==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER AMINOTRANSFERASE 10-SEP-93 1MAP . COMPND 2 MOLECULE: ASPARTATE AMINOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR V.N.MALASHKEVICH,J.N.JANSONIUS . 402 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18722.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 296 73.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 6.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 22 5.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 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 . 28 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 157 39.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 1 2 0 0 3 1 1 2 2 0 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 0 2 0 1 1 1 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 . 1 1 1 0 1 1 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 . 3 0 0 0 0 1 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 0 159 0, 0.0 2,-0.0 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 77.8 49.8 32.3 8.6 2 4 A S - 0 0 100 1,-0.0 3,-0.4 0, 0.0 4,-0.1 0.042 360.0 -79.8 -88.7-162.0 47.1 29.7 9.6 3 5 A W S S+ 0 0 211 1,-0.2 3,-0.3 2,-0.1 4,-0.0 0.801 123.7 37.7 -75.3 -37.0 44.9 29.7 12.6 4 6 A W S > S+ 0 0 189 1,-0.2 3,-0.6 2,-0.1 -1,-0.2 0.039 73.6 112.7-111.5 29.9 47.4 28.4 15.1 5 7 A S T 3 S+ 0 0 82 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.1 0.771 81.7 50.7 -70.2 -24.0 50.6 30.0 14.2 6 8 A H T 3 S+ 0 0 129 -3,-0.3 2,-0.6 -4,-0.1 -1,-0.2 0.555 80.4 109.2 -88.2 -13.7 50.7 32.0 17.4 7 9 A V < - 0 0 91 -3,-0.6 2,-0.1 1,-0.1 3,-0.1 -0.605 61.9-146.8 -72.5 112.7 50.0 29.0 19.8 8 10 A E - 0 0 173 -2,-0.6 2,-0.6 1,-0.1 -2,-0.1 -0.274 23.1 -89.6 -81.3 163.8 53.3 28.4 21.7 9 11 A M - 0 0 183 -2,-0.1 -1,-0.1 1,-0.0 0, 0.0 -0.584 45.3-156.8 -72.3 113.9 54.9 25.3 23.0 10 12 A G - 0 0 47 -2,-0.6 -3,-0.0 1,-0.1 -1,-0.0 -0.494 21.6-105.8 -85.5 165.7 53.5 24.9 26.6 11 13 A P - 0 0 120 0, 0.0 -1,-0.1 0, 0.0 6,-0.0 -0.581 33.4 -96.3 -95.2 159.7 55.6 22.9 29.1 12 14 A P - 0 0 90 0, 0.0 6,-0.0 0, 0.0 5,-0.0 -0.302 52.9 -83.3 -69.4 151.9 54.9 19.4 30.4 13 15 A D > - 0 0 73 1,-0.1 4,-1.6 2,-0.0 5,-0.3 -0.299 30.1-129.6 -59.9 132.1 53.1 18.8 33.7 14 16 A P T 4 S+ 0 0 100 0, 0.0 361,-0.3 0, 0.0 -1,-0.1 0.677 104.9 18.1 -54.0 -21.1 55.3 19.1 36.8 15 17 A I T >4 S+ 0 0 14 359,-0.1 3,-1.0 2,-0.1 4,-0.5 0.744 131.0 40.1-114.8 -55.5 53.9 