==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE(AMINOTRANSFERASE) 02-DEC-91 9AAT . COMPND 2 MOLECULE: ASPARTATE AMINOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR C.A.MCPHALEN,M.G.VINCENT,J.N.JANSONIUS . 802 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30946.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 578 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 6.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 42 5.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.5 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-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 . 54 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 71 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 316 39.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 1.9 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 6 0 0 0 5 1 1 3 8 2 0 0 2 0 0 2 0 0 0 0 0 0 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 0 4 0 2 2 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 PARALLEL BRIDGES PER LADDER . 0 2 2 0 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 ANTIPARALLEL BRIDGES PER LADDER . 6 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 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 S 0 0 54 0, 0.0 667,-0.1 0, 0.0 641,-0.0 0.000 360.0 360.0 360.0-143.5 29.5 -4.6 44.2 2 4 A S + 0 0 62 1,-0.0 3,-0.4 2,-0.0 4,-0.1 0.653 360.0 131.3 66.6 25.1 29.8 -7.6 41.9 3 5 A W S S+ 0 0 6 1,-0.2 3,-0.3 2,-0.1 520,-0.2 0.780 71.6 38.2 -69.6 -36.6 26.1 -7.4 40.8 4 6 A W S > S+ 0 0 2 1,-0.2 3,-2.3 2,-0.1 -1,-0.2 0.298 74.1 111.7-106.4 9.7 26.7 -7.7 37.1 5 7 A S T 3 S+ 0 0 78 -3,-0.4 -1,-0.2 1,-0.3 -2,-0.1 0.689 80.8 53.3 -56.1 -26.0 29.5 -10.2 36.8 6 8 A H T 3 S+ 0 0 59 -3,-0.3 2,-0.5 -4,-0.1 -1,-0.3 0.368 80.4 110.8 -91.6 1.8 27.0 -12.7 35.2 7 9 A V < - 0 0 2 -3,-2.3 2,-0.3 666,-0.0 670,-0.1 -0.699 59.6-148.3 -81.6 122.1 25.8 -10.4 32.5 8 10 A E - 0 0 151 -2,-0.5 2,-0.2 668,-0.1 672,-0.1 -0.634 23.7 -99.5 -93.0 149.3 27.0 -11.6 29.1 9 11 A M - 0 0 101 -2,-0.3 667,-0.1 1,-0.1 668,-0.1 -0.511 46.9-122.5 -66.1 129.9 27.8 -9.3 26.2 10 12 A G - 0 0 10 666,-0.4 -1,-0.1 -2,-0.2 670,-0.1 -0.287 33.4 -84.3 -73.5 160.6 24.8 -9.4 23.9 11 13 A P - 0 0 110 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.324 48.1-112.0 -67.4 148.0 25.1 -10.5 20.3 12 14 A P - 0 0 121 0, 0.0 3,-0.0 0, 0.0 -3,-0.0 -0.487 26.1-108.4 -84.4 152.7 26.1 -7.9 17.7 13 15 A D > - 0 0 64 -2,-0.2 4,-1.8 1,-0.1 5,-0.0 -0.663 16.8-151.6 -82.4 