==== 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 2FQE . COMPND 2 MOLECULE: BLUE COPPER OXIDASE CUEO; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR X.LI,Z.WEI,M.ZHANG,M.TENG,W.GONG . 463 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16957.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 306 66.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 45 9.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 111 24.0 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 . 55 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 28 6.0 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 0 1 1 1 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 2 3 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 1 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 1 3 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 31 A R 0 0 131 0, 0.0 190,-0.1 0, 0.0 192,-0.1 0.000 360.0 360.0 360.0 145.4 31.2 31.1 10.3 2 32 A P - 0 0 74 0, 0.0 191,-2.6 0, 0.0 2,-0.1 -0.410 360.0-103.0 -63.9 148.3 29.2 33.0 12.9 3 33 A T B -a 193 0A 110 189,-0.2 191,-0.2 1,-0.1 0, 0.0 -0.473 44.7 -92.3 -70.2 147.6 30.3 32.2 16.5 4 34 A L - 0 0 8 189,-2.8 -1,-0.1 284,-0.2 183,-0.1 -0.441 41.2-124.9 -61.2 119.6 28.0 29.8 18.3 5 35 A P - 0 0 54 0, 0.0 184,-0.1 0, 0.0 -1,-0.1 -0.442 21.7-148.9 -63.0 138.6 25.4 31.8 20.3 6 36 A I - 0 0 50 -2,-0.1 3,-0.1 140,-0.1 147,-0.1 -0.958 14.1-126.0-114.2 115.3 25.4 30.8 24.0 7 37 A P - 0 0 16 0, 0.0 2,-0.1 0, 0.0 37,-0.0 -0.308 37.8-104.8 -53.7 136.0 22.1 31.0 25.9 8 38 A D - 0 0 132 1,-0.1 39,-2.9 139,-0.0 2,-0.8 -0.443 27.5-119.4 -69.6 138.3 22.6 33.2 29.0 9 39 A L E -f 47 0B 55 37,-0.2 2,-0.6 -2,-0.1 39,-0.2 -0.727 33.5-159.8 -81.9 109.2 22.8 31.3 32.3 10 40 A L E +f 48 0B 31 37,-2.9 39,-2.5 -2,-0.8 2,-0.2 -0.812 13.7 177.6-102.3 111.5 19.9 32.7 34.3 11 41 A T - 0 0 79 -2,-0.6 39,-0.1 37,-0.2 6,-0.1 -0.626 35.7 -77.5-109.2 169.5 19.9 32.3 38.1 12 42 A T - 0 0 49 37,-0.4 6,-0.2 -2,-0.2 -1,-0.1 -0.198 42.6-129.0 -59.2 151.1 17.6 33.4 40.9 13 43 A D > - 0 0 84 4,-2.0 3,-2.3 1,-0.0 -1,-0.1 -0.254 41.7 -80.9 -89.5-176.4 17.6 36.9 42.2 14 44 A A T 3 S+ 0 0 100 1,-0.3 -2,-0.1 2,-0.1 -1,-0.0 0.713 134.0 49.7 -62.9 -19.5 18.0 38.0 45.9 15 45 A R T 3 S- 0 0 203 2,-0.1 -1,-0.3 42,-0.1 3,-0.1 0.176 120.9-107.8-104.3 