==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 02-JUL-10 3NT0 . COMPND 2 MOLECULE: BLUE COPPER OXIDASE CUEO; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR S.A.ROBERTS,W.R.MONTFORT,S.K.SINGH . 468 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18457.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 297 63.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 46 9.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 112 23.9 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 . 1 0.2 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 . 46 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 30 6.4 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+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 2 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 1 1 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 . 7 0 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 2 2 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 0 236 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 13.4 -13.4 -10.2 42.2 2 31 A R - 0 0 94 1,-0.1 190,-0.1 191,-0.1 3,-0.1 -0.485 360.0-113.0 -73.1 143.4 -10.2 -8.4 41.2 3 32 A P - 0 0 69 0, 0.0 191,-2.3 0, 0.0 2,-0.1 -0.407 37.7 -99.7 -70.9 153.1 -10.3 -4.6 41.7 4 33 A T B -a 194 0A 110 189,-0.2 191,-0.2 1,-0.1 0, 0.0 -0.452 45.3 -93.1 -71.1 148.8 -10.3 -2.5 38.5 5 34 A L - 0 0 6 189,-2.3 -1,-0.1 -2,-0.1 183,-0.1 -0.445 43.3-120.0 -61.5 121.5 -6.9 -1.0 37.5 6 35 A P - 0 0 55 0, 0.0 184,-0.1 0, 0.0 -1,-0.1 -0.391 24.2-148.2 -63.4 141.2 -6.6 2.5 39.0 7 36 A I - 0 0 58 -2,-0.1 3,-0.1 145,-0.1 147,-0.1 -0.945 11.3-131.3-114.2 116.3 -6.2 5.2 36.3 8 37 A P - 0 0 19 0, 0.0 2,-0.1 0, 0.0 37,-0.0 -0.349 34.6-103.2 -60.5 144.7 -4.1 8.3 37.1 9 38 A D - 0 0 122 1,-0.1 39,-2.9 139,-0.0 2,-0.7 -0.451 26.4-125.8 -69.8 142.2 -5.8 11.5 36.2 10 39 A L E -f 48 0B 58 37,-0.2 2,-0.5 -2,-0.1 39,-0.2 -0.844 33.3-161.2 -90.3 111.4 -4.6 13.3 33.0 11 40 A L E +f 49 0B 43 37,-2.5 39,-2.5 -2,-0.7 2,-0.2 -0.863 14.0 175.4-105.9 123.2 -3.7 16.8 34.2 12 41 A T - 0 0 89 -2,-0.5 39,-0.1 37,-0.2 6,-0.1 -0.660 39.3 -73.6-116.2 171.5 -3.4 19.9 31.8 13 42 A T - 0 0 51 37,-0.3 6,-0.2 -2,-0.2 -1,-0.2 -0.186 42.2-135.7 -60.6 154.3 -2.8 23.6 32.4 14 43 A D > - 0 0 89 4,-1.7 3,-1.9 1,-0.0 -1,-0.1 -0.268 43.5 -77.6 -96.7-170.5 -5.5 25.9 33.7 15 44 A A T 3 S+ 0 0 117 1,-0.3 -2,-0.1 2,-0.1 -1,-0.0 0.734 134.5 54.0 -66.0 -23.6 -6.5 29.4 32.4 16 45 A R T 3 S- 0 0 180 2,-0.1 -1,-0.3 42,-0.0 3,-0.1 0.357 119.1-113.9 -83.5 1.8 -3.4 30.9 34.2 17 46 A N S < S+ 0 0 66 -3,-1.9 41,-1.8 1,-0.2 2,-0.3 0.815 75.7 127.8 64.4 33.6 -1.2 28.3 32.4 18 47 A R E -j 58 0C 67 39,-0.2 -4,-1.7 -6,-0.1 2,-0.4 -0.805 47.3-158.2-118.5 158.0 -0.5 26.5 35.7 19 48 A I E -j 59 0C 5 39,-1.8 41,-2.4 -2,-0.3 2,-0.4 -0.991 18.1-144.5-130.6 133.6 -0.6 23.0 37.1 20 49 A Q E -j 60 0C 110 -2,-0.4 2,-0.5 39,-0.2 41,-0.2 -0.890 15.3-176.1-105.8 130.3 -0.8 22.4 40.9 21 50 A L E -j 61 0C 0 39,-2.8 41,-2.7 -2,-0.4 2,-0.5 -0.990 5.2-166.0-124.0 121.9 1.0 19.4 42.6 22 51 A T E -j 62 0C 26 -2,-0.5 19,-2.5 39,-0.2 2,-0.5 -0.939 8.2-152.2-106.9 131.0 0.6 18.9 46.4 23 52 A I E +jK 63 40C 0 39,-2.8 41,-2.6 -2,-0.5 2,-0.3 -0.890 36.2 142.9-100.7 119.6 2.9 16.4 48.1 24 53 A G E - K 0 39C 14 15,-2.3 15,-2.7 -2,-0.5 2,-0.3 -0.984 46.9-103.7-157.4 169.7 1.3 14.8 51.2 25 54 A A E + K 0 38C 63 39,-0.3 13,-0.2 -2,-0.3 2,-0.2 -0.707 44.9 138.3 -97.5 143.3 0.7 11.9 53.5 26 55 A G E - K 0 37C 16 11,-3.5 11,-1.6 17,-0.4 2,-0.3 -0.610 44.7 -86.7-150.5-148.4 -2.4 9.8 53.6 27 56 A Q E - K 0 36C 124 9,-0.3 2,-0.3 -2,-0.2 9,-0.2 -0.989 29.0-177.3-142.2 144.9 -3.4 6.2 53.9 28 57 A S E - K 0 35C 20 7,-2.4 7,-2.5 -2,-0.3 2,-0.4 -0.878 22.6-123.8-131.3 168.4 -3.9 3.2 51.6 29 58 A T E - K 0 34C 93 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.969 20.0-177.7-119.2 132.2 -5.1 -0.4 52.0 30 59 A F E > S- K 0 33C 16 3,-2.8 3,-1.2 -2,-0.4 160,-0.1 -0.977 76.5 -23.5-126.8 115.9 -3.2 -3.5 50.9 31 60 A G T 3 S- 0 0 72 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.875 128.0 -47.6 51.5 45.5 -4.9 -6.9 51.4 32 61 A G T 3 S+ 0 0 73 1,-0.2 2,-0.4 133,-0.0 -1,-0.3 0.604 117.1 110.1 74.0 13.1 -7.1 -5.5 54.1 33 62 A K E < -K 30 0C 117 -3,-1.2 -3,-2.8 132,-0.1 2,-0.2 -0.984 63.4-130.7-121.9 133.7 -4.4 -3.8 56.1 34 63 A T E -K 29 0C 69 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.569 25.3-175.8 -78.7 140.3 -4.0 0.0 56.3 35 64 A A E -K 28 0C 0 -7,-2.5 -7,-2.4 -2,-0.2 2,-0.4 -0.995 31.6-115.0-135.0 142.1 -0.6 1.7 55.6 36 65 A T E +K 27 0C 51 -2,-0.3 131,-0.4 -9,-0.2 2,-0.3 -0.649 47.8 176.4 -66.2 128.2 0.6 5.3 55.9 37 66 A T E -K 26 0C 0 -11,-1.6 -11,-3.5 -2,-0.4 2,-0.4 -0.918 24.1-136.0-137.1 158.5 1.4 6.3 52.3 38 67 A W E +K 25 0C 19 87,-2.5 