15.7 38.0 16 18 A L T >> S+ 0 0 88 1,-0.3 4,-1.1 2,-0.2 3,-1.0 0.810 107.5 65.6 -67.0 -30.5 52.3 13.9 35.1 17 19 A G H 3X S+ 0 0 9 -4,-1.6 4,-2.1 1,-0.2 -1,-0.3 0.762 89.7 68.3 -63.6 -23.1 55.1 15.0 32.9 18 20 A V H <> S+ 0 0 21 -3,-1.0 4,-2.1 -5,-0.3 -1,-0.2 0.825 97.1 51.7 -65.3 -32.0 57.4 12.8 35.1 19 21 A T H <> S+ 0 0 29 -3,-1.0 4,-2.2 -4,-0.5 -1,-0.2 0.881 106.1 54.2 -71.5 -38.3 55.8 9.7 33.8 20 22 A E H X S+ 0 0 114 -4,-1.1 4,-1.0 1,-0.2 -2,-0.2 0.939 112.5 43.2 -59.9 -49.3 56.3 10.8 30.2 21 23 A A H X S+ 0 0 30 -4,-2.1 4,-0.6 1,-0.2 3,-0.4 0.894 113.0 52.3 -65.0 -41.0 60.0 11.3 30.8 22 24 A F H >< S+ 0 0 38 -4,-2.1 3,-1.0 1,-0.2 -1,-0.2 0.872 101.4 60.4 -64.1 -35.9 60.4 8.1 32.7 23 25 A K H 3< S+ 0 0 139 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.857 102.9 53.2 -58.1 -36.0 58.7 6.1 30.1 24 26 A R H 3< S+ 0 0 182 -4,-1.0 -1,-0.2 -3,-0.4 -2,-0.2 0.555 83.0 104.9 -76.9 -16.5 61.4 7.0 27.6 25 27 A D << - 0 0 35 -3,-1.0 5,-0.0 -4,-0.6 -3,-0.0 -0.454 54.7-157.7 -72.3 142.6 64.5 6.0 29.6 26 28 A T + 0 0 140 -2,-0.1 2,-0.5 3,-0.0 -1,-0.1 0.483 54.4 118.2 -99.1 -3.8 66.2 2.8 28.6 27 29 A N > - 0 0 41 1,-0.2 3,-2.0 2,-0.1 -2,-0.1 -0.561 56.6-150.8 -69.7 116.5 67.9 2.1 32.0 28 30 A S T 3 S+ 0 0 114 -2,-0.5 -1,-0.2 1,-0.3 342,-0.0 0.611 95.0 58.4 -59.8 -21.2 66.5 -1.2 33.3 29 31 A K T 3 S+ 0 0 123 2,-0.1 -1,-0.3 362,-0.0 -2,-0.1 0.365 79.6 137.5 -91.6 0.7 67.0 -0.0 36.9 30 32 A K < - 0 0 57 -3,-2.0 2,-0.4 341,-0.1 341,-0.2 -0.090 35.1-163.7 -50.8 143.6 64.7 3.0 36.3 31 33 A M E -a 371 0A 8 339,-2.3 341,-2.9 338,-0.1 2,-0.8 -1.000 12.3-145.3-134.6 136.4 62.2 3.9 39.1 32 34 A N E +a 372 0A 36 -2,-0.4 341,-0.1 351,-0.2 339,-0.1 -0.851 33.1 152.9-106.8 100.3 59.1 6.2 38.8 33 35 A L + 0 0 1 339,-3.1 347,-1.5 -2,-0.8 341,-0.4 -0.015 46.9 91.3-115.4 28.6 58.5 8.0 42.0 34 36 A G S S+ 0 0 0 339,-0.3 340,-0.2 345,-0.2 -18,-0.1 0.891 78.6 44.8 -83.3 -86.2 56.8 11.1 40.7 35 37 A V S S- 0 0 25 -20,-0.4 2,-1.8 1,-0.1 345,-0.1 -0.207 92.2-108.5 -61.6 146.1 53.1 10.4 40.7 36 38 A G + 0 0 0 346,-0.1 2,-0.4 -3,-0.0 -1,-0.1 -0.590 61.6 147.6 -78.6 87.6 51.6 8.9 43.8 37 39 A A - 0 0 17 -2,-1.8 2,-0.2 314,-0.1 213,-0.1 -0.990 45.5-122.7-125.5 126.3 50.7 5.4 42.4 38 40 A Y - 0 0 17 -2,-0.4 8,-0.7 8,-0.1 2,-0.3 -0.486 25.3-166.1 -74.6 139.3 50.8 2.4 44.6 39 41 A R B -B 45 0B 68 343,-1.7 345,-0.1 -2,-0.2 -1,-0.0 -0.911 18.6-122.7-120.2 145.9 53.1 -0.5 43.6 40 42 A D > - 0 0 39 4,-3.3 3,-1.7 -2,-0.3 -1,-0.1 -0.051 47.1 -83.0 -76.3-173.3 53.1 -4.0 45.0 41 43 A D T 3 S+ 0 0 61 1,-0.3 345,-0.8 2,-0.1 346,-0.5 0.579 130.9 54.4 -72.3 -2.9 56.2 -5.5 46.7 42 44 A N T 3 S- 0 0 118 2,-0.2 -1,-0.3 343,-0.1 343,-0.1 0.285 122.7-104.0-105.4 -0.1 57.6 -6.5 43.3 43 45 A G S < S+ 0 0 32 -3,-1.7 -2,-0.1 1,-0.3 342,-0.1 0.816 79.2 131.2 77.6 37.2 57.3 -3.0 42.0 44 46 A K - 0 0 118 1,-0.1 -4,-3.3 -4,-0.0 -1,-0.3 -0.886 66.0 -90.6-123.2 150.7 54.3 -3.7 39.9 45 47 A P B -B 39 0B 91 0, 0.0 2,-0.5 0, 0.0 -6,-0.2 -0.245 43.8-143.5 -57.6 141.3 50.9 -2.1 39.5 46 48 A Y - 0 0 63 -8,-0.7 2,-0.7 -6,-0.1 -8,-0.1 -0.933 18.6-171.8-124.4 115.4 48.3 -3.5 41.9 47 49 A V - 0 0 55 -2,-0.5 5,-0.1 207,-0.1 206,-0.1 -0.891 37.9-117.9 -98.1 110.9 44.7 -4.1 41.2 48 50 A L >> - 0 0 1 -2,-0.7 4,-2.2 204,-0.3 3,-0.8 -0.171 13.2-121.0 -55.4 151.1 43.0 -5.0 44.5 49 51 A N H 3> S+ 0 0 87 1,-0.3 4,-1.8 2,-0.2 -1,-0.1 0.837 113.9 53.2 -55.8 -42.5 41.5 -8.3 45.0 50 52 A C H 3> S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.786 106.5 54.4 -68.9 -26.5 38.1 -6.9 45.8 51 53 A V H <> S+ 0 0 6 -3,-0.8 4,-2.6 2,-0.2 5,-0.2 0.967 105.6 51.8 -70.1 -51.2 38.3 -4.9 42.5 52 54 A R H X S+ 0 0 141 -4,-2.2 4,-1.4 1,-0.2 -2,-0.2 0.860 112.9 46.5 -52.6 -37.9 38.9 -8.0 40.5 53 55 A K H X S+ 0 0 101 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.895 108.7 52.3 -73.0 -41.4 35.9 -9.6 42.1 54 56 A A H X S+ 0 0 0 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.933 109.6 53.0 -55.1 -46.4 33.5 -6.6 41.7 55 57 A E H X S+ 0 0 59 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.882 107.3 50.4 -52.7 -49.3 34.6 -6.7 38.0 56 58 A A H X S+ 0 0 59 -4,-1.4 4,-2.5 2,-0.2 -1,-0.2 0.848 108.9 51.0 -63.5 -36.4 33.6 -10.3 37.7 57 59 A M H X S+ 0 0 72 -4,-2.0 4,-1.5 1,-0.2 -2,-0.2 0.933 110.0 50.2 -67.6 -44.2 30.3 -9.7 39.2 58 60 A I H <>S+ 0 0 18 -4,-2.7 5,-1.1 1,-0.2 -2,-0.2 0.891 110.8 51.2 -60.1 -37.7 29.7 -7.0 36.8 59 61 A A H ><5S+ 0 0 57 -4,-2.3 3,-1.8 1,-0.2 -2,-0.2 0.954 107.7 49.4 -63.3 -51.9 30.7 -9.3 34.0 60 62 A A H 3<5S+ 0 0 81 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.741 102.3 61.2 -62.3 -27.3 28.4 -12.1 34.9 61 63 A K T 3<5S- 0 0 116 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.518 99.5-133.2 -81.1 -0.7 25.4 -10.0 35.2 62 64 A K T < 5 - 0 0 177 -3,-1.8 -3,-0.1 -4,-0.2 -2,-0.1 0.912 32.2-162.2 52.8 49.5 25.6 -8.9 31.6 63 66 A M < - 0 0 74 -5,-1.1 -1,-0.1 1,-0.1 -5,-0.0 -0.230 11.3-122.7 -65.1 151.3 25.1 -5.2 32.4 64 67 A D - 0 0 93 1,-0.1 -1,-0.1 2,-0.0 -2,-0.0 -0.113 9.3-132.0 -77.6-173.0 24.0 -2.7 29.8 65 68 A K + 0 0 165 2,-0.0 3,-0.1 3,-0.0 -1,-0.1 -0.097 49.6 148.6-132.1 29.2 26.0 0.4 28.9 66 69 A E - 0 0 127 1,-0.1 -2,-0.0 0, 0.0 0, 0.0 -0.282 58.6 -83.9 -65.3 155.3 23.1 2.9 28.9 67 70 A Y - 0 0 198 1,-0.1 -1,-0.1 222,-0.0 3,-0.1 -0.253 43.2-134.5 -56.6 147.2 23.7 6.5 29.9 68 71 A L - 0 0 23 222,-0.3 5,-0.1 1,-0.2 -1,-0.1 -0.625 36.8 -81.7 -97.6 159.3 23.7 7.2 33.8 69 72 A P > - 0 0 88 0, 0.0 3,-1.6 0, 0.0 -1,-0.2 -0.124 45.3-104.8 -56.8 160.1 21.8 10.1 35.2 70 73 A I T 3 S+ 0 0 48 1,-0.3 3,-0.1 219,-0.2 -2,-0.1 0.856 123.0 51.9 -56.9 -35.5 23.6 13.5 35.1 71 74 A A T 3 S- 0 0 12 1,-0.2 30,-2.4 29,-0.1 -1,-0.3 0.477 114.5-118.3 -81.9 -2.7 24.4 13.1 38.9 72 75 A G < - 0 0 5 -3,-1.6 2,-0.6 28,-0.2 -1,-0.2 -0.387 55.7 -19.3 98.5-176.3 25.8 9.6 38.6 73 76 A L >> - 0 0 45 1,-0.1 4,-1.8 -2,-0.1 3,-1.6 -0.593 58.7-144.3 -71.3 112.7 25.0 6.1 39.9 74 77 A A H 3> S+ 0 0 59 -2,-0.6 4,-2.9 1,-0.3 5,-0.3 0.835 97.3 51.9 -42.6 -50.8 22.6 6.6 43.0 75 78 A D H 3> S+ 0 0 73 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.757 110.2 48.3 -62.0 -30.8 24.0 3.8 44.9 76 79 A F H <> S+ 0 0 0 -3,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.847 113.1 49.1 -78.1 -35.9 27.6 5.0 44.5 77 80 A T H X S+ 0 0 25 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.888 111.5 46.1 -70.1 -45.8 26.6 8.5 45.5 78 81 A R H X S+ 0 0 99 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.904 114.0 51.8 -66.5 -38.5 24.8 7.5 48.6 79 82 A A H X S+ 0 0 1 -4,-1.2 4,-1.6 -5,-0.3 -2,-0.2 0.826 107.5 50.3 -67.8 -35.8 27.7 5.2 49.5 80 83 A S H X S+ 0 0 0 -4,-1.9 4,-2.0 2,-0.2 5,-0.2 0.919 110.9 49.2 -70.8 -41.0 30.4 7.8 49.2 81 84 A A H X S+ 0 0 0 -4,-1.8 4,-2.8 1,-0.2 5,-0.3 0.937 111.6 49.5 -59.9 -45.3 28.5 10.3 51.4 82 85 A E H X S+ 0 0 50 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.863 109.2 53.1 -59.4 -38.0 28.0 7.6 53.9 83 86 A L H < S+ 0 0 5 -4,-1.6 -1,-0.2 2,-0.2 -2,-0.2 0.835 116.7 36.5 -68.8 -35.9 31.8 6.8 53.7 84 87 A A H < S+ 0 0 0 -4,-2.0 -2,-0.2 -3,-0.1 149,-0.2 0.939 126.1 38.2 -77.2 -51.8 32.9 10.4 54.4 85 88 A L H < S- 0 0 5 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.700 104.4-122.8 -71.5 -36.2 30.1 11.3 56.9 86 89 A G >< - 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