==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 20-JUL-01 1JMZ . COMPND 2 MOLECULE: AMINE DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS PUTIDA; . AUTHOR A.SATOH,I.MIYAHARA,K.HIROTSU . 909 4 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33442.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 638 70.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 301 33.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 11 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 4 0.4 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 . 101 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 72 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 97 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 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 3 2 0 2 1 2 0 0 0 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 1 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 0 PARALLEL BRIDGES PER LADDER . 5 4 5 7 5 9 4 6 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 3 7 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 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 2 A E 0 0 116 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-158.3 154.1 34.1 4.9 2 3 A Q > - 0 0 147 1,-0.1 4,-1.6 60,-0.0 3,-0.4 -0.711 360.0-112.9 -92.5 152.9 153.6 30.4 5.3 3 4 A G H > S+ 0 0 6 -2,-0.3 4,-1.9 1,-0.2 3,-0.2 0.910 110.6 52.2 -52.1 -51.4 151.3 29.3 8.2 4 5 A P H > S+ 0 0 38 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.801 109.2 47.1 -57.7 -37.7 154.1 27.6 10.3 5 6 A S H > S+ 0 0 41 -3,-0.4 4,-2.9 2,-0.2 5,-0.2 0.845 112.4 50.2 -76.2 -31.5 156.5 30.5 10.4 6 7 A L H X S+ 0 0 0 -4,-1.6 4,-2.1 2,-0.2 5,-0.4 0.830 105.9 57.6 -71.1 -35.0 153.7 33.0 11.3 7 8 A L H X>S+ 0 0 4 -4,-1.9 4,-1.8 -5,-0.2 5,-0.6 0.930 115.2 36.5 -58.9 -47.0 152.7 30.6 14.1 8 9 A Q H X5S+ 0 0 85 -4,-1.4 4,-1.4 3,-0.2 -2,-0.2 0.964 118.1 48.0 -71.2 -54.1 156.2 30.9 15.5 9 10 A N H <5S+ 0 0 94 -4,-2.9 -2,-0.2 1,-0.2 -3,-0.2 0.780 126.5 27.9 -58.8 -31.9 156.9 34.6 14.8 10 11 A K H <5S+ 0 0 70 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.695 129.4 31.4-105.5 -25.4 153.6 35.7 16.2 11 12 A C H >X5S+ 0 0 21 -4,-1.8 4,-2.1 -5,-0.4 3,-0.8 0.697 91.4 98.2-108.1 -26.3 152.4 33.2 18.8 12 13 A M B 3< S+B 22 0B 35 3,-0.7 3,-2.1 0, 0.0 -1,-0.3 -0.158 100.8 36.4 109.3 155.8 158.1 20.4 18.4 20 21 A N T 3 S- 0 0 147 1,-0.3 3,-0.1 -2,-0.1 0, 0.0 0.816 131.9 -48.1 26.5 65.7 157.3 20.2 14.6 21 22 A D T 3 S+ 0 0 84 1,-0.2 2,-0.3 -17,-0.1 -1,-0.3 0.619 108.6 126.1 60.6 18.4 155.2 23.3 14.3 22 23 A T E < -B 19 0B 42 -3,-2.1 -4,-3.2 4,-0.0 -3,-0.7 -0.840 35.6-175.5-108.0 144.4 153.0 22.5 17.3 23 24 A Y E > -B 17 0B 13 -2,-0.3 4,-1.9 -6,-0.3 5,-0.1 -0.910 35.3 -80.4-135.2 161.6 152.4 24.8 20.2 24 