==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 23-JUN-10 3NN0 . COMPND 2 MOLECULE: 6-HYDROXY-L-NICOTINE OXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ARTHROBACTER NICOTINOVORANS; . AUTHOR G.S.KACHALOVA,H.D.BARTUNIK . 425 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17253.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 303 71.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 7.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 13.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 36 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 53 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 106 24.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.2 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 0 0 2 0 1 2 1 1 1 0 0 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 2 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 PARALLEL BRIDGES PER LADDER . 2 1 3 2 1 1 0 0 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 . 1 1 0 0 1 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 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 1 X M 0 0 100 0, 0.0 2,-0.3 0, 0.0 247,-0.3 0.000 360.0 360.0 360.0 160.2 21.6 61.4 49.6 2 2 X Y E -a 248 0A 26 245,-2.0 247,-1.4 1,-0.1 248,-0.2 -0.799 360.0-120.1-129.1 158.7 22.9 64.4 47.6 3 3 X D E S+ 0 0 55 23,-2.0 247,-1.9 -2,-0.3 2,-0.3 0.939 100.5 7.3 -64.6 -43.8 21.6 67.3 45.6 4 4 X A E -ab 250 27A 1 22,-1.6 24,-2.4 245,-0.2 2,-0.5 -0.987 56.7-154.2-142.0 146.3 23.5 66.0 42.6 5 5 X I E -ab 251 28A 0 245,-2.0 247,-3.2 -2,-0.3 2,-0.6 -0.990 15.0-157.9-114.3 124.7 25.6 63.1 41.5 6 6 X V E -ab 252 29A 0 22,-2.9 24,-3.1 -2,-0.5 2,-0.7 -0.925 6.8-156.7-100.7 119.4 28.1 63.9 38.9 7 7 X V E +ab 253 30A 5 245,-3.7 247,-3.1 -2,-0.6 24,-0.2 -0.862 62.1 26.0-101.9 113.4 29.1 60.7 37.0 8 8 X G - 0 0 5 22,-3.4 23,-0.2 -2,-0.7 22,-0.1 0.197 63.5-136.8 104.9 130.2 32.5 61.0 35.3 9 9 X G + 0 0 0 26,-0.2 28,-2.3 4,-0.1 29,-0.1 -0.078 59.6 116.7-116.8 33.1 35.5 63.2 36.2 10 10 X G B > S-i 37 0B 16 244,-0.5 4,-2.1 27,-0.2 28,-0.2 -0.165 91.8 -74.3 -67.3-173.6 36.7 64.6 33.0 11 11 X F H > S+ 0 0 9 26,-0.6 4,-2.0 1,-0.2 5,-0.2 0.819 133.2 56.2 -58.2 -34.4 36.5 68.3 32.5 12 12 X S H > S+ 0 0 6 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.971 111.7 