==== 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 TRANSFERASE 06-AUG-99 1CQ6 . COMPND 2 MOLECULE: ASPARTATE AMINOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR J.ISHIJIMA,T.NAKAI,S.KAWAGUCHI,K.HIROTSU,S.KURAMITSU . 397 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18231.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 297 74.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 5.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 25 6.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 1 0.3 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 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 153 38.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.5 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 1 0 0 1 2 1 2 0 2 1 1 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 1 1 0 1 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 0 PARALLEL BRIDGES PER LADDER . 2 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 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 5 A M 0 0 196 0, 0.0 3,-0.3 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0 -10.6 41.6 13.8 14.9 2 6 A F > + 0 0 162 1,-0.2 3,-1.7 2,-0.1 0, 0.0 0.563 360.0 96.7 -97.5 -9.6 39.2 15.8 12.7 3 7 A E T 3 S+ 0 0 160 1,-0.3 -1,-0.2 3,-0.0 0, 0.0 0.600 90.3 39.7 -58.0 -15.8 40.6 19.3 13.3 4 8 A N T 3 S+ 0 0 148 -3,-0.3 -1,-0.3 2,-0.1 -2,-0.1 0.398 80.5 137.3-117.1 8.1 42.7 19.2 10.2 5 9 A I < - 0 0 117 -3,-1.7 2,-0.4 1,-0.1 -3,-0.1 -0.216 55.3-122.6 -58.7 134.1 40.4 17.5 7.7 6 10 A T - 0 0 120 1,-0.1 2,-0.3 0, 0.0 -1,-0.1 -0.677 25.5-117.1 -80.6 127.3 40.4 19.1 4.3 7 11 A A - 0 0 93 -2,-0.4 -1,-0.1 1,-0.1 0, 0.0 -0.532 34.7-118.0 -65.8 126.0 36.9 20.2 3.2 8 12 A A - 0 0 89 -2,-0.3 2,-0.1 1,-0.1 -1,-0.1 -0.310 26.2-114.8 -66.8 146.9 36.0 18.2 0.1 9 13 A P - 0 0 123 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.420 42.3 -85.4 -77.9 161.0 35.4 20.1 -3.2 10 14 A A - 0 0 88 -2,-0.1 0, 0.0 1,-0.1 0, 0.0 -0.416 41.7-110.3 -72.9 139.1 31.9 20.1 -4.7 11 15 A D > - 0 0 57 -2,-0.1 4,-1.6 1,-0.1 5,-0.1 -0.482 27.7-122.0 -65.9 137.2 30.9 17.2 -7.1 12 16 A P T 4 S+ 0 0 69 0, 0.0 359,-0.3 0, 0.0 -1,-0.1 0.624 106.5 28.9 -54.2 -21.9 30.6 18.5 -10.7 13 17 A I T >> S+ 0 0 13 357,-0.1 3,-1.4 3,-0.1 4,-1.1 0.801 121.0 45.2-106.4 -54.1 26.9 17.4 -10.9 14 18 A L H 3> S+ 0 0 101 1,-0.3 4,-2.6 2,-0.2 5,-0.3 