==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 18-JAN-06 2FQD . COMPND 2 MOLECULE: BLUE COPPER OXIDASE CUEO; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR X.LI,Z.WEI,M.ZHANG,M.TENG,W.GONG . 464 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16904.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 307 66.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 44 9.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 112 24.1 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 . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 1.3 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 . 56 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 29 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 1 2 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 2 0 0 3 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 PARALLEL BRIDGES PER LADDER . 4 2 7 3 3 1 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 . 0 1 0 4 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 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 30 A E 0 0 37 0, 0.0 191,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 44.8 31.6 27.6 9.9 2 31 A R + 0 0 191 190,-0.9 2,-0.1 189,-0.3 190,-0.1 0.776 360.0 69.8-127.4 -63.0 31.6 31.4 10.3 3 32 A P S S- 0 0 63 0, 0.0 191,-2.5 0, 0.0 -1,-0.1 -0.441 88.1-108.7 -64.6 141.7 29.2 33.0 12.8 4 33 A T B -a 194 0A 108 189,-0.2 191,-0.2 1,-0.1 -2,-0.1 -0.417 42.2 -92.4 -67.7 147.6 30.3 32.2 16.4 5 34 A L - 0 0 8 189,-2.6 -1,-0.1 284,-0.1 183,-0.1 -0.448 41.5-123.5 -62.2 118.0 27.9 29.8 18.2 6 35 A P - 0 0 54 0, 0.0 184,-0.1 0, 0.0 -1,-0.1 -0.434 23.6-150.8 -63.3 139.8 25.3 31.7 20.1 7 36 A I - 0 0 53 -2,-0.1 3,-0.1 147,-0.1 147,-0.1 -0.954 13.3-126.1-118.6 113.2 25.3 30.9 23.8 8 37 A P - 0 0 18 0, 0.0 2,-0.1 0, 0.0 37,-0.0 -0.310 35.9-105.0 -53.3 134.0 22.1 31.1 25.9 9 38 A D - 0 0 132 1,-0.1 39,-2.8 38,-0.0 2,-0.8 -0.420 29.2-121.2 -63.9 133.3 22.5 33.3 29.0 10 39 A L E -f 48 0B 61 37,-0.2 2,-0.6 -2,-0.1 39,-0.2 -0.714 32.5-156.1 -77.9 108.2 22.7 31.2 32.1 11 40 A L E +f 49 0B 42 37,-2.6 39,-2.8 -2,-0.8 2,-0.2 -0.819 16.0 177.5 -99.8 115.8 19.8 32.6 34.2 12 41 A T - 0 0 76 -2,-0.6 39,-0.1 37,-0.2 6,-0.1 -0.651 36.7 -76.9-108.7 168.2 19.9 32.3 38.0 13 42 A T - 0 0 49 37,-0.3 6,-0.2 -2,-0.2 -1,-0.1 -0.211 42.2-133.3 -55.4 150.4 17.7 33.4 40.9 14 43 A D > - 0 0 84 4,-1.8 3,-1.6 1,-0.0 -1,-0.1 -0.182 44.2 -76.7 -91.1-168.3 17.7 37.0 42.0 15 44 A A T 3 S+ 0 0 99 1,-0.3 -2,-0.1 2,-0.1 -1,-0.0 0.677 134.1 50.1 -70.9 -17.3 17.9 38.1 45.7 16 45 A R T 3 S- 0 0 199 2,-0.1 -1,-0.3 42,-0.1 3,-0.1 0.184 120.6-106.5-103.4 16.5 14.2 37.2 46.2 17 46 A N S < S+ 0 0 94 -3,-1.6 41,-2.5 1,-0.2 2,-0.3 0.847 78.4 131.3 59.7 39.7 14.6 33.7 44.7 18 47 A R E -j 58 0C 84 39,-0.2 -4,-1.8 -6,-0.1 2,-0.4 -0.860 42.1-161.5-119.9 157.2 12.7 34.7 41.5 19 48 A I E -j 59 0C 3 39,-2.1 41,-2.9 -2,-0.3 2,-0.5 -0.998 13.2-144.8-136.7 131.6 13.4 34.3 37.8 20 49 A Q E -j 60 0C 49 -2,-0.4 2,-0.5 39,-0.2 41,-0.2 -0.882 15.3-178.2-103.7 124.7 11.7 36.4 35.1 21 50 A L E -j 61 0C 0 39,-3.0 41,-2.7 -2,-0.5 2,-0.5 -0.988 6.4-166.1-119.4 122.5 10.8 34.9 31.7 22 51 A T E -j 62 0C 54 -2,-0.5 19,-2.4 39,-0.2 2,-0.7 -0.929 9.3-151.1-109.7 128.1 9.2 37.1 29.1 23 52 A I E +jK 63 40C 0 39,-3.4 41,-3.0 -2,-0.5 2,-0.3 -0.877 36.5 148.7-100.9 113.3 7.6 35.5 26.0 24 53 A G E - K 0 39C 15 15,-2.3 15,-2.4 -2,-0.7 2,-0.3 -0.938 42.5-115.2-145.3 161.4 7.8 37.9 23.0 25 54 A A E + K 0 38C 62 39,-0.5 13,-0.2 -2,-0.3 2,-0.2 -0.718 42.6 136.6 -96.1 150.7 8.1 38.2 19.3 26 55 A G E - K 0 37C 15 11,-3.4 11,-2.9 17,-0.4 2,-0.4 -0.801 46.7 -69.3-161.7-150.1 11.0 39.8 17.4 27 56 A Q E + K 0 36C 100 9,-0.3 2,-0.3 -2,-0.2 9,-0.2 -0.953 32.7 179.9-128.9 132.7 13.3 39.4 14.4 28 57 A S E - K 0 35C 16 7,-2.8 7,-2.9 -2,-0.4 2,-0.5 -0.899 21.4-133.7-122.8 161.3 16.0 37.0 13.5 29 58 A T E + K 0 34C 91 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.977 20.1 179.8-117.6 125.3 18.2 36.7 10.4 30 59 A F E > S- K 0 33C 16 3,-2.2 3,-2.0 -2,-0.5 160,-0.1 -0.996 74.3 -19.6-121.6 123.8 18.8 33.4 8.7 31 60 A G T 3 S- 0 0 76 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.888 125.7 -52.9 46.4 50.5 21.0 33.4 5.5 32 61 A G T 3 S+ 0 0 70 1,-0.1 2,-0.5 -3,-0.1 -1,-0.3 0.136 118.5 103.9 79.6 -21.7 20.5 37.2 4.9 33 62 A K E < -K 30 0C 124 -3,-2.0 -3,-2.2 132,-0.1 -1,-0.1 -0.842 66.2-134.9-101.5 126.3 16.7 37.0 5.0 34 63 A T E -K 29 0C 73 -2,-0.5 2,-0.3 -5,-0.2 -5,-0.2 -0.428 22.7-172.1 -80.8 152.6 15.0 38.3 8.2 35 64 A A E -K 28 0C 0 -7,-2.9 -7,-2.8 -2,-0.1 2,-0.3 -0.998 31.1-108.7-145.3 143.2 12.1 36.5 9.8 36 65 A T E +K 27 0C 49 -2,-0.3 131,-0.4 -9,-0.2 2,-0.3 -0.574 49.6 177.0 -66.8 128.7 9.6 37.1 12.6 37 66 A T E -K 26 0C 0 -11,-2.9 -11,-3.4 -2,-0.3 2,-0.3 -0.937 24.2-133.6-137.0 158.5 