41.2 -63.3 -50.1 32.8 68.3 32.1 13 13 X G H > S+ 0 0 0 241,-0.4 4,-3.0 1,-0.2 5,-0.2 0.845 113.1 55.0 -65.1 -36.7 32.1 66.5 35.4 14 14 X L H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.871 108.6 46.3 -68.5 -40.0 34.7 68.5 37.2 15 15 X K H X S+ 0 0 13 -4,-2.0 4,-2.5 -5,-0.2 5,-0.2 0.923 115.0 46.7 -69.3 -42.6 33.2 71.9 36.3 16 16 X A H X S+ 0 0 0 -4,-2.0 4,-3.1 2,-0.2 5,-0.3 0.968 113.3 47.8 -65.0 -48.6 29.7 70.9 37.1 17 17 X A H X S+ 0 0 0 -4,-3.0 4,-1.7 1,-0.3 -1,-0.2 0.858 115.8 45.9 -63.5 -39.0 30.6 69.3 40.4 18 18 X R H X S+ 0 0 1 -4,-1.9 4,-2.3 -5,-0.2 -1,-0.3 0.853 113.9 46.8 -68.3 -38.0 32.6 72.4 41.3 19 19 X D H X S+ 0 0 34 -4,-2.5 4,-1.3 2,-0.2 -2,-0.2 0.944 112.1 48.6 -79.8 -40.0 30.0 74.9 40.2 20 20 X L H ><>S+ 0 0 0 -4,-3.1 5,-2.3 -5,-0.2 3,-0.6 0.948 112.9 50.5 -57.2 -48.0 27.1 73.2 41.9 21 21 X T H ><5S+ 0 0 29 -4,-1.7 3,-1.9 -5,-0.3 -2,-0.2 0.910 109.5 48.9 -56.1 -44.0 29.3 73.0 45.1 22 22 X N H 3<5S+ 0 0 88 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.766 105.8 58.3 -71.6 -18.4 30.2 76.6 45.0 23 23 X A T <<5S- 0 0 53 -4,-1.3 -1,-0.3 -3,-0.6 -2,-0.2 0.372 128.6-101.1 -88.6 1.1 26.5 77.4 44.5 24 24 X G T < 5S+ 0 0 61 -3,-1.9 -3,-0.2 1,-0.3 2,-0.2 0.647 73.8 142.0 90.6 20.6 25.9 75.6 47.8 25 25 X K < - 0 0 81 -5,-2.3 2,-0.9 -6,-0.1 -1,-0.3 -0.569 57.1-118.0 -92.7 160.2 24.7 72.2 46.6 26 26 X K - 0 0 109 -2,-0.2 -23,-2.0 2,-0.0 -22,-1.6 -0.857 47.7-178.8 -97.8 106.9 25.6 68.9 48.3 27 27 X V E -b 4 0A 4 -2,-0.9 2,-0.4 -24,-0.2 192,-0.3 -0.860 23.2-163.7-119.2 136.4 27.4 67.2 45.4 28 28 X L E -b 5 0A 0 -24,-2.4 -22,-2.9 -2,-0.4 2,-0.6 -0.974 11.1-153.0-115.0 135.9 29.0 63.8 45.0 29 29 X L E -bc 6 220A 0 190,-2.5 192,-2.8 -2,-0.4 2,-0.5 -0.936 7.0-162.7-115.2 122.1 31.4 63.1 42.1 30 30 X L E -bc 7 221A 1 -24,-3.1 -22,-3.4 -2,-0.6 2,-0.5 -0.884 8.0-178.3-106.8 119.9 31.8 59.5 40.9 31 31 X E - 0 0 17 190,-2.6 193,-2.6 -2,-0.5 192,-0.1 -0.959 17.8-156.7-124.6 122.6 34.8 58.5 38.7 32 32 X G S S+ 0 0 18 -2,-0.5 193,-0.3 191,-0.3 -1,-0.1 0.712 73.1 58.0 -67.8 -23.6 35.2 55.0 37.3 33 33 X G S S- 0 0 10 2,-0.3 190,-3.3 191,-0.2 191,-0.3 -0.136 90.3-104.9-103.4-166.3 38.9 55.2 36.9 34 34 X E S S+ 0 0 157 188,-0.2 2,-0.3 189,-0.1 188,-0.1 0.238 97.7 42.1-105.8 11.3 41.9 55.7 39.1 35 35 X R S S- 0 0 67 6,-0.0 -2,-0.3 