129.5 23.9 -6.4 15.0 14 16 A P H > S+ 0 0 87 0, 0.0 4,-2.0 0, 0.0 -1,-0.1 0.809 97.8 56.1 -69.3 -34.1 24.8 -7.6 11.5 15 17 A I H > S+ 0 0 56 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.807 106.3 51.0 -68.3 -32.0 23.4 -4.4 9.9 16 18 A L H > S+ 0 0 98 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.929 106.8 54.9 -68.4 -46.1 25.8 -2.6 12.2 17 19 A G H X S+ 0 0 35 -4,-1.8 4,-1.8 1,-0.2 -2,-0.2 0.876 107.8 49.0 -51.6 -46.9 28.6 -4.8 10.9 18 20 A V H X S+ 0 0 23 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.870 111.2 49.4 -62.6 -41.4 27.7 -3.9 7.3 19 21 A T H X S+ 0 0 46 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.846 109.9 50.1 -67.3 -36.7 27.7 -0.2 8.1 20 22 A E H X S+ 0 0 92 -4,-2.3 4,-1.3 2,-0.2 -1,-0.2 0.873 111.5 48.1 -69.5 -42.9 31.1 -0.3 9.9 21 23 A A H X S+ 0 0 20 -4,-1.8 4,-1.3 -5,-0.2 -2,-0.2 0.892 111.3 52.0 -64.1 -43.1 32.7 -2.2 7.0 22 24 A F H < S+ 0 0 44 -4,-2.0 3,-0.5 1,-0.2 -2,-0.2 0.899 108.3 50.6 -58.9 -45.8 31.2 0.4 4.6 23 25 A K H < S+ 0 0 143 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.781 109.3 51.6 -63.7 -32.4 32.7 3.2 6.6 24 26 A R H < S+ 0 0 171 -4,-1.3 -1,-0.2 -3,-0.2 -2,-0.2 0.719 87.7 103.0 -77.5 -26.2 36.1 1.6 6.6 25 27 A D < - 0 0 27 -4,-1.3 5,-0.0 -3,-0.5 -3,-0.0 -0.354 51.5-166.4 -63.2 134.3 36.1 1.2 2.8 26 28 A T + 0 0 144 -2,-0.1 2,-0.6 3,-0.0 -1,-0.1 0.460 51.8 113.3-101.7 -5.5 38.2 3.7 0.7 27 29 A N > - 0 0 60 1,-0.2 3,-2.2 2,-0.1 -2,-0.1 -0.600 62.2-146.2 -71.2 115.3 36.8 2.9 -2.7 28 30 A S T 3 S+ 0 0 125 -2,-0.6 -1,-0.2 1,-0.3 -3,-0.0 0.551 96.2 63.8 -60.1 -7.6 35.0 6.1 -3.7 29 31 A K T 3 S+ 0 0 123 2,-0.1 -1,-0.3 362,-0.0 -2,-0.1 0.415 75.0 132.1 -95.8 -3.5 32.5 3.9 -5.6 30 32 A K < - 0 0 56 -3,-2.2 2,-0.4 -8,-0.1 341,-0.2 -0.171 41.3-156.3 -53.0 142.2 31.3 2.2 -2.4 31 33 A M E -a 371 0A 3 339,-2.5 341,-3.0 338,-0.1 2,-0.7 -0.976 10.2-150.1-126.7 140.0 27.6 1.9 -1.9 32 34 A N E +a 372 0A 27 -2,-0.4 3,-0.5 351,-0.3 341,-0.2 -0.899 25.9 161.8-111.0 97.1 25.7 1.4 1.4 33 35 A L + 0 0 0 339,-3.0 347,-1.8 -2,-0.7 341,-0.3 0.012 66.0 76.6-102.6 23.5 22.5 -0.5 0.7 34 36 A G + 0 0 4 345,-0.2 -1,-0.2 339,-0.2 2,-0.2 0.295 67.2 127.1-108.9 0.1 22.1 -1.4 4.4 35 37 A V - 0 0 19 -3,-0.5 347,-0.3 345,-0.2 348,-0.2 -0.390 45.0-162.3 -68.2 128.1 20.8 2.1 5.1 36 38 A G + 0 0 33 -2,-0.2 2,-0.3 2,-0.1 -1,-0.1 0.110 65.9 60.9-100.4 20.6 17.5 2.4 7.0 37 39 A A S S- 0 0 5 314,-0.1 213,-0.1 343,-0.0 345,-0.1 -0.935 92.4 -88.5-141.0 158.4 16.5 6.0 6.3 38 40 A Y - 0 0 15 -2,-0.3 8,-0.4 