==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 02-JAN-02 1GS6 . COMPND 2 MOLECULE: DISSIMILATORY COPPER-CONTAINING NITRITE REDUCTASE . SOURCE 2 ORGANISM_SCIENTIFIC: ALCALIGENES XYLOSOXIDANS; . AUTHOR M.J.ELLIS,M.PRUDENCIO,F.E.DODD,R.W.STRANGE,G.SAWERS, . 336 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16372.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 211 62.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 29 8.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 76 22.6 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 . 3 0.9 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 . 31 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 19 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 0 1 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 2 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 PARALLEL BRIDGES PER LADDER . 7 1 2 2 0 2 1 2 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 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 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 Q 0 0 140 0, 0.0 2,-0.8 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 49.5 -9.6 30.9 22.4 2 2 X D >> - 0 0 100 1,-0.2 3,-2.3 2,-0.1 4,-0.8 -0.499 360.0-139.6 -56.5 147.6 -9.3 27.9 20.0 3 3 X A T 34 S+ 0 0 2 -2,-0.8 3,-0.5 1,-0.3 -1,-0.2 0.722 92.6 70.5 -88.1 -40.9 -11.6 28.7 17.4 4 4 X D T 34 S+ 0 0 105 1,-0.2 -1,-0.3 -3,-0.0 -2,-0.1 0.721 105.4 44.2 -57.8 -21.6 -13.1 25.4 16.9 5 5 X K T <4 S+ 0 0 191 -3,-2.3 -1,-0.2 2,-0.1 -2,-0.2 0.634 91.2 96.0-102.4 -17.3 -14.8 25.8 20.4 6 6 X L S < S- 0 0 31 -4,-0.8 25,-0.1 -3,-0.5 2,-0.0 -0.337 85.6 -92.6 -69.4 158.0 -16.1 29.4 20.2 7 7 X P - 0 0 79 0, 0.0 25,-1.8 0, 0.0 2,-0.4 -0.380 38.8-143.4 -66.7 157.6 -19.7 30.1 19.2 8 8 X H E -a 32 0A 83 23,-0.2 2,-0.3 -3,-0.1 25,-0.2 -0.941 17.6-179.0-128.2 136.9 -20.4 30.8 15.5 9 9 X T E -a 33 0A 62 23,-2.2 25,-2.6 -2,-0.4 2,-0.4 -0.843 19.8-130.0-133.1 170.7 -22.9 33.2 14.0 10 10 X K E -a 34 0A 156 -2,-0.3 2,-0.3 23,-0.2 25,-0.2 -0.984 14.9-156.1-127.6 127.7 -24.0 34.2 10.5 11 11 X V - 0 0 37 23,-2.0 2,-0.7 -2,-0.4 25,-0.3 -0.774 11.5-140.3-104.0 147.3 -24.2 37.7 9.1 12 12 X T - 0 0 122 -2,-0.3 2,-0.1 9,-0.1 23,-0.1 -0.917 25.0-139.4-109.4 107.5 -26.4 38.7 6.2 13 13 X L - 0 0 32 -2,-0.7 2,-0.3 23,-0.2 54,-0.1 -0.345 15.1-157.2 -69.3 138.2 -24.5 41.3 4.0 14 14 X V - 0 0 55 52,-0.3 52,-0.3 4,-0.1 6,-0.2 -0.814 23.0 -94.6-112.9 166.6 -26.2 44.4 2.5 15 15 X A > - 0 0 64 -2,-0.3 3,-1.4 50,-0.1 49,-0.1 -0.392 56.0 -66.7 -81.8 142.8 -25.4 46.6 -0.5 16 16 X P T 3 S+ 0 0 23 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.377 110.6 38.8 -57.0 149.0 -23.4 49.8 -0.4 17 17 X P T 3 S+ 0 0 26 0, 0.0 154,-2.5 0, 0.0 2,-0.1 -0.990 111.6 66.0 -87.3 7.5 -23.8 52.5 0.7 18 18 X Q B < -D 170 0B 93 -3,-1.4 48,-0.4 152,-0.2 2,-0.3 -0.351 69.1-142.8 -80.4 165.7 -25.3 50.9 3.7 19 19 X V - 0 0 22 150,-0.5 150,-0.1 46,-0.1 3,-0.1 -0.955 28.2-100.3-124.0 141.2 -23.5 48.7 6.2 20 20 X H - 0 0 5 46,-0.5 -7,-0.1 -2,-0.3 -9,-0.0 -0.182 51.0 -84.9 -61.7 154.3 -25.1 45.6 7.9 21 21 X P + 0 0 115 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.252 63.9 146.8 -61.3 141.8 -26.4 46.0 11.5 22 22 X H - 0 0 60 -3,-0.1 2,-0.3 47,-0.0 47,-0.1 -0.959 43.1-101.2-164.3 169.7 -23.8 45.5 14.1 23 23 X E - 0 0 104 -2,-0.3 3,-0.1 1,-0.2 132,-0.1 -0.811 13.4-150.5-104.5 148.4 -22.9 46.8 17.6 24 24 X Q S S+ 0 0 32 -2,-0.3 131,-0.5 1,-0.2 2,-0.3 0.936 87.3 21.0 -73.7 -85.2 -20.3 49.3 18.5 25 25 X A S S- 0 0 60 129,-0.3 2,-0.4 131,-0.1 -1,-0.2 -0.603 82.0-163.1 -82.6 137.0 -19.2 48.3 22.0 26 26 X T - 0 0 25 127,-2.7 129,-0.0 -2,-0.3 -1,-0.0 -0.938 27.2-157.0-124.1 149.3 -20.0 44.6 22.8 27 27 X K + 0 0 218 -2,-0.4 -1,-0.1 2,-0.1 127,-0.0 0.721 69.8 98.7 -85.7 -31.3 -20.2 42.7 26.1 28 28 X S - 0 0 59 1,-0.1 -2,-0.1 125,-0.1 3,-0.1 0.109 68.0-128.0 -52.4 167.1 -19.6 39.4 24.2 29 29 X G - 0 0 37 1,-0.2 -1,-0.1 43,-0.0 -2,-0.1 -0.643 54.3 -43.3-112.8 171.7 -16.4 37.5 23.8 30 30 X P - 0 0 22 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.063 59.5-179.8 -37.5 132.8 -14.8 36.2 20.6 31 31 X K - 0 0 58 39,-0.2 43,-2.5 -25,-0.1 2,-0.6 -0.807 33.9-117.1-125.3 172.7 -17.0 34.5 18.0 32 32 X V E -ab 8 74A 0 -25,-1.8 -23,-2.2 -2,-0.3 2,-0.5 -0.979 35.8-155.6-106.4 115.4 -16.4 32.9 14.6 33 33 X V E -ab 9 75A 9 41,-3.1 43,-2.7 -2,-0.6 2,-0.4 -0.897 5.6-147.3-105.0 129.9 -18.4 35.2 12.3 34 34 X E E +ab 10 76A 55 -25,-2.6 -23,-2.0 -2,-0.5 2,-0.3 -0.781 21.0 169.2-104.1 132.4 -19.5 33.6 9.1 35 35 X F E - b 0 77A 4 41,-2.6 43,-2.5 -2,-0.4 2,-0.4 -0.981 16.3-157.8-135.9 156.8 -19.9 35.2 5.7 36 36 X T E + b 0 78A 84 -2,-0.3 2,-0.3 -25,-0.3 -23,-0.2 -0.992 12.3 178.4-130.0 137.5 -20.5 34.2 2.2 37 37 X M E - b 0 79A 0 41,-2.4 43,-2.6 -2,-0.4 2,-0.4 -0.996 14.2-152.5-140.7 144.3 -19.8 36.1 -1.1 38 38 X T E - b 0 80A 46 -2,-0.3 21,-4.0 41,-0.2 2,-0.4 -0.897 16.5-133.8-110.3 136.7 -20.1 35.4 -4.7 39 39 X I E -I 58 0C 6 41,-2.1 2,-0.4 -2,-0.4 19,-0.2 -0.813 23.3-165.8 -85.1 139.4 -17.9 36.9 -7.5 40 40 X E E -I 