10.7 34.8 15.5 38 67 A W E +K 25 0C 16 87,-2.6 7,-0.9 -2,-0.3 2,-0.3 -0.866 29.9 160.8-113.4 148.5 9.6 34.1 19.1 39 68 A G E -Kl 24 45C 0 -15,-2.4 -15,-2.3 -2,-0.3 2,-0.5 -0.988 40.9-111.1-158.8 164.9 11.8 33.8 22.2 40 69 A Y E S-K 23 0C 3 5,-2.9 -17,-0.2 88,-0.3 4,-0.2 -0.921 106.0 -10.2-100.3 125.0 12.1 33.8 25.9 41 70 A N S S+ 0 0 76 -19,-2.4 2,-0.3 -2,-0.5 -1,-0.2 0.865 141.4 28.7 52.2 41.8 14.0 36.9 27.1 42 71 A G S S- 0 0 42 -20,-0.4 -18,-0.4 -3,-0.3 -3,-0.3 -0.956 101.9 -76.2 160.4-178.2 15.0 37.6 23.5 43 72 A N S S+ 0 0 86 -2,-0.3 -17,-0.4 1,-0.2 2,-0.3 0.651 107.4 26.0 -82.6 -20.5 13.8 37.2 19.9 44 73 A L S S- 0 0 37 -4,-0.2 -5,-0.3 -19,-0.1 -1,-0.2 -0.997 113.8 -22.4-151.9 141.8 14.7 33.5 19.5 45 74 A L B S-l 39 0C 8 81,-2.1 -5,-2.9 -7,-0.9 83,-0.2 -0.301 78.7-111.6 53.8-131.6 15.0 30.4 21.7 46 75 A G - 0 0 11 -7,-0.2 -5,-0.1 81,-0.1 83,-0.1 -0.974 25.5 -67.1 180.0 176.6 15.7 31.3 25.3 47 76 A P - 0 0 7 0, 0.0 83,-2.4 0, 0.0 2,-0.8 -0.211 44.4-106.4 -79.8 171.8 18.1 31.3 28.3 48 77 A A E -fg 10 130B 0 -39,-2.8 -37,-2.6 81,-0.2 2,-0.5 -0.909 33.9-148.0 -99.9 103.9 19.5 28.4 30.3 49 78 A V E -fg 11 131B 0 81,-2.9 83,-2.7 -2,-0.8 2,-0.5 -0.636 12.1-148.8 -74.3 118.2 17.6 28.5 33.6 50 79 A K E + g 0 132B 65 -39,-2.8 2,-0.3 -2,-0.5 -37,-0.3 -0.801 19.4 179.7 -96.8 128.7 20.0 27.2 36.3 51 80 A L E - g 0 133B 3 81,-2.9 83,-3.1 -2,-0.5 2,-0.5 -0.963 19.7-143.0-131.2 145.0 18.5 25.4 39.3 52 81 A Q E > - g 0 134B 54 -2,-0.3 3,-1.6 81,-0.2 50,-0.3 -0.912 31.6-108.3-110.2 132.3 19.9 23.8 42.4 53 82 A R T 3 S+ 0 0 101 81,-2.8 50,-0.2 -2,-0.5 3,-0.1 -0.301 104.0 20.2 -56.6 136.0 18.5 20.6 43.8 54 83 A G T 3 S+ 0 0 57 48,-4.1 2,-0.4 1,-0.2 -1,-0.3 0.587 101.2 108.8 77.0 11.2 16.6 21.2 47.1 55 84 A K < - 0 0 136 -3,-1.6 47,-1.0 47,-0.3 -1,-0.2 -0.986 61.6-137.3-122.4 129.7 16.1 24.9 46.4 56 85 A A E - M 0 101C 50 -2,-0.4 2,-0.3 45,-0.2 45,-0.2 -0.484 21.4-176.4 -80.1 145.9 12.8 26.5 45.6 57 86 A V E - M 0 100C 7 43,-1.8 43,-3.5 -2,-0.2 2,-0.5 -0.994 18.6-143.0-140.5 144.5 12.5 29.2 42.9 58 87 A T E -jM 18 99C 30 -41,-2.5 -39,-2.1 -2,-0.3 2,-0.5 -0.921 15.7-157.8-105.1 131.6 9.6 31.3 41.7 59 88 A V E -jM 19 98C 0 39,-2.9 39,-2.1 -2,-0.5 2,-0.6 -0.958 3.2-153.5-110.9 123.4 9.4 31.9 38.0 60 89 A D E -jM 20 97C 10 -41,-2.9 -39,-3.0 -2,-0.5 2,-0.6 -0.886 13.5-163.1 -96.2 121.3 7.4 34.9 36.7 61 90 A I E -jM 21 96C 5 35,-3.2 35,-3.0 -2,-0.6 