7,-0.7 -2,-0.3 2,-0.3 -0.925 28.1 167.4-116.5 144.0 2.6 9.4 50.4 39 68 A G E -Kl 24 45C 0 -15,-2.7 -15,-2.3 3,-0.4 2,-0.5 -0.943 39.6-112.5-145.3 170.4 1.3 10.8 47.1 40 69 A Y E S-K 23 0C 1 5,-2.6 -17,-0.2 -2,-0.3 4,-0.2 -0.943 106.2 -12.9 -98.8 124.3 1.0 13.7 44.6 41 70 A N S S+ 0 0 72 -19,-2.5 2,-0.3 -2,-0.5 -1,-0.2 0.917 141.9 29.1 46.3 49.9 -2.6 15.1 44.5 42 71 A G S S- 0 0 40 -20,-0.3 -3,-0.4 -3,-0.3 -18,-0.3 -0.953 103.2 -75.1 154.1-179.9 -3.6 12.0 46.5 43 72 A N S S+ 0 0 85 -2,-0.3 -17,-0.4 1,-0.2 2,-0.3 0.590 107.2 21.0 -90.9 -13.2 -2.6 9.4 49.0 44 73 A L S S- 0 0 36 -4,-0.2 -5,-0.3 -7,-0.1 -1,-0.2 -0.976 114.3 -16.8-156.5 145.6 -0.4 7.3 46.7 45 74 A L B S-l 39 0C 13 81,-1.7 -5,-2.6 -7,-0.7 83,-0.3 -0.360 79.3-116.5 57.1-131.5 1.5 7.6 43.4 46 75 A G - 0 0 15 -7,-0.2 -5,-0.1 81,-0.1 83,-0.1 -0.977 23.3 -65.9 176.5 173.1 0.3 10.7 41.4 47 76 A P - 0 0 7 0, 0.0 83,-2.1 0, 0.0 2,-0.6 -0.178 44.1-110.1 -76.0 171.9 -1.3 12.2 38.3 48 77 A A E -fg 10 130B 0 -39,-2.9 -37,-2.5 81,-0.2 2,-0.4 -0.959 30.8-146.3-104.7 109.9 -0.1 12.1 34.6 49 78 A V E -fg 11 131B 0 81,-2.7 83,-2.8 -2,-0.6 2,-0.5 -0.679 11.2-147.0 -82.4 126.3 1.0 15.6 33.7 50 79 A K E + g 0 132B 66 -39,-2.5 2,-0.3 -2,-0.4 -37,-0.3 -0.844 21.1 177.4-101.7 125.1 0.3 16.3 30.0 51 80 A L E - g 0 133B 5 81,-2.7 83,-2.3 -2,-0.5 2,-0.4 -0.905 20.8-140.0-128.3 149.6 2.7 18.6 28.1 52 81 A Q E > - g 0 134B 93 -2,-0.3 3,-1.8 81,-0.2 50,-0.3 -0.945 30.9-108.0-109.2 133.4 2.9 19.8 24.4 53 82 A R T 3 S+ 0 0 95 81,-2.7 50,-0.2 -2,-0.4 3,-0.1 -0.314 105.4 18.6 -52.1 132.7 6.3 20.2 22.6 54 83 A G T 3 S+ 0 0 66 48,-3.4 2,-0.4 1,-0.3 -1,-0.2 0.473 102.4 107.0 83.7 4.4 7.1 23.9 22.1 55 84 A K < - 0 0 117 -3,-1.8 47,-1.3 47,-0.2 2,-0.3 -0.901 62.5-134.2-116.2 142.4 4.7 25.1 24.8 56 85 A A E - M 0 101C 38 -2,-0.4 2,-0.3 45,-0.2 45,-0.2 -0.737 21.8-175.9 -93.6 143.4 5.7 26.5 28.3 57 86 A V E - M 0 100C 8 43,-1.8 43,-2.6 -2,-0.3 2,-0.5 -0.958 17.8-140.8-132.1 152.7 3.9 25.5 31.5 58 87 A T E -jM 18 99C 21 -41,-1.8 -39,-1.8 -2,-0.3 2,-0.5 -0.980 14.5-160.0-114.1 126.7 4.3 26.6 35.1 59 88 A V E -jM 19 98C 0 39,-2.8 39,-2.1 -2,-0.5 2,-0.6 -0.923 3.1-157.4-111.1 123.8 4.1 24.0 37.9 60 89 A D E -jM 20 97C 13 -41,-2.4 -39,-2.8 -2,-0.5 2,-0.6 -0.931 12.7-163.4-100.3 118.7 3.4 25.1 41.5 61 90 A I E -jM 21 96C 4 35,-2.7 35,-2.3 -2,-0.6 2,-0.6 -0.934 4.7-166.5-114.5 115.3 