25 A S T 4 S- 0 0 6 -8,-2.0 2,-2.8 -2,-0.3 -6,-0.0 -0.299 109.3 -4.6 -62.4 144.7 150.7 24.8 23.6 25 26 A R T >4 S+ 0 0 35 1,-0.2 3,-1.7 2,-0.1 -1,-0.2 -0.364 125.7 70.0 71.7 -62.7 146.9 25.4 23.4 26 27 A I G >4 S+ 0 0 21 -2,-2.8 3,-0.8 1,-0.3 -1,-0.2 0.861 98.5 45.2 -50.4 -50.4 146.9 26.0 19.7 27 28 A S G 3< S+ 0 0 26 -4,-1.9 -1,-0.3 1,-0.2 -3,-0.1 0.223 106.6 62.0 -84.9 16.8 147.7 22.4 18.5 28 29 A H G < S+ 0 0 49 -3,-1.7 2,-0.3 -5,-0.1 -1,-0.2 0.122 93.7 66.4-128.1 20.1 145.2 20.8 20.9 29 30 A Q < - 0 0 14 -3,-0.8 2,-0.4 84,-0.1 84,-0.2 -0.973 57.9-156.0-141.5 149.5 141.9 22.3 19.7 30 31 A R E +C 112 0C 5 82,-1.7 82,-2.0 -2,-0.3 2,-0.3 -0.998 25.3 160.3-128.1 130.0 139.8 22.1 16.5 31 32 A K E -C 111 0C 0 36,-2.0 38,-0.2 -2,-0.4 80,-0.2 -0.908 40.4 -91.4-140.7 174.1 137.4 24.8 15.4 32 33 A T > - 0 0 3 78,-0.7 4,-2.2 -2,-0.3 5,-0.2 -0.228 51.6 -95.4 -78.3 171.7 135.5 26.2 12.5 33 34 A P H > S+ 0 0 8 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.912 129.9 44.5 -58.2 -41.7 137.1 29.0 10.3 34 35 A E H > S+ 0 0 27 2,-0.2 4,-1.9 1,-0.2 458,-0.2 0.777 108.0 59.6 -73.3 -25.0 135.3 31.7 12.3 35 36 A G H > S+ 0 0 3 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.926 107.1 46.0 -66.1 -42.9 136.2 29.9 15.5 36 37 A W H X S+ 0 0 8 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.881 110.7 52.0 -67.0 -38.9 139.9 30.3 14.6 37 38 A L H X S+ 0 0 39 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.877 109.0 52.2 -64.5 -36.5 139.4 34.0 13.7 38 39 A M H X S+ 0 0 23 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.867 107.8 50.5 -67.5 -37.9 137.7 34.6 17.1 39 40 A S H X S+ 0 0 19 -4,-1.8 4,-1.1 2,-0.2 -1,-0.2 0.901 113.8 43.9 -66.6 -43.3 140.6 33.0 19.0 40 41 A I H X S+ 0 0 16 -4,-1.9 4,-1.4 1,-0.2 -2,-0.2 0.861 111.1 55.7 -69.7 -34.2 143.2 35.2 17.2 41 42 A A H X S+ 0 0 2 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.859 105.0 52.3 -65.5 -36.3 140.9 38.2 17.6 42 43 A R H X>S+ 0 0 71 -4,-1.7 4,-2.8 1,-0.2 5,-0.8 0.830 104.0 57.9 -68.6 -31.6 140.9 37.6 21.4 43 44 A M H X5S+ 0 0 42 -4,-1.1 6,-2.2 3,-0.2 4,-0.7 0.868 110.6 43.0 -65.3 -36.4 144.7 37.5 21.4 44 45 A Q H X5S+ 0 0 41 -4,-1.4 4,-0.9 4,-0.3 -2,-0.2 0.949 121.7 37.8 -73.4 -50.2 144.7 41.0 19.9 45 46 A V H <5S+ 0 0 45 -4,-2.4 -2,-0.2 2,-0.1 -3,-0.2 0.913 131.0 26.1 -68.6 -46.5 142.0 42.5 22.1 46 47 A M H <5S+ 0 0 37 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.1 0.834 132.9 29.2 -89.6 -36.7 142.9 40.7 25.4 47 48 A H H < - 0 0 57 -2,-0.3 4,-2.0 1,-0.1 5,-0.2 -0.325 31.1-112.2 -73.2 160.6 148.0 42.5 10.3 53 54 A D H > S+ 0 0 36 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.847 117.6 53.1 -61.0 -34.2 144.6 41.5 8.7 54 55 A D H > S+ 0 0 94 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.907 109.7 43.6 -69.0 -46.8 146.6 39.7 6.0 55 56 A D H > S+ 0 0 36 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.816 112.6 55.6 -69.3 -28.6 148.7 37.6 8.3 56 57 A R H X S+ 0 0 1 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.938 107.5 48.1 -67.0 -44.9 145.6 36.9 10.4 57 58 A R H X S+ 0 0 85 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.845 110.5 53.6 -62.3 -34.4 143.8 35.6 7.3 58 59 A T H X S+ 0 0 46 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.918 111.7 43.2 -67.6 -43.1 146.9 33.5 6.6 59 60 A L H X S+ 0 0 3 -4,-2.2 4,-2.9 2,-0.2 5,-0.3 0.889 111.1 53.9 -71.1 -40.9 146.8 31.9 10.0 60 61 A V H X S+ 0 0 8 -4,-2.7 4,-2.8 2,-0.2 5,-0.2 0.948 111.0 47.2 -57.3 -48.2 143.0 31.4 10.1 61 62 A K H X S+ 0 0 44 -4,-2.0 4,-1.8 2,-0.2 172,-0.3 0.934 114.1 47.1 -58.6 -48.0 143.3 29.5 6.7 62 63 A Y H X S+ 0 0 47 -4,-2.0 4,-2.2 1,-0.2 5,-0.2 0.916 117.2 41.8 -61.5 -46.8 146.2 27.4 8.0 63 64 A L H X S+ 0 0 6 -4,-2.9 4,-2.5 1,-0.2 -32,-0.2 0.836 111.0 56.3 -72.7 -31.2 144.6 26.5 11.3 64 65 A A H < S+ 0 0 1 -4,-2.8 -1,-0.2 -5,-0.3 -2,-0.2 0.835 113.5 40.8 -69.5 -34.0 141.1 25.9 9.7 65 66 A D H >< S+ 0 0 19 -4,-1.8 3,-0.5 -5,-0.2 -2,-0.2 0.923 121.3 40.4 -79.0 -47.8 142.6 23.3 7.3 66 67 A K H 3< S+ 0 0 91 -4,-2.2 2,-0.2 1,-0.2 -2,-0.2 0.914 131.9 22.4 -66.8 -47.7 144.9 21.6 9.8 67 68 A Q T 3< S+ 0 0 34 -4,-2.5 -36,-2.0 -5,-0.2 -1,-0.2 -0.563 92.0 124.3-125.7 68.6 142.5 21.7 12.8 68 69 A G < - 0 0 2 -3,-0.5 2,-0.3 -2,-0.2 -36,-0.2 -0.304 58.9 -88.8-109.8-166.2 139.0 22.0 11.6 69 70 A L - 0 0 3 -38,-0.2 5,-0.1 -5,-0.1 -38,-0.0 -0.839 33.0-117.3-110.6 146.8 135.8 20.0 12.0 70 71 A A > - 0 0 1 -2,-0.3 3,-1.2 1,-0.1 4,-0.5 -0.398 36.7-107.4 -71.6 157.2 134.5 17.1 9.9 71 72 A P G > S+ 0 0 20 0, 0.0 3,-1.8 0, 0.0 4,-0.5 0.940 121.0 52.1 -53.7 -44.7 131.2 17.8 8.1 72 73 A S G 3 S+ 0 0 71 1,-0.3 3,-0.2 2,-0.2 94,-0.0 0.658 99.9 64.0 -67.1 -16.3 129.3 15.5 10.5 73 74 A E G < S+ 0 0 14 -3,-1.2 -1,-0.3 1,-0.2 38,-0.1 0.563 102.9 48.5 -83.6 -9.9 130.8 17.4 13.5 74 75 A T S X S+ 0 0 1 -3,-1.8 3,-2.2 -4,-0.5 4,-0.3 0.461 82.1 133.4-103.1 -6.2 129.0 20.6 12.4 75 76 A D T 3 S+ 0 0 121 -4,-0.5 -3,-0.1 1,-0.3 0, 0.0 -0.209 77.0 4.8 -51.0 122.2 125.6 18.8 11.9 76 77 A G T 3 S+ 0 0 67 1,-0.0 -1,-0.3 0, 0.0 3,-0.1 0.351 121.1 69.6 86.3 -7.5 122.8 20.7 13.5 77 78 A V X + 0 0 13 -3,-2.2 3,-1.0 32,-0.1 4,-0.4 0.135 59.2 106.5-127.1 20.1 124.8 23.8 14.6 78 79 A R T 3> + 0 0 32 -4,-0.3 4,-2.0 1,-0.2 3,-0.4 0.689 61.0 81.4 -72.9 -17.3 125.5 25.3 11.2 79 80 A Y T 34>S+ 0 0 29 1,-0.2 5,-3.0 2,-0.2 -1,-0.2 0.791 85.6 60.1 -57.4 -29.9 123.0 28.1 11.9 80 81 A A T X45S+ 0 0 0 -3,-1.0 3,-1.1 3,-0.2 -1,-0.2 0.923 108.1 40.8 -64.9 -47.9 125.6 29.9 14.0 81 82 A M T 345S+ 0 0 3 -4,-0.4 -2,-0.2 -3,-0.4 -1,-0.2 0.840 113.2 56.8 -68.6 -32.3 128.1 30.2 11.1 82 83 A E T 3<5S- 0 0 21 -4,-2.0 -1,-0.3 2,-0.1 -2,-0.2 0.353 113.2-123.4 -80.3 3.4 125.1 31.1 8.9 83 84 A R T < 5 + 0 0 21 -3,-1.1 2,-1.4 1,-0.2 -3,-0.2 0.842 52.5 159.2 56.5 40.4 124.3 33.9 11.2 84 85 A R > < + 0 0 67 -5,-3.0 3,-1.4 1,-0.2 754,-0.2 -0.666 7.8 170.3 -92.1 77.9 120.8 32.7 12.0 85 86 A L T 3 + 0 0 24 -2,-1.4 754,-1.9 1,-0.3 -1,-0.2 0.482 66.9 64.7 -70.8 -5.6 120.4 34.7 15.2 86 87 A N T 3 S+ 0 0 53 752,-0.2 -1,-0.3 751,-0.2 287,-0.1 0.397 73.6 125.8 -96.0 3.0 116.7 34.1 15.7 87 88 A T < - 0 0 36 -3,-1.4 751,-2.5 750,-0.1 2,-0.8 -0.392 59.2-139.2 -64.5 130.1 117.3 30.3 16.1 88 89 A V - 0 0 76 749,-0.2 749,-0.1 -2,-0.1 2,-0.1 -0.868 27.5-134.0 -92.8 110.8 115.9 29.0 19.3 89 90 A E - 0 0 39 -2,-0.8 2,-0.4 747,-0.1 7,-0.0 -0.393 15.2-158.3 -70.7 146.8 118.5 26.6 20.5 90 91 A Q + 0 0 170 -2,-0.1 2,-0.3 6,-0.0 -1,-0.0 -0.802 35.9 133.9-129.7 86.2 117.8 23.1 21.8 91 92 A F - 0 0 42 -2,-0.4 15,-0.0 1,-0.1 14,-0.0 -0.791 62.1 -81.0-122.3 167.2 120.6 21.8 24.0 92 93 A D > - 0 0 59 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.261 45.6-109.4 -65.0 159.9 120.4 20.0 27.4 93 94 A T H > S+ 0 0 104 1,-0.2 4,-3.1 2,-0.2 5,-0.4 0.887 113.4 56.8 -62.4 -43.6 119.9 22.2 30.5 94 95 A Q H > S+ 0 0 57 1,-0.2 4,-2.1 2,-0.2 5,-0.4 0.919 112.7 42.0 -55.4 -44.9 123.3 21.8 32.0 95 96 A L H >>S+ 0 0 2 3,-0.2 4,-2.7 2,-0.2 5,-0.9 0.929 116.5 48.9 -68.1 -45.2 125.0 23.0 28.8 96 97 A S H X5S+ 0 0 43 -4,-2.2 4,-0.8 3,-0.2 -2,-0.2 0.897 117.4 38.8 -61.2 -47.0 122.4 25.9 28.4 97 98 A E H <5S+ 0 0 64 -4,-3.1 4,-0.2 -5,-0.2 -1,-0.2 0.898 126.7 35.3 -71.6 -43.8 122.6 27.2 31.9 98 99 A T H <5S+ 0 0 14 -4,-2.1 -3,-0.2 -5,-0.4 -2,-0.2 0.945 138.5 10.7 -77.0 -48.5 126.3 26.8 32.3 99 100 A C H <5S+ 0 0 27 -4,-2.7 4,-0.3 -5,-0.4 -3,-0.2 0.495 123.7 50.7-113.3 -8.0 127.5 27.5 28.8 100 101 A G S <> S+ 0 0 0 -5,-0.3 4,-1.9 1,-0.2 3,-0.5 0.704 107.4 69.3 -74.8 -19.8 125.4 26.9 23.0 106 107 A A H 3> S+ 0 0 0 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.778 86.8 63.4 -66.5 -31.3 126.4 26.4 19.3 107 108 A R H 34 S+ 0 0 40 -3,-0.5 -1,-0.2 2,-0.2 -2,-0.2 0.833 108.1 43.8 -62.1 -31.2 129.6 28.3 19.8 108 109 A V H X4 S+ 0 0 14 -3,-0.5 3,-1.2 -4,-0.4 -2,-0.2 0.927 110.7 53.3 -77.2 -48.4 130.6 25.5 22.2 109 110 A A H 3< S+ 0 0 4 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.648 97.2 67.7 -63.7 -17.1 129.4 22.7 19.9 110 111 A L T 3< S+ 0 0 1 -4,-1.2 -78,-0.7 -5,-0.1 2,-0.3 0.056 95.3 70.7 -93.2 25.3 131.5 24.0 17.0 111 112 A Q E < -C 31 0C 23 -3,-1.2 2,-0.4 -80,-0.2 -80,-0.2 -0.966 61.9-155.5-139.8 153.0 134.7 23.1 18.8 112 113 A R E +C 30 0C 23 -82,-2.0 -82,-1.7 -2,-0.3 49,-0.1 -0.988 26.8 156.2-131.8 118.9 136.5 19.8 19.7 113 114 A R - 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