2,-0.6 -0.922 5.6-167.3-115.2 119.5 6.2 34.3 33.2 62 91 A Y E -jM 22 95C 72 -41,-2.7 -39,-3.4 -2,-0.6 2,-0.9 -0.915 11.0-151.4-109.8 110.7 5.0 37.2 31.1 63 92 A N E +j 23 0C 0 31,-2.4 30,-2.3 -2,-0.6 -39,-0.1 -0.748 23.2 168.3 -78.7 106.1 3.2 36.4 27.9 64 93 A Q + 0 0 114 -41,-3.0 -39,-0.5 -2,-0.9 2,-0.2 0.033 46.1 99.6-110.2 23.1 3.9 39.3 25.6 65 94 A L S S- 0 0 11 2,-0.3 28,-0.4 -41,-0.2 4,-0.1 -0.441 82.3-120.2 -86.2 175.2 2.6 37.6 22.5 66 95 A T S S+ 0 0 140 -2,-0.2 2,-0.3 26,-0.1 -42,-0.0 0.258 92.9 59.6-101.8 9.2 -0.9 38.4 21.2 67 96 A E S S- 0 0 53 24,-0.1 -2,-0.3 23,-0.0 26,-0.1 -0.952 93.0 -91.3-132.5 158.2 -2.0 34.7 21.6 68 97 A E + 0 0 88 -2,-0.3 2,-0.3 24,-0.1 47,-0.1 -0.220 46.2 169.5 -58.2 153.5 -2.2 32.2 24.5 69 98 A T B -N 90 0D 0 21,-1.1 21,-2.7 19,-0.1 2,-0.3 -0.942 21.4-143.9-155.0 167.3 0.7 30.0 25.3 70 99 A T - 0 0 0 -2,-0.3 2,-0.5 19,-0.2 45,-0.2 -0.909 11.8-137.4-129.1 163.5 1.9 27.6 28.0 71 100 A L - 0 0 5 17,-0.4 2,-0.4 -2,-0.3 14,-0.1 -0.927 20.2-171.9-126.1 106.3 5.3 26.9 29.5 72 101 A H E -H 112 0B 0 40,-2.6 40,-1.8 -2,-0.5 2,-1.0 -0.815 19.1-143.6 -96.7 133.3 6.1 23.2 30.1 73 102 A W E > -H 111 0B 1 10,-0.8 3,-1.3 -2,-0.4 2,-0.5 -0.824 23.7-149.8 -97.1 93.1 9.3 22.2 32.0 74 103 A H E 3 S+H 110 0B 0 36,-1.7 36,-1.9 -2,-1.0 57,-0.1 -0.534 77.3 13.3 -73.2 116.8 10.2 19.1 30.0 75 104 A G T 3 S+ 0 0 3 -2,-0.5 2,-0.4 1,-0.3 -1,-0.2 0.143 93.8 128.1 104.5 -16.0 12.1 16.5 32.3 76 105 A L < - 0 0 1 -3,-1.3 2,-1.2 34,-0.2 322,-0.6 -0.617 56.7-140.4 -80.2 128.7 11.2 18.2 35.6 77 106 A E + 0 0 17 -2,-0.4 26,-0.4 321,-0.1 -1,-0.1 -0.745 55.6 130.8 -82.9 88.0 9.7 16.2 38.4 78 107 A V - 0 0 2 -2,-1.2 359,-0.2 -5,-0.1 22,-0.1 -0.919 64.1 -78.4-137.6 159.8 7.2 18.8 39.6 79 108 A P > - 0 0 37 0, 0.0 3,-1.8 0, 0.0 4,-0.5 -0.248 42.3-113.3 -59.6 151.1 3.5 18.9 40.4 80 109 A G G >> S+ 0 0 4 358,-2.5 3,-0.6 1,-0.3 4,-0.5 0.743 111.4 72.1 -55.2 -26.7 1.0 19.0 37.5 81 110 A E G 34 S+ 0 0 75 357,-0.4 -1,-0.3 1,-0.3 3,-0.1 0.736 111.1 27.4 -64.4 -27.8 -0.0 22.5 38.7 82 111 A V G <4 S+ 0 0 23 -3,-1.8 -1,-0.3 361,-0.1 -2,-0.2 0.320 94.7 98.4-112.0 5.5 3.3 24.0 37.5 83 112 A D T <4 S- 0 0 1 -3,-0.6 -10,-0.8 -4,-0.5 -2,-0.2 0.709 81.0-138.3 -73.3 -21.6 4.0 21.5 34.8 84 113 A G < + 0 0 10 -4,-0.5 -3,-0.1 -12,-0.2 -1,-0.1 0.840 41.7 157.5 69.6 37.3 2.6 23.8 32.1 85 114 A G > - 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