0.963 104.8 61.8 -58.5 -52.6 25.4 17.6 -7.4 15 19 A G H 3< S+ 0 0 27 -4,-1.6 -1,-0.3 1,-0.2 -5,-0.1 0.450 100.3 60.8 -55.9 -0.7 26.9 21.0 -6.6 16 20 A L H X> S+ 0 0 16 -3,-1.4 4,-2.6 -5,-0.1 3,-1.1 0.874 110.1 33.7 -90.6 -59.3 24.8 22.3 -9.5 17 21 A A H 3X S+ 0 0 29 -4,-1.1 4,-3.4 -3,-0.3 -2,-0.2 0.936 111.6 64.1 -63.8 -41.8 21.4 21.4 -8.3 18 22 A D H 3< S+ 0 0 127 -4,-2.6 -1,-0.3 1,-0.3 -3,-0.2 0.739 113.5 35.3 -52.1 -25.3 22.4 22.1 -4.7 19 23 A L H <> S+ 0 0 77 -3,-1.1 4,-0.6 -5,-0.3 -1,-0.3 0.756 109.9 61.9 -95.5 -37.0 22.9 25.7 -5.8 20 24 A F H >< S+ 0 0 39 -4,-2.6 2,-3.2 1,-0.3 3,-2.2 0.947 93.1 69.0 -51.3 -46.2 20.0 25.6 -8.3 21 25 A R T 3< S+ 0 0 222 -4,-3.4 -1,-0.3 1,-0.3 3,-0.1 -0.360 104.3 41.2 -72.7 63.2 18.0 25.0 -5.1 22 26 A A T 34 S+ 0 0 82 -2,-3.2 2,-1.4 3,-0.1 -1,-0.3 0.177 84.3 95.8 179.1 -21.6 18.7 28.6 -4.0 23 27 A D << - 0 0 24 -3,-2.2 5,-0.1 -4,-0.6 -4,-0.0 -0.573 52.8-169.8 -92.0 81.0 18.4 30.7 -7.2 24 28 A E + 0 0 152 -2,-1.4 4,-0.2 -3,-0.1 -1,-0.2 0.666 33.1 143.4 -35.5 -40.4 14.8 32.0 -6.9 25 29 A R > - 0 0 79 1,-0.1 3,-1.7 -3,-0.1 2,-0.4 0.338 55.6-121.6 -12.9 112.0 14.9 33.4 -10.4 26 30 A P T 3 S+ 0 0 118 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.516 100.8 28.3 -67.8 120.6 11.5 32.9 -12.1 27 31 A G T 3 S+ 0 0 63 -2,-0.4 2,-1.0 1,-0.2 -2,-0.1 0.437 80.5 165.9 105.4 6.0 12.0 30.8 -15.3 28 32 A K < - 0 0 54 -3,-1.7 -1,-0.2 -4,-0.2 339,-0.1 -0.363 18.8-162.5 -60.2 93.0 15.0 29.0 -13.8 29 33 A I - 0 0 12 -2,-1.0 339,-2.4 336,-0.4 2,-0.4 -0.396 0.9-155.7 -74.1 155.6 15.6 26.1 -16.2 30 34 A N B +a 368 0A 20 349,-0.3 339,-0.2 337,-0.2 337,-0.1 -0.938 24.0 164.8-140.0 118.8 17.7 23.1 -15.0 31 35 A L + 0 0 2 337,-1.9 345,-2.0 -2,-0.4 339,-0.3 0.167 59.4 81.3-118.0 17.2 19.5 20.8 -17.3 32 36 A G + 0 0 1 337,-0.2 338,-0.1 343,-0.2 -18,-0.1 0.940 60.2 88.1 -81.1 -83.7 21.9 19.1 -14.9 33 37 A I - 0 0 39 1,-0.2 2,-4.2 -20,-0.2 -1,-0.1 0.159 67.1-146.2 -17.5 83.1 20.1 16.4 -13.0 34 38 A G + 0 0 1 2,-0.0 2,-0.3 345,-0.0 -1,-0.2 0.011 66.2 115.0 -53.1 41.5 20.5 13.2 -15.2 35 39 A V S S- 0 0 37 -2,-4.2 2,-0.2 312,-0.1 211,-0.1 -0.871 72.7-107.9-112.6 141.3 17.0 12.3 -13.8 36 40 A Y - 0 0 15 -2,-0.3 2,-0.4 8,-0.1 343,-0.1 -0.482 31.7-171.6 -76.2 145.8 14.0 12.1 -16.2 37 41 A K - 0 0 45 341,-1.6 6,-0.2 -2,-0.2 343,-0.1 -0.996 14.8-135.8-137.8 129.3 11.2 14.7 -16.1 38 42 A D > - 0 0 40 4,-2.7 