8,-0.1 2,-0.3 -0.312 39.3-168.2 -68.4 151.0 15.7 7.9 3.1 39 41 A R - 0 0 47 6,-0.2 345,-0.1 343,-0.1 2,-0.0 -0.964 18.5-122.4-136.7 144.0 18.7 9.5 1.3 40 42 A D > - 0 0 44 4,-2.7 3,-2.5 -2,-0.3 6,-0.0 -0.106 44.2 -82.6 -79.6-178.1 18.4 12.1 -1.6 41 43 A D T 3 S+ 0 0 53 1,-0.3 346,-0.4 2,-0.1 345,-0.1 0.701 133.4 55.3 -59.3 -21.0 19.9 11.7 -5.0 42 44 A N T 3 S- 0 0 130 2,-0.1 -1,-0.3 343,-0.1 343,-0.1 0.395 120.9-110.0 -92.3 -0.8 23.2 13.0 -3.5 43 45 A G S < S+ 0 0 44 -3,-2.5 -2,-0.1 1,-0.3 342,-0.0 0.679 75.5 133.3 77.7 23.8 23.1 10.3 -0.8 44 46 A K - 0 0 126 1,-0.1 -4,-2.7 0, 0.0 -1,-0.3 -0.748 64.3 -96.0-110.0 156.3 22.3 12.8 1.9 45 47 A P - 0 0 50 0, 0.0 2,-0.5 0, 0.0 -6,-0.2 -0.323 41.4-142.1 -61.5 145.2 19.8 12.9 4.8 46 48 A Y - 0 0 60 -8,-0.4 2,-0.5 -6,-0.0 -8,-0.1 -0.940 19.0-173.5-127.0 112.7 16.7 14.8 3.9 47 49 A V - 0 0 24 -2,-0.5 206,-0.1 207,-0.0 2,-0.1 -0.892 36.3-119.7 -97.2 123.9 14.7 17.1 6.2 48 50 A L >> - 0 0 0 -2,-0.5 4,-2.0 204,-0.4 3,-0.7 -0.338 8.2-126.5 -68.3 147.5 11.6 18.2 4.4 49 51 A N H 3> S+ 0 0 87 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.867 112.7 55.0 -58.4 -43.8 10.9 21.9 3.7 50 52 A C H 3> S+ 0 0 0 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.751 106.6 53.3 -62.2 -27.7 7.5 21.7 5.3 51 53 A V H <> S+ 0 0 0 -3,-0.7 4,-2.5 2,-0.2 -2,-0.2 0.915 109.1 46.6 -72.3 -45.8 9.3 20.3 8.4 52 54 A R H X S+ 0 0 63 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.905 114.5 49.3 -61.2 -42.3 11.7 23.3 8.5 53 55 A K H X S+ 0 0 91 -4,-2.5 4,-1.8 2,-0.2 -1,-0.2 0.874 110.3 49.1 -65.5 -42.2 8.7 25.6 8.0 54 56 A A H X S+ 0 0 0 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.908 112.1 49.9 -66.2 -39.2 6.7 23.9 10.8 55 57 A E H X S+ 0 0 43 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.863 107.6 51.9 -65.5 -42.2 9.7 24.2 13.1 56 58 A A H X S+ 0 0 60 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.888 108.1 55.1 -60.1 -41.0 10.2 27.9 12.4 57 59 A M H X S+ 0 0 75 -4,-1.8 4,-1.4 2,-0.2 -2,-0.2 0.869 106.4 48.4 -59.3 -46.0 6.5 28.4 13.2 58 60 A I H <>S+ 0 0 16 -4,-1.6 5,-0.9 2,-0.2 3,-0.4 0.921 112.2 50.1 -60.7 -48.7 6.9 26.8 16.7 59 61 A A H ><5S+ 0 0 59 -4,-2.1 3,-1.7 1,-0.2 -2,-0.2 0.912 107.7 53.6 -54.2 -51.0 9.9 28.9 17.4 60 62 A A H 3<5S+ 0 0 80 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.795 105.5 53.8 -54.9 -38.7 8.1 32.1 16.3 61 63 A K T 3<5S- 0 0 129 -4,-1.4 -1,-0.3 -3,-0.4 -2,-0.2 0.425 99.9-135.6 -79.8 -3.5 5.2 31.4 18.7 62 64 A K T < 5 - 0 0 136 -3,-1.7 -3,-0.2 -4,-0.3 -2,-0.1 0.922 33.7-166.0 43.8 59.2 7.5 31.0 21.7 63 66 A M < - 0 0 55 -5,-0.9 -1,-0.1 1,-0.1 2,-0.0 -0.320 15.0-113.4 -72.6 155.3 5.7 27.9 22.9 64 67 A D - 0 0 63 1,-0.1 -1,-0.1 -2,-0.1 385,-0.0 -0.150 10.5-131.4 -79.5 177.7 6.2 26.4 26.4 65 68 A K + 0 0 4 590,-0.1 593,-2.9 -2,-0.0 594,-0.3 -0.086 52.6 149.6-123.1 28.5 7.7 23.1 27.2 66 69 A E - 0 0 26 591,-0.2 226,-0.0 1,-0.1 373,-0.0 -0.259 56.2 -86.3 -68.4 151.5 5.0 22.0 29.5 67 70 A Y - 0 0 78 1,-0.1 -1,-0.1 590,-0.1 591,-0.1 -0.233 40.1-132.0 -55.2 144.6 4.1 18.3 29.8 68 71 A L - 0 0 16 222,-0.4 5,-0.1 1,-0.2 -1,-0.1 -0.583 36.6 -87.7 -93.2 160.9 1.6 16.9 27.3 69 72 A P > - 0 0 84 0, 0.0 3,-1.6 0, 0.0 -1,-0.2 -0.205 46.5-102.5 -60.1 159.7 -1.3 14.8 28.5 70 73 A I T 3 S+ 0 0 28 1,-0.3 3,-0.1 219,-0.2 -2,-0.1 0.881 125.1 51.7 -51.8 -45.2 -0.4 11.1 28.8 71 74 A A T 3 S- 0 0 13 1,-0.3 30,-3.0 29,-0.1 -1,-0.3 0.530 115.3-123.6 -73.6 -10.6 -2.3 10.3 25.6 72 75 A G < - 0 0 5 -3,-1.6 2,-0.6 28,-0.2 -1,-0.3 -0.427 53.7 -13.0 99.2-170.6 -0.3 13.1 23.8 73 76 A L >> - 0 0 36 1,-0.1 4,-2.3 -2,-0.1 3,-1.4 -0.561 55.8-147.1 -71.2 111.7 -1.2 16.3 21.9 74 77 A A H 3> S+ 0 0 71 -2,-0.6 4,-2.2 1,-0.3 5,-0.2 0.779 97.2 53.3 -48.1 -41.2 -4.9 16.2 21.0 75 78 A D H 3> S+ 0 0 95 1,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.770 112.7 47.3 -64.3 -34.0 -4.5 18.0 17.7 76 79 A F H <> S+ 0 0 0 -3,-1.4 4,-1.8 2,-0.2 -2,-0.2 0.897 111.2 46.8 -76.2 -49.7 -1.9 15.4 16.7 77 80 A T H X S+ 0 0 21 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.893 114.8 47.8 -63.1 -41.1 -3.8 12.3 17.7 78 81 A R H X S+ 0 0 85 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.909 113.9 45.3 -64.2 -48.3 -7.0 13.5 16.0 79 82 A A H X S+ 0 0 0 -4,-1.3 4,-2.3 1,-0.2 -1,-0.2 0.807 111.1 57.1 -64.3 -31.8 -5.2 14.4 12.7 80 83 A S H X S+ 0 0 0 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.928 108.5 43.1 -65.6 -48.6 -3.3 11.1 13.0 81 84 A A H X S+ 0 0 0 -4,-2.0 4,-3.4 2,-0.2 5,-0.3 0.901 113.6 53.2 -66.1 -40.5 -6.5 9.0 13.1 82 85 A E H X S+ 0 0 35 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.893 107.4 51.2 -62.5 -41.8 -8.0 11.1 10.3 83 86 A L H < S+ 0 0 2 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.906 117.9 39.2 -60.4 -45.4 -4.9 10.5 8.2 84 87 A A H < S+ 0 0 0 -4,-1.9 -2,-0.2 1,-0.1 -1,-0.2 0.914 126.1 31.5 -70.2 -51.3 -5.2 6.8 8.7 85 88 A L H < S- 0 0 8 -4,-3.4 -3,-0.2 -5,-0.1 -2,-0.2 0.639 108.2-116.0 -85.0 -25.1 -9.0 6.3 8.5 86 89 A G >< - 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