16.8 14.3 37.3 46.4 16 46 A N S < S+ 0 0 95 -3,-2.3 41,-2.6 1,-0.2 2,-0.3 0.846 77.8 127.4 63.6 37.0 14.6 33.8 44.8 17 47 A R E -j 57 0C 87 39,-0.2 -4,-2.0 -6,-0.1 2,-0.4 -0.868 41.2-164.5-121.7 157.0 12.7 34.8 41.6 18 48 A I E -j 58 0C 5 39,-2.3 41,-2.9 -2,-0.3 2,-0.5 -0.993 14.3-143.5-135.9 137.8 13.5 34.5 37.9 19 49 A Q E -j 59 0C 116 -2,-0.4 2,-0.4 39,-0.2 41,-0.2 -0.905 14.3-176.0-108.3 134.5 11.6 36.4 35.2 20 50 A L E -j 60 0C 0 39,-2.8 41,-2.8 -2,-0.5 2,-0.5 -0.990 5.8-165.0-125.1 122.4 10.8 35.0 31.8 21 51 A T E -j 61 0C 42 -2,-0.4 19,-2.6 39,-0.2 2,-0.6 -0.927 8.6-151.3-109.2 128.6 9.2 37.1 29.1 22 52 A I E +jK 62 39C 0 39,-3.1 41,-2.5 -2,-0.5 2,-0.3 -0.883 36.7 146.0-100.2 119.5 7.6 35.4 26.1 23 53 A G E - K 0 38C 16 15,-2.3 15,-2.5 -2,-0.6 2,-0.4 -0.949 46.1-109.0-154.6 164.2 7.7 37.7 23.0 24 54 A A E + K 0 37C 64 39,-0.4 13,-0.3 -2,-0.3 2,-0.2 -0.808 42.9 145.5-101.2 141.4 8.1 38.2 19.3 25 55 A G E - K 0 36C 13 11,-3.5 11,-1.7 17,-0.5 2,-0.4 -0.597 44.2 -85.1-144.9-150.6 11.1 39.7 17.6 26 56 A Q E - K 0 35C 96 9,-0.2 2,-0.3 -2,-0.2 9,-0.2 -0.992 31.7-176.2-133.6 138.7 13.2 39.4 14.5 27 57 A S E - K 0 34C 16 7,-2.6 7,-2.7 -2,-0.4 2,-0.5 -0.877 20.7-130.6-123.7 162.8 16.0 37.0 13.6 28 58 A T E - K 0 33C 90 -2,-0.3 2,-0.4 5,-0.2 5,-0.3 -0.976 20.7-177.2-116.2 127.2 18.1 36.8 10.5 29 59 A F E > S- K 0 32C 16 3,-2.8 3,-2.0 -2,-0.5 160,-0.1 -0.989 72.4 -23.5-122.9 125.4 18.7 33.5 8.7 30 60 A G T 3 S- 0 0 71 -2,-0.4 2,-0.2 1,-0.3 -1,-0.1 0.882 128.9 -46.8 37.8 53.1 21.0 33.3 5.7 31 61 A G T 3 S+ 0 0 71 1,-0.1 2,-0.4 -3,-0.0 -1,-0.3 -0.055 119.0 99.7 92.7 -34.8 20.5 37.0 4.9 32 62 A K E < -K 29 0C 119 -3,-2.0 -3,-2.8 -2,-0.2 2,-0.1 -0.757 66.6-131.6 -95.1 131.9 16.7 37.2 5.3 33 63 A T E -K 28 0C 79 -2,-0.4 2,-0.3 -5,-0.3 -5,-0.2 -0.451 25.9-174.3 -72.9 148.7 14.9 38.5 8.4 34 64 A A E -K 27 0C 0 -7,-2.7 -7,-2.6 -2,-0.1 2,-0.4 -0.993 32.3-106.6-142.3 146.0 12.1 36.4 9.9 35 65 A T E +K 26 0C 44 -2,-0.3 131,-0.4 -9,-0.2 2,-0.3 -0.642 49.8 174.1 -70.4 126.1 9.6 37.0 12.7 36 66 A T E -K 25 0C 0 -11,-1.7 -11,-3.5 -2,-0.4 2,-0.4 -0.889 24.6-135.1-131.7 163.1 10.7 34.7 15.5 37 67 A W E +K 24 0C 16 87,-2.4 7,-0.9 -2,-0.3 2,-0.3 -0.914 28.4 164.6-118.3 146.9 9.6 34.2 19.1 38 68 A G E -Kl 23 44C 0 -15,-2.5 -15,-2.3 3,-0.4 2,-0.5 -0.971 