4.6 22.5 43.9 62 91 A Y E -jM 22 95C 68 -41,-2.7 -39,-2.8 -2,-0.6 2,-0.9 -0.904 9.2-152.5-105.7 115.3 3.3 22.5 47.5 63 92 A N E +j 23 0C 1 31,-2.5 30,-2.3 -2,-0.6 31,-0.3 -0.767 23.5 166.3 -89.8 103.8 5.3 20.4 50.1 64 93 A Q + 0 0 131 -41,-2.6 -39,-0.3 -2,-0.9 -1,-0.1 0.182 45.6 101.9-104.1 15.3 2.8 19.4 52.8 65 94 A L S S- 0 0 10 2,-0.2 28,-0.5 -41,-0.1 4,-0.1 -0.397 81.2-120.6 -78.4 169.9 5.1 16.7 54.3 66 95 A T S S+ 0 0 143 26,-0.1 2,-0.3 -2,-0.1 -1,-0.1 0.314 91.6 59.8 -94.8 9.1 7.0 17.4 57.5 67 96 A E S S- 0 0 50 24,-0.1 -2,-0.2 23,-0.0 26,-0.2 -0.908 92.9 -91.4-131.2 160.7 10.4 16.8 55.8 68 97 A E + 0 0 87 -2,-0.3 2,-0.3 24,-0.1 -2,-0.1 -0.338 46.9 166.8 -64.6 150.4 12.3 18.3 52.9 69 98 A T B -N 90 0D 0 21,-1.1 21,-2.6 19,-0.1 2,-0.3 -0.916 21.3-146.8-149.8 178.3 11.9 16.8 49.3 70 99 A T - 0 0 0 -2,-0.3 2,-0.4 19,-0.2 45,-0.2 -0.886 14.0-132.6-141.4 164.8 12.7 17.8 45.7 71 100 A L - 0 0 7 17,-0.3 2,-0.4 -2,-0.3 14,-0.1 -0.925 21.3-172.3-132.1 109.3 10.8 17.0 42.4 72 101 A H E -H 112 0B 3 40,-2.7 40,-1.7 -2,-0.4 2,-1.0 -0.843 20.5-142.0-103.1 136.8 12.8 15.7 39.4 73 102 A W E > -H 111 0B 1 10,-0.6 3,-1.6 -2,-0.4 2,-0.4 -0.761 23.2-153.9 -98.4 86.2 11.4 15.2 35.9 74 103 A H E 3 S+H 110 0B 0 -2,-1.0 36,-1.9 36,-1.0 57,-0.1 -0.462 78.8 16.5 -67.0 119.0 13.1 12.0 34.8 75 104 A G T 3 S+ 0 0 7 -2,-0.4 2,-0.5 1,-0.3 -1,-0.3 0.139 98.0 114.2 105.4 -19.3 13.4 11.9 31.0 76 105 A L < - 0 0 5 -3,-1.6 2,-1.1 34,-0.2 321,-0.4 -0.782 62.9-137.3 -93.9 126.7 12.7 15.6 30.4 77 106 A E + 0 0 20 -2,-0.5 26,-0.3 -3,-0.1 -3,-0.1 -0.675 47.8 142.1 -82.4 99.1 15.5 17.8 29.0 78 107 A V - 0 0 4 -2,-1.1 358,-0.1 -5,-0.1 5,-0.1 -0.918 55.4 -80.5-135.6 160.0 15.4 21.0 31.1 79 108 A P >> - 0 0 56 0, 0.0 3,-2.0 0, 0.0 4,-0.8 -0.265 44.0-110.8 -58.1 148.3 18.0 23.4 32.6 80 109 A G H >> S+ 0 0 4 357,-2.2 3,-0.8 1,-0.3 4,-0.5 0.814 114.0 68.5 -45.5 -38.2 19.7 22.5 35.8 81 110 A E H 34 S+ 0 0 133 356,-0.4 -1,-0.3 1,-0.2 357,-0.1 0.740 113.1 26.7 -62.2 -23.0 17.8 25.2 37.6 82 111 A V H <4 S+ 0 0 29 -3,-2.0 -1,-0.2 360,-0.1 -2,-0.2 0.358 94.2 97.5-118.4 3.9 14.4 23.4 37.2 83 112 A D H << S- 0 0 1 -3,-0.8 -10,-0.6 -4,-0.8 -2,-0.1 0.691 79.6-139.1 -68.1 -25.1 15.7 19.8 37.0 84 113 A G < + 0 0 13 -4,-0.5 30,-0.1 -12,-0.2 -3,-0.1 0.802 41.9 155.2 70.6 31.0 15.0 19.2 40.7 85 114 A G > - 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