==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 20-NOV-11 3VKP . COMPND 2 MOLECULE: NITRITE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: NICOTIANA TABACUM; . AUTHOR S.NAKANO,M.TAKAHASHI,A.SAKAMOTO,H.MORIKAWA,K.KATAYANAGI . 538 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21178.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 355 66.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 3.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 88 16.4 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 . 3 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.6 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 . 20 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 80 14.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 118 21.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.3 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 4 1 0 0 3 0 1 2 2 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 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 0 0 PARALLEL BRIDGES PER LADDER . 3 4 2 4 3 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 ANTIPARALLEL BRIDGES PER LADDER . 3 0 0 3 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 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 18 A V 0 0 121 0, 0.0 5,-0.0 0, 0.0 299,-0.0 0.000 360.0 360.0 360.0 116.2 -42.9 7.2 -46.1 2 19 A A > - 0 0 65 1,-0.1 3,-1.5 3,-0.0 4,-0.4 -0.302 360.0-119.5 -64.7 148.4 -40.4 9.6 -47.7 3 20 A A G > S+ 0 0 88 1,-0.3 3,-1.4 2,-0.2 -1,-0.1 0.794 111.6 65.6 -59.3 -31.5 -37.3 8.1 -49.4 4 21 A E G > S+ 0 0 164 1,-0.3 3,-1.2 2,-0.2 -1,-0.3 0.754 89.5 66.6 -63.4 -26.2 -35.1 10.1 -47.0 5 22 A R G < S+ 0 0 28 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.741 94.8 59.4 -64.8 -23.2 -36.5 8.0 -44.1 6 23 A L G < S+ 0 0 51 -3,-1.4 -1,-0.2 -4,-0.4 -2,-0.2 0.374 72.9 118.4 -93.2 3.5 -34.8 5.0 -45.5 7 24 A E S < S- 0 0 80 -3,-1.2 -3,-0.0 -4,-0.1 2,-0.0 -0.577 77.2-108.2 -68.8 124.0 -31.2 6.3 -45.4 8 25 A P - 0 0 45 0, 0.0 274,-0.2 0, 0.0 273,-0.1 -0.324 26.8-157.4 -54.3 133.3 -29.1 4.1 -43.1 9 26 A R + 0 0 54 272,-2.7 11,-3.0 271,-0.1 2,-0.3 0.591 69.1 57.8 -95.4 -12.8 -28.5 6.1 -39.9 10 27 A V E -A 19 0A 3 9,-0.3 2,-0.3 271,-0.1 9,-0.2 -0.800 63.0-165.6-114.6 158.4 -25.4 4.2 -38.8 11 28 A E E -A 18 0A 57 7,-2.7 7,-2.7 -2,-0.3 2,-0.5 -0.979 28.0-106.5-139.9 153.1 -22.0 3.6 -40.5 12 29 A E E +A 17 0A 103 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.685 39.9 173.8 -78.6 126.0 -19.0 1.3 -40.0 13 30 A K E > -A 16 0A 105 3,-3.2 3,-1.5 -2,-0.5 -2,-0.0 -0.940 66.3 -24.2-138.6 114.2 -16.0 3.2 -38.6 14 31 A D T 3 S- 0 0 144 -2,-0.4 3,-0.1 1,-0.3 -2,-0.0 0.842 127.9 -43.7 54.3 43.8 -12.9 1.4 -37.5 15 32 A G T 3 S+ 0 0 39 1,-0.3 2,-0.3 185,-0.0 -1,-0.3 0.334 124.1 84.6 91.4 -6.2 -14.6 -2.0 -36.9 16 33 A Y E < S-A 13 0A 18 -3,-1.5 -3,-3.2 184,-0.1 2,-0.5 -0.820 74.7-118.0-125.8 164.1 -17.6 -0.6 -35.0 17 34 A W E +A 12 0A 58 182,-0.4 2,-0.3 -2,-0.3 -5,-0.2 -0.916 36.7 173.9-109.9 122.4 -21.0 0.8 -36.0 18 35 A I E -A 11 0A 22 -7,-2.7 -7,-2.7 -2,-0.5 2,-0.2 -0.911 37.8 -94.8-128.4 149.8 -21.8 4.3 -35.0 19 36 A L E -A 10 0A 2 -2,-0.3 -9,-0.3 -9,-0.2 5,-0.1 -0.438 48.6-109.8 -59.6 131.4 -24.5 6.9 -35.6 20 37 A K > - 0 0 33 -11,-3.0 3,-2.2 -2,-0.2 -1,-0.1 -0.311 28.4-110.8 -59.7 147.2 -23.8 9.2 -38.5 21 38 A E G > S+ 0 0 114 1,-0.3 3,-0.6 2,-0.1 -1,-0.1 0.823 118.0 51.0 -50.6 -38.4 -23.0 12.8 -37.6 22 39 A Q G 3 S+ 0 0 105 1,-0.2 -1,-0.3 2,-0.1 3,-0.2 0.485 104.7 58.9 -82.9 -2.9 -26.3 14.0 -39.1 23 40 A F G < S+ 0 0 46 -3,-2.2 -1,-0.2 -14,-0.2 -2,-0.1 -0.235 79.8 87.7-118.3 43.7 -28.4 11.4 -37.3 24 41 A R X + 0 0 80 -3,-0.6 3,-1.1 -5,-0.1 2,-0.2 0.446 54.6 115.1-117.2 -6.5 -27.5 12.3 -33.7 25 42 A K T 3 S+ 0 0 205 1,-0.2 -3,-0.0 -3,-0.2 0, 0.0 -0.465 85.9 3.3 -68.2 133.8 -30.1 15.0 -33.0 26 43 A G T 3 S+ 0 0 76 1,-0.2 -1,-0.2 -2,-0.2 261,-0.1 0.549 88.2 155.2 74.5 10.3 -32.7 14.2 -30.3 27 44 A I < - 0 0 20 -3,-1.1 259,-0.2 1,-0.1 -1,-0.2 -0.306 45.2-106.1 -70.3 152.3 -31.2 10.8 -29.3 28 45 A N > - 0 0 10 257,-2.0 4,-1.3 258,-0.3 3,-0.3 -0.192 34.2-100.2 -72.2 167.5 -31.8 9.4 -25.9 29 46 A P H > S+ 0 0 79 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.807 120.7 58.6 -62.3 -29.3 -29.1 9.3 -23.2 30 47 A Q H > S+ 0 0 61 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.898 103.6 52.4 -67.2 -38.4 -28.2 5.6 -23.8 31 48 A E H > S+ 0 0 1 -3,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.868 106.9 53.6 -61.2 -36.5 -27.4 6.5 -27.4 32 49 A K H X S+ 0 0 106 -4,-1.3 4,-2.6 2,-0.2 -2,-0.2 0.883 105.4 53.3 -67.0 -38.3 -25.1 9.2 -26.1 33 50 A V H X S+ 0 0 8 -4,-1.8 4,-1.7 1,-0.2 -2,-0.2 0.922 108.5 50.1 -58.4 -45.1 -23.3 6.6 -23.9 34 51 A K H < S+ 0 0 10 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.853 113.2 45.8 -65.8 -35.5 -22.7 4.4 -27.0 35 52 A I H < S+ 0 0 54 -4,-1.8 3,-0.2 1,-0.2 -1,-0.2 0.910 106.5 58.8 -70.6 -43.8 -21.3 7.4 -28.9 36 53 A E H < S- 0 0 94 -4,-2.6 2,-0.3 1,-0.3 -2,-0.2 0.869 129.8 -5.5 -56.6 -42.8 -19.1 8.6 -26.1 37 54 A K S < S- 0 0 61 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.0 -0.907 77.1-113.4-156.1 