.6 -48.0 26.3 30.8 70.1 102 102 A A H X S+ 0 0 36 -4,-2.2 4,-1.7 -5,-0.3 -1,-0.2 0.907 110.8 50.7 -58.7 -43.6 26.2 34.2 71.7 103 103 A E H X S+ 0 0 72 -4,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.864 109.4 49.4 -63.6 -39.1 25.8 32.7 75.1 104 104 A A H X>S+ 0 0 1 -4,-2.1 5,-2.7 1,-0.2 4,-0.8 0.894 107.3 56.1 -67.1 -39.9 28.7 30.4 74.7 105 105 A K H ><5S+ 0 0 90 -4,-2.2 3,-0.6 1,-0.2 -2,-0.2 0.891 106.7 51.1 -58.8 -39.0 30.8 33.3 73.6 106 106 A A H 3<5S+ 0 0 84 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.910 107.2 51.0 -66.0 -44.3 29.9 35.1 76.8 107 107 A S H 3<5S- 0 0 7 -4,-1.8 -31,-0.3 1,-0.1 -1,-0.2 0.580 128.9 -93.2 -71.7 -9.0 30.9 32.2 79.1 108 108 A G T <<5 + 0 0 14 -4,-0.8 -25,-0.3 -3,-0.6 -3,-0.2 0.513 68.9 154.8 112.6 4.3 34.3 32.0 77.3 109 109 A V < - 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