39.7-109.1-151.1 168.7 11.8 33.8 22.2 39 69 A Y E S-K 22 0C 2 5,-3.3 -17,-0.2 88,-0.3 4,-0.2 -0.925 105.8 -10.4 -98.7 126.7 12.1 33.8 26.0 40 70 A N S S+ 0 0 75 -19,-2.6 2,-0.3 -2,-0.5 -1,-0.2 0.909 140.7 26.1 50.7 46.7 14.0 36.9 27.2 41 71 A G S S- 0 0 44 -20,-0.4 -3,-0.4 -3,-0.3 -18,-0.3 -0.950 103.0 -70.5 156.2-175.3 15.0 37.7 23.6 42 72 A N S S+ 0 0 91 -2,-0.3 -17,-0.5 1,-0.2 2,-0.3 0.692 107.9 21.5 -82.5 -24.9 14.0 37.2 19.9 43 73 A L S S- 0 0 37 -4,-0.2 -5,-0.3 -19,-0.1 -1,-0.2 -0.998 114.0 -20.8-152.6 139.7 14.7 33.5 19.6 44 74 A L B S-l 38 0C 8 81,-1.8 -5,-3.3 -7,-0.9 83,-0.2 -0.277 79.8-111.8 59.0-133.9 15.0 30.4 21.8 45 75 A G - 0 0 11 -7,-0.2 -5,-0.1 81,-0.1 83,-0.1 -0.984 25.2 -65.6-178.3 179.9 15.8 31.4 25.5 46 76 A P - 0 0 9 0, 0.0 83,-2.3 0, 0.0 2,-0.7 -0.187 45.9-107.8 -78.4 171.3 18.1 31.4 28.5 47 77 A A E -fg 9 129B 0 -39,-2.9 -37,-2.9 81,-0.2 2,-0.5 -0.939 34.0-146.2 -99.6 108.0 19.4 28.4 30.4 48 78 A V E -fg 10 130B 0 81,-3.1 83,-3.1 -2,-0.7 2,-0.5 -0.662 12.3-147.5 -77.2 123.0 17.6 28.6 33.7 49 79 A K E + g 0 131B 61 -39,-2.5 -37,-0.4 -2,-0.5 2,-0.3 -0.835 20.6 177.4-101.6 124.6 19.9 27.3 36.4 50 80 A L E - g 0 132B 4 81,-3.0 83,-2.7 -2,-0.5 2,-0.4 -0.916 19.7-142.1-126.1 152.3 18.4 25.5 39.4 51 81 A Q E > - g 0 133B 48 -2,-0.3 3,-1.9 81,-0.2 50,-0.2 -0.949 30.4-107.9-113.7 133.2 19.9 23.8 42.5 52 82 A R T 3 S+ 0 0 98 81,-2.8 50,-0.2 -2,-0.4 3,-0.1 -0.364 105.8 20.3 -55.1 129.6 18.5 20.6 44.0 53 83 A G T 3 S+ 0 0 58 48,-3.4 2,-0.4 1,-0.3 -1,-0.3 0.491 102.0 107.6 88.5 6.9 16.7 21.3 47.2 54 84 A K < - 0 0 136 -3,-1.9 47,-1.2 47,-0.3 2,-0.3 -0.962 60.7-139.1-120.5 134.1 16.2 25.0 46.5 55 85 A A E - M 0 100C 48 -2,-0.4 2,-0.3 45,-0.2 45,-0.2 -0.700 20.5-175.7 -90.3 138.8 12.9 26.6 45.6 56 86 A V E - M 0 99C 7 43,-2.3 43,-3.0 -2,-0.3 2,-0.5 -0.980 18.8-140.0-129.5 149.5 12.6 29.2 43.0 57 87 A T E -jM 17 98C 27 -41,-2.6 -39,-2.3 -2,-0.3 2,-0.6 -0.941 15.1-159.3-105.3 126.1 9.7 31.4 41.8 58 88 A V E -jM 18 97C 0 39,-3.0 39,-2.3 -2,-0.5 2,-0.6 -0.918 2.9-156.3-105.8 121.3 9.4 32.0 38.0 59 89 A D E -jM 19 96C 11 -41,-2.9 -39,-2.8 -2,-0.6 2,-0.5 -0.881 13.3-162.6 -94.9 117.6 7.4 35.0 36.9 60 90 A I E -jM 20 95C 4 35,-3.3 35,-2.9 -2,-0.6 2,-0.6 -0.899 5.4-166.0-111.2 124.1 6.2 34.3 33.3 61 91 A Y E -jM 21 94C 60 -41,-2.8 -39,-3.1 -2,-0.5 2,-1.1 -0.934 10.9-150.0-112.9 111.6 5.0 37.2 31.2 62 92 A N E +j 22 0C 0 31,-2.9 30,-3.1 -2,-0.6 31,-0.2 -0.717 24.6 167.1 -84.3 104.3 3.2 36.4 28.1 63 93 A Q + 0 0 116 -41,-2.5 -39,-0.4 -2,-1.1 -1,-0.2 0.169 45.7 100.4-106.0 16.6 3.9 39.2 25.7 64 94 A L S S- 0 0 10 2,-0.2 28,-0.2 -41,-0.2 4,-0.1 -0.350 80.4-123.2 -77.9 173.6 2.6 37.4 22.6 65 95 A T S S+ 0 0 142 26,-0.1 2,-0.3 -2,-0.1 -1,-0.1 0.272 92.1 60.8-104.2 9.8 -0.9 38.2 21.3 66 96 A E S S- 0 0 52 24,-0.1 -2,-0.2 23,-0.0 26,-0.1 -0.930 94.1 -91.5-129.6 162.7 -1.9 34.6 21.6 67 97 A E + 0 0 88 -2,-0.3 2,-0.3 24,-0.1 -2,-0.1 -0.273 46.8 168.4 -63.6 151.8 -2.2 32.1 24.5 68 98 A T B -N 89 0D 0 21,-1.3 21,-2.7 19,-0.1 2,-0.3 -0.927 20.9-147.7-151.9 173.8 0.7 29.9 25.4 69 99 A T - 0 0 0 -2,-0.3 2,-0.5 19,-0.2 44,-0.3 -0.919 14.7-132.2-139.3 165.9 1.9 27.6 28.2 70 100 A L - 0 0 5 17,-0.3 2,-0.4 -2,-0.3 14,-0.1 -0.909 19.8-170.0-131.3 105.4 5.3 26.8 29.6 71 101 A H E -H 111 0B 0 40,-2.8 40,-1.9 -2,-0.5 2,-1.1 -0.786 17.7-144.8 -97.5 131.4 6.3 23.2 30.2 72 102 A W E > -H 110 0B 1 10,-0.8 3,-1.7 -2,-0.4 2,-0.5 -0.800 23.6-148.2 -95.7 92.1 9.4 22.2 32.0 73 103 A H E 3 S+H 109 0B 0 36,-1.4 36,-2.0 -2,-1.1 57,-0.1 -0.494 79.2 12.9 -69.1 113.8 10.4 19.1 30.1 74 104 A G T 3 S+ 0 0 4 -2,-0.5 2,-0.4 1,-0.3 -1,-0.3 0.247 92.7 132.3 108.1 -11.3 12.1 16.6 32.4 75 105 A L < - 0 0 1 -3,-1.7 2,-1.4 34,-0.2 322,-0.5 -0.621 54.8-140.9 -81.4 128.8 11.2 18.3 35.7 76 106 A E + 0 0 17 -2,-0.4 26,-0.4 321,-0.1 322,-0.1 -0.712 56.1 132.8 -84.2 87.1 9.8 16.3 38.6 77 107 A V - 0 0 3 -2,-1.4 359,-0.2 -5,-0.1 22,-0.1 -0.894 62.1 -83.7-134.4 159.5 7.3 18.9 39.7 78 108 A P > - 0 0 39 0, 0.0 3,-1.7 0, 0.0 4,-0.4 -0.283 43.4-109.3 -62.7 154.6 3.5 18.9 40.6 79 109 A G G >> S+ 0 0 4 358,-2.6 3,-1.1 1,-0.3 4,-0.5 0.778 113.0 71.4 -53.3 -31.0 1.0 19.1 37.8 80 110 A E G 34 S+ 0 0 89 357,-0.4 -1,-0.3 1,-0.3 3,-0.1 0.773 110.8 28.5 -59.2 -29.6 0.1 22.6 38.8 81 111 A V G <4 S+ 0 0 21 -3,-1.7 -1,-0.3 1,-0.1 -9,-0.2 0.273 93.5 97.9-112.9 10.5 3.4 24.0 37.6 82 112 A D T <4 S- 0 0 1 -3,-1.1 -10,-0.8 -4,-0.4 -2,-0.1 0.741 78.8-141.0 -79.1 -22.0 4.0 21.4 34.9 83 113 A G < + 0 0 11 -4,-0.5 -3,-0.1 -12,-0.2 30,-0.1 0.827 40.7 156.4 69.2 34.2 2.6 23.8 32.2 84 114 A G > - 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