0, 0.0 2,-0.3 -0.957 75.8-121.6-147.0 163.4 42.7 59.3 37.9 36 36 X L S S+ 0 0 36 -2,-0.3 -26,-0.2 1,-0.1 174,-0.1 -0.783 78.7 62.5-105.7 157.0 40.8 62.4 37.0 37 37 X G B > -i 10 0B 2 -28,-2.3 3,-1.7 -2,-0.3 -26,-0.6 0.006 67.9-156.2 121.2 -27.1 40.8 64.2 33.6 38 38 X G T 3 S+ 0 0 8 1,-0.3 329,-0.1 -28,-0.2 217,-0.0 -0.361 80.0 8.4 62.5-127.5 39.3 61.6 31.3 39 39 X R T 3 S+ 0 0 58 1,-0.2 18,-2.0 -2,-0.1 2,-0.8 0.427 118.2 81.8 -69.5 2.7 40.3 62.2 27.6 40 40 X A < + 0 0 8 -3,-1.7 2,-0.6 16,-0.2 -1,-0.2 -0.799 67.4 165.7-106.1 86.5 42.7 64.8 29.0 41 41 X Y + 0 0 54 -2,-0.8 14,-2.9 -4,-0.1 15,-0.7 -0.906 15.7 175.4-115.9 110.3 45.5 62.4 30.1 42 42 X S E +J 54 0C 23 -2,-0.6 12,-0.2 12,-0.2 2,-0.2 -0.950 21.6 139.0-117.3 115.0 49.0 63.6 30.9 43 43 X R E -J 53 0C 39 10,-1.5 10,-2.6 -2,-0.5 2,-0.3 -0.620 54.2 -65.1-134.3-168.1 51.4 61.0 32.1 44 44 X E E -J 52 0C 111 8,-0.3 8,-0.2 -2,-0.2 -1,-0.0 -0.663 58.9 -95.2 -93.7 146.8 55.0 60.0 31.7 45 45 X S - 0 0 5 6,-3.3 5,-0.2 3,-0.4 6,-0.2 -0.210 17.0-146.1 -59.8 139.0 56.3 58.8 28.4 46 46 X R S S+ 0 0 138 1,-0.1 -1,-0.2 3,-0.1 310,-0.1 0.528 102.7 38.7 -73.9 -2.3 56.5 55.1 27.8 47 47 X N S S+ 0 0 43 1,-0.2 -1,-0.1 4,-0.1 -2,-0.0 0.748 113.5 49.5-115.7 -40.4 59.6 55.7 25.8 48 48 X V S > S- 0 0 23 3,-0.2 3,-2.2 0, 0.0 -3,-0.4 -0.864 81.6-134.6-116.6 95.9 61.5 58.4 27.7 49 49 X P T 3 S+ 0 0 118 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.236 90.7 14.1 -48.7 127.3 61.9 57.8 31.4 50 50 X G T 3 S+ 0 0 65 1,-0.2 2,-0.4 -5,-0.2 -6,-0.0 0.420 96.6 122.0 89.0 2.3 61.1 60.9 33.4 51 51 X L < - 0 0 42 -3,-2.2 -6,-3.3 -6,-0.2 2,-0.6 -0.839 54.1-138.7-107.3 133.1 59.4 62.8 30.6 52 52 X R E -J 44 0C 111 -2,-0.4 2,-0.4 -8,-0.2 -8,-0.3 -0.763 24.7-178.4 -94.7 121.5 55.8 64.1 30.8 53 53 X V E -J 43 0C 1 -10,-2.6 -10,-1.5 -2,-0.6 2,-0.7 -0.881 30.1-126.4-116.0 143.4 53.7 63.8 27.7 54 54 X E E -J 42 0C 10 -2,-0.4 -12,-0.2 -12,-0.2 4,-0.1 -0.794 25.5-178.6 -77.1 111.9 50.1 64.8 26.8 55 55 X I + 0 0 6 -14,-2.9 304,-0.3 -2,-0.7 232,-0.2 0.558 68.7 13.7 -91.4 -6.0 48.4 61.5 25.6 56 56 X G S S+ 0 0 14 -15,-0.7 2,-0.5 1,-0.1 -16,-0.2 -0.121 117.5 5.7-135.7-127.2 45.1 63.1 24.8 57 57 X G + 0 0 34 -18,-2.0 -1,-0.1 1,-0.2 149,-0.1 -0.522 60.1 147.4 -84.3 118.3 43.8 66.6 24.5 58 58 X A + 0 0 7 -2,-0.5 144,-0.5 -4,-0.1 -1,-0.2 0.788 36.9 83.3-115.9 -37.7 46.4 69.3 24.7 59 59 X Y E +K 201 0D 50 142,-0.1 2,-0.3 140,-0.0 349,-0.3 -0.337 40.9 173.1 -86.3 155.1 45.7 72.4 22.6 60 60 X L E -K 200 0D 0 140,-2.1 140,-2.6 -2,-0.1 139,-0.6 -0.973 19.1-156.5-147.8 164.0 43.7 75.5 23.1 61 61 X H >> - 0 0 27 -2,-0.3 4,-1.6 138,-0.2 3,-1.4 -0.896 14.8-148.4-144.6 114.0 43.0 78.9 21.5 62 62 X R T 34 S+ 0 0 85 -2,-0.3 7,-0.2 1,-0.3 8,-0.1 0.781 93.4 54.2 -57.2 -34.6 41.8 81.7 23.7 63 63 X K T 34 S+ 0 0 170 1,-0.2 -1,-0.3 2,-0.1 134,-0.0 0.801 119.0 35.8 -75.6 -21.5 39.7 83.5 21.2 64 64 X H T <4 S+ 0 0 23 -3,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.637 121.4 47.3 -99.6 -16.8 37.8 80.4 20.4 65 65 X H X + 0 0 4 -4,-1.6 4,-2.8 1,-0.1 -1,-0.2 -0.581 57.5 156.5-128.0 65.8 37.8 78.9 23.9 66 66 X P H > S+ 0 0 78 0, 0.0 4,-2.3 0, 0.0 -1,-0.1 0.802 76.7 54.1 -64.7 -27.6 36.8 81.7 26.4 67 67 X R H > S+ 0 0 51 2,-0.2 4,-2.4 1,-0.2 3,-0.3 0.994 110.8 44.3 -73.6 -55.1 35.6 79.2 29.0 68 68 X L H > S+ 0 0 1 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.915 111.5 55.0 -46.2 -48.1 38.9 77.4 29.0 69 69 X A H X S+ 0 0 9 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.926 107.6 49.9 -57.9 -38.6 40.7 80.8 29.0 70 70 X A H X S+ 0 0 54 -4,-2.3 4,-3.4 -3,-0.3 -1,-0.2 0.939 108.7 51.9 -65.9 -44.2 38.7 81.7 32.1 71 71 X E H X S+ 0 0 8 -4,-2.4 4,-2.2 1,-0.2 6,-0.3 0.976 111.8 46.8 -54.3 -52.2 39.6 78.5 33.8 72 72 X L H <>S+ 0 0 1 -4,-2.8 5,-2.0 1,-0.2 4,-0.4 0.920 114.7 46.9 -58.7 -38.4 43.3 79.1 33.1 73 73 X D H ><5S+ 0 0 101 -4,-2.7 3,-0.9 -5,-0.3 -1,-0.2 0.915 108.4 55.3 -70.7 -39.2 43.0 82.7 34.3 74 74 X R H 3<5S+ 0 0 121 -4,-3.4 -2,-0.2 1,-0.2 -1,-0.2 0.942 118.6 32.5 -53.8 -54.6 41.2 81.8 37.5 75 75 X Y T 3<5S- 0 0 55 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.299 106.8-120.2 -90.0 11.1 43.8 79.3 38.7 76 76 X G T < 5 + 0 0 64 -3,-0.9 -3,-0.2 -4,-0.4 -4,-0.1 0.830 47.6 175.1 54.1 37.9 46.9 81.2 37.2 77 77 X I < - 0 0 16 -5,-2.0 2,-0.3 -6,-0.3 -1,-0.2 -0.600 27.4-126.2 -78.8 124.9 47.7 78.2 35.0 78 78 X P - 0 0 60 0, 0.0 125,-1.4 0, 0.0 126,-0.6 -0.528 25.6-172.4 -77.0 136.9 50.6 78.9 32.7 79 79 X T E -L 202 0D 35 -2,-0.3 2,-0.4 123,-0.2 123,-0.2 -0.939 7.9-155.0-117.9 146.4 50.3 78.2 29.0 80 80 X A E -L 201 0D 43 121,-2.1 121,-2.6 -2,-0.4 2,-0.2 -0.971 31.5-104.5-116.0 138.2 53.0 78.4 26.4 81 81 X A E -L 200 0D 83 -2,-0.4 119,-0.2 119,-0.2 3,-0.2 -0.474 55.1 -99.3 -56.9 124.0 52.5 79.1 22.7 82 82 X A - 0 0 27 117,-1.3 -1,-0.1 -2,-0.2 231,-0.0 -0.079 52.0 -68.1 -58.7 145.6 52.9 75.7 20.9 83 83 X S - 0 0 64 230,-0.2 -1,-0.2 1,-0.1 2,-0.1 0.043 56.4-129.2 -28.9 115.5 56.1 74.5 19.1 84 84 X E - 0 0 166 -3,-0.2 2,-0.7 1,-0.1 -1,-0.1 -0.385 15.3-121.7 -71.1 154.5 56.6 76.7 16.0 85 85 X F + 0 0 52 1,-0.1 15,-0.2 -2,-0.1 214,-0.2 -0.885 37.9 162.1-104.6 108.9 57.2 75.0 12.6 86 86 X T + 0 0 100 -2,-0.7 2,-0.4 1,-0.2 213,-0.2 0.438 64.3 52.8 -95.5 -5.4 60.5 76.0 10.9 87 87 X S E -m 299 0E 19 211,-2.2 213,-2.9 209,-0.1 2,-0.5 -0.946 62.2-159.1-144.8 123.3 60.7 73.1 8.5 88 88 X F E +m 300 0E 32 -2,-0.4 213,-0.2 10,-0.3 10,-0.1 -0.849 16.0 167.3-114.0 130.4 58.3 71.6 5.9 89 89 X R + 0 0 62 211,-2.4 -1,-0.1 -2,-0.5 9,-0.0 -0.433 21.6 171.4-134.4 60.8 58.3 68.1 4.5 90 90 X H - 0 0 20 211,-0.2 2,-0.3 1,-0.1 213,-0.2 -0.315 34.4-148.7 -71.5 153.9 55.1 67.6 2.7 91 91 X R B +r 303 0F 106 211,-1.8 213,-1.5 1,-0.1 -1,-0.1 -0.674 57.7 122.3-113.9 69.9 54.0 64.8 0.5 92 92 X L S S- 0 0 12 1,-0.4 3,-0.2 -2,-0.3 4,-0.2 0.090 77.3 -92.6-122.0 21.1 51.7 66.8 -1.7 93 93 X G > - 0 0 50 1,-0.2 3,-1.1 2,-0.1 -1,-0.4 -0.101 54.5 -60.7 90.2 172.7 53.2 66.1 -5.1 94 94 X P T 3 S+ 0 0 138 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.694 125.8 57.0 -73.9 -17.3 55.8 68.0 -7.0 95 95 X T T 3 S+ 0 0 76 -3,-0.2 11,-0.1 2,-0.1 -2,-0.1 0.608 84.4 100.8 -87.4 -15.3 53.9 71.3 -7.4 96 96 X A < - 0 0 26 -3,-1.1 2,-0.4 -4,-0.2 7,-0.2 -0.239 68.3-130.0 -67.8 161.5 53.4 71.9 -3.7 97 97 X V - 0 0 42 5,-1.7 2,-2.5 2,-0.1 -2,-0.1 -0.932 16.4-115.2-124.5 137.7 55.6 74.3 -1.9 98 98 X D S S+ 0 0 99 -2,-0.4 -10,-0.3 -10,-0.1 2,-0.3 -0.421 76.2 95.1 -79.7 76.2 57.4 73.7 1.4 99 99 X Q S S- 0 0 108 -2,-2.5 -2,-0.1 -12,-0.1 -13,-0.1 -0.954 90.6 -89.0-147.9 173.9 55.8 76.1 3.7 100 100 X A S S+ 0 0 55 -2,-0.3 -2,-0.0 1,-0.2 -14,-0.0 0.806 125.9 40.8 -51.9 -35.9 53.0 76.1 6.3 101 101 X F S S+ 0 0 94 1,-0.1 -1,-0.2 2,-0.1 -4,-0.0 -0.906 76.5 178.2-113.8 99.1 50.5 76.9 3.5 102 102 X P + 0 0 0 0, 0.0 -5,-1.7 0, 0.0 -1,-0.1 0.506 33.7 120.7 -94.7 -0.5 51.6 74.8 0.7 103 103 X I - 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