3,-2.7 -2,-0.4 4,-0.1 0.023 48.3 -72.9 -72.9-172.0 7.9 14.5 -18.0 39 43 A E T 3 S+ 0 0 92 1,-0.3 344,-0.3 2,-0.1 -1,-0.1 0.547 137.2 51.3 -59.8 -5.7 6.1 17.2 -20.0 40 44 A T T 3 S- 0 0 102 2,-0.2 -1,-0.3 341,-0.1 3,-0.1 0.470 117.6-111.9-108.5 -8.7 5.3 18.8 -16.6 41 45 A G S < S+ 0 0 30 -3,-2.7 2,-0.4 1,-0.3 -2,-0.1 0.930 75.6 129.5 75.2 46.0 8.9 18.7 -15.3 42 46 A K - 0 0 118 -4,-0.1 -4,-2.7 2,-0.0 -1,-0.3 -0.970 57.3-141.6-132.8 147.4 8.0 16.1 -12.7 43 47 A T - 0 0 55 -2,-0.4 -6,-0.1 -6,-0.2 2,-0.1 -0.860 34.7-172.5-110.6 90.2 9.7 12.9 -12.0 44 48 A P - 0 0 59 0, 0.0 2,-0.6 0, 0.0 -8,-0.1 -0.297 29.7-107.9 -80.4 165.9 6.8 10.6 -11.2 45 49 A V - 0 0 66 1,-0.1 204,-0.1 -2,-0.1 205,-0.1 -0.852 46.4-109.3 -94.5 124.1 6.8 7.1 -9.9 46 50 A L > - 0 0 13 -2,-0.6 4,-1.9 202,-0.3 5,-0.1 -0.167 18.3-124.4 -49.4 153.1 5.8 4.8 -12.8 47 51 A T H > S+ 0 0 78 2,-0.2 4,-3.2 1,-0.2 5,-0.2 0.905 109.7 57.3 -69.1 -41.5 2.3 3.2 -12.5 48 52 A S H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.934 109.3 44.1 -56.6 -45.6 3.8 -0.3 -12.8 49 53 A V H > S+ 0 0 3 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.915 111.2 55.7 -68.4 -35.4 6.0 0.2 -9.8 50 54 A K H X S+ 0 0 125 -4,-1.9 4,-1.4 1,-0.2 -2,-0.2 0.937 110.4 44.7 -60.8 -43.7 3.1 1.8 -8.0 51 55 A K H X S+ 0 0 113 -4,-3.2 4,-2.2 1,-0.2 -1,-0.2 0.919 111.8 53.1 -66.1 -40.8 1.0 -1.3 -8.7 52 56 A A H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.879 105.5 54.2 -62.2 -38.0 4.0 -3.5 -7.6 53 57 A E H X S+ 0 0 51 -4,-2.9 4,-3.1 2,-0.2 -1,-0.2 0.868 107.2 50.5 -66.6 -33.6 4.3 -1.7 -4.3 54 58 A Q H X S+ 0 0 95 -4,-1.4 4,-2.3 -3,-0.2 5,-0.2 0.958 110.4 49.6 -67.4 -48.8 0.6 -2.3 -3.5 55 59 A Y H X S+ 0 0 129 -4,-2.2 4,-2.8 1,-0.2 5,-0.3 0.938 114.0 46.3 -53.8 -48.2 1.1 -6.0 -4.2 56 60 A L H X S+ 0 0 10 -4,-2.6 4,-3.1 1,-0.2 -2,-0.2 0.967 108.4 54.4 -59.2 -53.4 4.1 -6.0 -2.0 57 61 A L H < S+ 0 0 132 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.835 115.6 41.3 -49.9 -36.8 2.4 -4.1 0.8 58 62 A E H < S+ 0 0 132 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.922 123.3 34.3 -79.9 -44.5 -0.3 -6.7 0.8 59 63 A N H < S+ 0 0 79 -4,-2.8 -2,-0.2 -5,-0.2 -3,-0.2 0.770 85.1 103.4 -84.7 -31.8 1.8 -9.9 0.4 60 64 A E < + 0 0 67 -4,-3.1 3,-0.1 -5,-0.3 -4,-0.0 -0.361 35.7 171.7 -56.4 127.7 5.0 -9.3 2.2 61 66 A T + 0 0 141 1,-0.2 2,-0.3 -2,-0.1 -1,-0.2 0.484 61.2 29.6-115.4 -6.8 4.9 -11.1 5.5 62 67 A T - 0 0 92 2,-0.1 -1,-0.2 1,-0.1 0, 0.0 -0.991 44.6-159.5-154.3 155.5 8.5 -10.6 6.6 63 68 A K + 0 0 163 -2,-0.3 225,-0.1 -3,-0.1 3,-0.1 0.261 47.3 145.8-112.7 1.5 11.5 -8.2 6.4 64 69 A N - 0 0 125 1,-0.1 -2,-0.1 0, 0.0 0, 0.0 -0.033 59.7 -73.1 -43.6 145.2 14.1 -10.9 7.3 65 70 A Y - 0 0 183 1,-0.1 2,-0.2 220,-0.0 -1,-0.1 0.085 43.0-130.9 -43.9 147.1 17.5 -10.6 5.6 66 71 A L - 0 0 45 220,-0.3 5,-0.1 1,-0.2 -1,-0.1 -0.469 36.0 -88.1 -93.3 165.8 18.1 -11.4 2.0 67 72 A G B > -B 70 0B 39 3,-0.5 3,-2.1 -2,-0.2 -1,-0.2 -0.342 47.0-102.8 -66.6 162.1 21.0 -13.7 0.8 68 73 A I T 3 S+ 0 0 31 1,-0.3 -1,-0.1 217,-0.2 -2,-0.1 0.826 125.7 50.7 -57.7 -30.6 24.2 -11.7 0.2 69 74 A D T 3 S- 0 0 42 1,-0.3 30,-2.4 29,-0.1 -1,-0.3 0.451 107.9-137.6 -86.9 -1.1 23.4 -11.9 -3.5 70 75 A G B < +B 67 0B 4 -3,-2.1 -3,-0.5 28,-0.2 -1,-0.3 -0.532 54.5 4.4 87.2-150.2 19.9 -10.6 -3.1 71 76 A I >> - 0 0 25 -2,-0.2 4,-2.1 1,-0.1 3,-0.6 -0.683 54.6-148.4 -84.3 118.5 16.6 -11.8 -4.8 72 77 A P H 3> S+ 0 0 106 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.882 99.4 48.8 -48.0 -53.9 16.9 -14.9 -7.0 73 78 A E H 3> S+ 0 0 72 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.838 109.4 56.4 -59.9 -32.0 14.1 -13.9 -9.4 74 79 A F H <> S+ 0 0 2 -3,-0.6 4,-2.4 2,-0.2 5,-0.3 0.996 109.4 42.4 -62.1 -60.9 15.8 -10.5 -9.6 75 80 A G H X S+ 0 0 9 -4,-2.1 4,-1.6 1,-0.2 -2,-0.2 0.854 114.5 52.0 -51.7 -43.8 19.2 -11.9 -10.8 76 81 A R H X S+ 0 0 125 -4,-2.5 4,-2.1 -5,-0.2 -1,-0.2 0.924 111.5 46.5 -60.1 -47.4 17.5 -14.3 -13.2 77 82 A C H X S+ 0 0 10 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.923 111.0 49.7 -63.4 -49.2 15.4 -11.6 -14.8 78 83 A T H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.823 108.5 57.0 -59.9 -31.1 18.3 -9.1 -15.2 79 84 A Q H X>S+ 0 0 14 -4,-1.6 4,-2.4 -5,-0.3 5,-0.7 0.982 109.0 42.9 -62.9 -55.0 20.2 -12.0 -16.7 80 85 A E H X5S+ 0 0 56 -4,-2.1 4,-0.8 1,-0.2 -2,-0.2 0.818 112.6 54.5 -61.7 -32.7 17.6 -12.5 -19.4 81 86 A L H <5S+ 0 0 2 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.898 118.9 33.8 -67.0 -40.2 17.3 -8.8 -20.0 82 87 A L H <5S+ 0 0 0 -4,-2.0 -2,-0.2 -3,-0.3 -3,-0.2 0.974 131.0 25.4 -77.8 -66.5 21.1 -8.5 -20.6 83 88 A F H <5S- 0 0 13 -4,-2.4 -3,-0.2 1,-0.2 -2,-0.1 0.611 107.9-120.8 -81.0 -13.1 22.2 -11.7 -22.3 84 89 A G ><< - 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