132.6 -17.3 5.2 -26.0 38 55 A E > - 0 0 14 -2,-0.3 3,-1.3 -3,-0.2 4,-0.4 -0.468 21.9-149.9 -64.2 115.1 -17.9 2.0 -27.9 39 56 A P T > S+ 0 0 1 0, 0.0 3,-1.8 0, 0.0 4,-0.4 0.865 91.8 63.8 -56.6 -36.9 -19.0 -0.6 -25.4 40 57 A M T >> S+ 0 0 0 1,-0.3 4,-3.1 2,-0.2 3,-1.1 0.719 85.4 74.2 -63.7 -20.6 -17.6 -3.5 -27.4 41 58 A K H <> S+ 0 0 78 -3,-1.3 6,-1.9 1,-0.2 4,-1.6 0.792 82.9 69.2 -61.1 -27.6 -14.1 -2.1 -26.9 42 59 A L H <4 S+ 0 0 3 -3,-1.8 6,-2.4 -4,-0.4 7,-0.3 0.846 118.0 20.7 -59.0 -33.8 -14.2 -3.3 -23.3 43 60 A F H X4 S+ 0 0 63 -3,-1.1 3,-1.2 -4,-0.4 -2,-0.2 0.871 127.9 45.5 -95.3 -55.4 -14.1 -6.9 -24.6 44 61 A M H 3< S+ 0 0 73 -4,-3.1 -3,-0.2 1,-0.3 -2,-0.1 0.716 126.3 30.4 -72.3 -24.7 -12.6 -6.6 -28.2 45 62 A E T 3< S- 0 0 113 -4,-1.6 -1,-0.3 -5,-0.3 -3,-0.1 0.106 112.0-115.6-114.3 16.9 -9.8 -4.3 -27.2 46 63 A N X> + 0 0 75 -3,-1.2 3,-1.2 1,-0.1 4,-0.5 0.799 60.9 153.4 53.9 34.9 -9.5 -5.7 -23.7 47 64 A G H 3> + 0 0 31 -6,-1.9 4,-1.9 1,-0.2 3,-0.4 0.780 63.2 71.4 -60.4 -25.5 -10.6 -2.4 -22.1 48 65 A I H 3> S+ 0 0 2 -6,-2.4 4,-2.8 1,-0.2 -1,-0.2 0.815 83.7 68.3 -61.6 -31.2 -11.9 -4.4 -19.2 49 66 A E H <4 S+ 0 0 80 -3,-1.2 4,-0.4 -7,-0.3 -1,-0.2 0.926 109.6 32.3 -57.5 -49.1 -8.3 -5.3 -18.0 50 67 A E H >X S+ 0 0 115 -4,-0.5 3,-1.0 -3,-0.4 4,-0.6 0.876 117.1 55.8 -77.2 -38.3 -7.5 -1.7 -17.0 51 68 A L H >< S+ 0 0 7 -4,-1.9 3,-1.5 1,-0.2 -2,-0.2 0.914 101.5 58.3 -57.2 -44.7 -11.0 -0.8 -15.9 52 69 A A T 3< S+ 0 0 6 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.664 100.2 58.4 -63.1 -18.5 -11.2 -3.7 -13.5 53 70 A K T <4 S+ 0 0 138 -3,-1.0 -1,-0.3 -4,-0.4 -2,-0.2 0.676 84.1 94.4 -83.4 -21.7 -8.1 -2.4 -11.6 54 71 A I S << S- 0 0 50 -3,-1.5 5,-0.1 -4,-0.6 82,-0.0 -0.592 86.7-112.3 -77.0 126.5 -9.7 0.9 -10.7 55 72 A P >> - 0 0 78 0, 0.0 4,-2.2 0, 0.0 3,-0.8 -0.325 24.3-123.5 -57.1 139.5 -11.4 1.0 -7.3 56 73 A I H 3> S+ 0 0 31 1,-0.3 4,-2.2 2,-0.2 5,-0.1 0.828 110.4 58.5 -58.9 -34.1 -15.1 1.3 -7.7 57 74 A E H 34 S+ 0 0 121 1,-0.2 -1,-0.3 2,-0.2 4,-0.2 0.880 110.0 45.1 -62.6 -36.1 -15.3 4.4 -5.5 58 75 A E H X4 S+ 0 0 112 -3,-0.8 3,-1.4 1,-0.2 4,-0.3 0.882 108.7 56.3 -71.7 -41.6 -12.9 6.1 -8.0 59 76 A I H >< S+ 0 0 0 -4,-2.2 3,-1.4 1,-0.3 7,-0.4 0.896 102.3 57.0 -55.0 -42.1 -14.9 4.7 -11.0 60 77 A D T 3< S+ 0 0 35 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.597 92.1 72.1 -67.9 -12.0 -18.0 6.4 -9.6 61 78 A Q T < S+ 0 0 162 -3,-1.4 2,-0.4 -4,-0.2 -1,-0.2 0.550 96.2 52.1 -84.9 -8.3 -16.3 9.9 -9.6 62 79 A S S <> S- 0 0 50 -3,-1.4 4,-2.4 -4,-0.3 5,-0.2 -0.994 73.2-138.3-131.1 140.0 -16.3 10.2 -13.5 63 80 A K H > S+ 0 0 122 -2,-0.4 4,-3.0 1,-0.2 5,-0.3 0.902 101.6 56.1 -57.2 -46.8 -19.2 9.9 -15.9 64 81 A L H > S+ 0 0 80 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.916 115.0 35.7 -55.6 -50.0 -17.2 7.9 -18.5 65 82 A T H > S+ 0 0 26 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.837 114.9 55.0 -78.2 -33.0 -16.2 5.1 -16.1 66 83 A K H X S+ 0 0 78 -4,-2.4 4,-2.4 -7,-0.4 5,-0.2 0.924 110.5 47.6 -62.8 -43.1 -19.4 5.1 -14.2 67 84 A D H X>S+ 0 0 27 -4,-3.0 5,-2.4 -5,-0.2 4,-2.2 0.846 106.4 60.4 -63.0 -35.4 -21.2 4.6 -17.5 68 85 A D H <>S+ 0 0 3 -4,-1.4 5,-2.1 -5,-0.3 -2,-0.2 0.954 114.6 32.4 -55.3 -50.8 -18.6 1.9 -18.2 69 86 A I H <5S+ 0 0 0 -4,-2.1 11,-0.6 3,-0.2 -2,-0.2 0.801 125.8 41.1 -81.9 -28.2 -19.7 -0.2 -15.2 70 87 A D H <5S+ 0 0 34 -4,-2.4 -3,-0.2 -5,-0.2 -2,-0.2 0.703 135.8 4.0 -89.9 -23.3 -23.4 0.7 -15.2 71 88 A V T ><5S+ 0 0 23 -4,-2.2 3,-1.5 -5,-0.2 4,-0.3 0.672 124.4 49.9-128.4 -60.2 -24.1 0.6 -18.9 72 89 A R G > XS+ 0 0 0 -5,-2.1 5,-2.3 -6,-0.4 3,-1.8 0.703 83.6 75.6 -64.3 -17.9 -20.5 -3.6 -19.2 74 91 A K G X 5S+ 0 0 43 -3,-1.5 83,-1.3 1,-0.3 3,-1.2 0.747 84.0 65.8 -65.3 -21.5 -23.9 -5.1 -20.2 75 92 A W G < 5S+ 0 0 0 -3,-2.0 80,-3.2 -4,-0.3 -1,-0.3 0.660 104.4 44.9 -68.7 -17.5 -22.3 -5.7 -23.6 76 93 A L G < 5S- 0 0 0 -3,-1.8 -1,-0.3 78,-0.2 -2,-0.2 0.136 127.7-104.3-106.8 13.6 -20.1 -8.2 -21.7 77 94 A G T < 5S+ 0 0 0 -3,-1.2 15,-2.4 1,-0.2 2,-0.5 0.706 79.0 134.3 72.3 23.0 -23.1 -9.5 -19.8 78 95 A L E < -B 91 0B 0 -5,-2.3 2,-0.6 13,-0.2 -1,-0.2 -0.929 34.2-170.2-113.5 127.1 -22.3 -7.7 -16.6 79 96 A F E -B 90 0B 14 11,-2.9 11,-2.4 -2,-0.5 2,-0.3 -0.924 16.7-140.4-125.3 103.2 -25.0 -5.9 -14.7 80 97 A H E -B 89 0B 9 -11,-0.6 2,-1.4 -2,-0.6 9,-0.2 -0.478 5.6-150.1 -66.4 124.0 -24.1 -3.6 -11.8 81 98 A R > + 0 0 34 7,-2.7 4,-2.3 4,-0.4 7,-0.3 -0.521 33.5 163.7 -88.6 64.1 -26.6 -4.0 -9.0 82 99 A R T 4 + 0 0 61 -2,-1.4 4,-0.3 1,-0.2 -1,-0.2 0.890 66.9 34.2 -56.9 -48.3 -26.0 -0.4 -8.0 83 100 A K T 4 S+ 0 0 138 -3,-0.2 3,-0.3 2,-0.1 -1,-0.2 0.926 130.3 26.3 -74.9 -46.3 -29.1 0.1 -5.8 84 101 A N T 4 S+ 0 0 60 344,-0.4 -2,-0.2 1,-0.2 -1,-0.1 0.590 137.1 17.5-103.9 -12.9 -29.7 -3.3 -4.2 85 102 A Q S >< S- 0 0 15 -4,-2.3 3,-2.0 343,-0.2 -4,-0.4 -0.348 84.4-154.4-153.1 63.1 -26.3 -5.0 -4.1 86 103 A Y T 3 S+ 0 0 91 -4,-0.3 -4,-0.2 -3,-0.3 3,-0.1 -0.046 74.8 13.3 -50.7 135.1 -23.8 -2.2 -4.6 87 104 A G T 3 S+ 0 0 14 1,-0.3 49,-0.5 -31,-0.1 2,-0.3 0.438 105.3 105.6 81.0 0.5 -20.4 -3.1 -6.1 88 105 A R E < - 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