57 0C 84 17,-3.0 17,-2.1 -2,-0.4 2,-0.5 -0.980 12.2-156.4-131.1 118.4 -19.9 38.2 -10.5 41 41 X E E +I 56 0C 36 -2,-0.4 2,-0.3 15,-0.2 15,-0.2 -0.810 35.2 150.6 -87.0 127.4 -18.4 39.1 -13.9 42 42 X K E -I 55 0C 70 13,-1.9 13,-2.2 -2,-0.5 2,-0.4 -0.984 48.8-114.6-158.5 153.4 -20.8 41.6 -15.6 43 43 X K E -I 54 0C 91 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.743 41.6-172.1 -88.7 124.3 -20.9 44.5 -18.1 44 44 X M E -I 53 0C 40 9,-2.5 9,-2.3 -2,-0.4 2,-0.6 -0.936 28.2-122.0-125.5 153.4 -22.0 47.7 -16.4 45 45 X V E -I 52 0C 83 -2,-0.3 7,-0.2 7,-0.2 6,-0.1 -0.799 28.8-179.6 -87.1 121.8 -23.0 51.2 -17.5 46 46 X I + 0 0 0 5,-2.3 172,-2.6 -2,-0.6 2,-0.2 0.585 57.1 22.3-106.4 -11.4 -20.6 53.7 -15.7 47 47 X D S S- 0 0 21 4,-0.7 3,-0.4 170,-0.2 164,-0.0 -0.683 82.4 -97.9-136.0-162.0 -21.7 57.2 -16.8 48 48 X D S S+ 0 0 127 -2,-0.2 -3,-0.0 1,-0.2 169,-0.0 0.278 113.2 63.3-106.5 8.1 -24.7 59.0 -18.3 49 49 X K S S- 0 0 182 2,-0.0 -1,-0.2 0, 0.0 -3,-0.0 -0.008 119.8-100.3-114.0 14.5 -23.5 58.8 -21.9 50 50 X G + 0 0 46 -3,-0.4 -2,-0.1 1,-0.2 2,-0.1 0.607 61.3 164.1 76.6 17.6 -23.6 55.1 -22.0 51 51 X T - 0 0 13 -6,-0.1 -5,-2.3 1,-0.0 -4,-0.7 -0.408 23.2-149.0 -67.1 141.4 -20.0 54.1 -21.4 52 52 X T E -I 45 0C 23 136,-0.3 2,-0.4 -7,-0.2 -7,-0.2 -0.849 13.1-161.6-113.0 157.0 -19.5 50.5 -20.4 53 53 X L E -I 44 0C 19 -9,-2.3 -9,-2.5 -2,-0.3 2,-1.1 -0.999 22.6-133.7-131.7 135.4 -17.1 48.6 -18.3 54 54 X Q E -I 43 0C 24 -2,-0.4 -11,-0.2 -11,-0.2 2,-0.1 -0.756 48.3-167.2 -85.7 100.1 -16.4 44.8 -18.3 55 55 X A E -I 42 0C 0 -13,-2.2 -13,-1.9 -2,-1.1 2,-0.4 -0.446 31.8-157.5-103.3 157.5 -16.5 44.5 -14.5 56 56 X M E +I 41 0C 0 86,-1.8 2,-0.3 -15,-0.2 -15,-0.2 -0.971 29.7 170.0-130.7 116.1 -15.5 42.0 -11.9 57 57 X T E -I 40 0C 1 -17,-2.1 -17,-3.0 -2,-0.4 2,-0.5 -0.927 38.7-119.2-132.7 152.3 -17.3 42.5 -8.6 58 58 X F E > S-IJ 39 61C 2 3,-0.6 3,-1.6 85,-0.4 -19,-0.2 -0.799 103.5 -8.7 -86.1 125.9 -18.0 40.8 -5.2 59 59 X N T 3 S- 0 0 61 -21,-4.0 -1,-0.2 -2,-0.5 -20,-0.1 0.733 122.1 -71.3 57.9 25.1 -21.7 40.2 -4.8 60 60 X G T 3 S+ 0 0 13 -3,-0.5 2,-0.3 -22,-0.3 -1,-0.3 0.567 108.2 100.3 75.1 6.4 -22.5 42.2 -8.0 61 61 X S B < S-J 58 0C 28 -3,-1.6 -3,-0.6 82,-0.0 -1,-0.2 -0.887 71.4-107.9-123.1 160.6 -21.7 45.7 -6.5 62 62 X M S S+ 0 0 7 -2,-0.3 2,-0.2 153,-0.2 111,-0.1 -0.997 108.0 25.5-123.4 118.2 -18.8 48.2 -6.6 63 63 X P S S- 0 0 1 0, 0.0 83,-0.2 0, 0.0 3,-0.1 0.751 102.4-118.1 -77.1 179.6 -17.5 48.3 -4.0 64 64 X G - 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