==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-SEP-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 10-AUG-10 3OD3 . COMPND 2 MOLECULE: BLUE COPPER OXIDASE CUEO; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR W.R.MONTFORT,S.A.ROBERTS,S.K.SINGH . 488 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19220.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 311 63.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 9.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 110 22.5 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 1.2 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 . 54 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 31 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 3 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 . 4 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 . 6 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 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 29 A A 0 0 157 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 117.5 -15.2 -11.4 44.2 2 30 A E - 0 0 166 1,-0.1 3,-0.1 193,-0.0 193,-0.0 -0.303 360.0 -86.7 -78.2 165.8 -14.1 -10.1 40.8 3 31 A R - 0 0 89 1,-0.1 -1,-0.1 191,-0.1 190,-0.1 -0.470 50.2-108.3 -65.8 142.0 -10.8 -8.5 40.0 4 32 A P - 0 0 68 0, 0.0 191,-2.6 0, 0.0 2,-0.1 -0.355 39.0-100.9 -65.5 154.3 -10.8 -4.7 40.6 5 33 A T B -a 195 0A 108 189,-0.2 191,-0.2 1,-0.1 3,-0.0 -0.480 45.3 -92.8 -72.1 149.9 -10.7 -2.5 37.5 6 34 A L - 0 0 5 189,-2.4 183,-0.1 -2,-0.1 -1,-0.1 -0.481 44.9-117.8 -62.0 121.8 -7.4 -1.0 36.6 7 35 A P - 0 0 55 0, 0.0 184,-0.1 0, 0.0 -1,-0.1 -0.411 24.9-147.6 -61.9 139.1 -7.1 2.4 38.2 8 36 A I - 0 0 55 -2,-0.1 3,-0.1 145,-0.1 147,-0.1 -0.944 11.7-132.3-112.2 112.2 -6.8 5.1 35.6 9 37 A P - 0 0 17 0, 0.0 2,-0.1 0, 0.0 37,-0.0 -0.345 33.0-102.0 -59.1 141.1 -4.7 8.2 36.6 10 38 A D - 0 0 131 1,-0.1 39,-3.1 139,-0.0 2,-0.8 -0.450 26.9-129.2 -62.5 136.5 -6.4 11.5 35.8 11 39 A L E -f 49 0B 54 37,-0.2 2,-0.5 -2,-0.1 39,-0.2 -0.826 32.3-157.8 -90.8 106.6 -5.1 13.2 32.7 12 40 A L E +f 50 0B 48 37,-2.7 39,-2.5 -2,-0.8 2,-0.2 -0.778 16.0 176.5-104.0 121.2 -4.3 16.7 34.0 13 41 A T - 0 0 85 -2,-0.5 39,-0.1 37,-0.2 6,-0.1 -0.641 37.2 -73.4-114.9 174.3 -4.1 19.8 31.8 14 42 A T - 0 0 53 37,-0.2 6,-0.2 -2,-0.2 -1,-0.1 -0.188 36.2-133.6 -71.4 150.4 -3.6 23.6 32.6 15 43 A D > - 0 0 73 4,-1.9 3,-0.6 1,-0.1 -1,-0.1 0.021 44.8 -83.1 -80.9-163.6 -6.0 26.0 34.1 16 44 A A T 3 S+ 0 0 109 1,-0.2 -2,-0.1 2,-0.1 -1,-0.1 0.822 134.2 54.2 -70.7 -31.3 -6.7 29.6 32.7 17 45 A R T 3 S- 0 0 152 2,-0.1 -1,-0.2 42,-0.0 3,-0.1 0.375 120.5-114.6 -85.6 9.2 -3.7 30.8 34.7 18 46 A N S < S+ 0 0 63 -3,-0.6 41,-2.4 1,-0.2 2,-0.3 0.828 70.8 138.3 65.3 36.9 -1.7 28.1 32.9 19 47 A R E -j 59 0C 65 39,-0.2 -4,-1.9 -6,-0.1 2,-0.4 -0.884 42.3-162.2-120.6 143.0 -1.1 26.2 36.1 20 48 A I E -j 60 0C 2 39,-2.1 41,-2.8 -2,-0.3 2,-0.6 -0.991 18.8-147.6-115.8 129.8 -1.1 22.6 37.2 21 49 A Q E -j 61 0C 65 -2,-0.4 2,-0.5 39,-0.2 41,-0.2 -0.898 15.5-177.5-107.4 121.1 -1.4 22.0 41.0 22 50 A L E -j 62 0C 0 39,-2.9 41,-2.9 -2,-0.6 2,-0.5 -0.971 6.6-164.8-117.2 125.5 0.3 18.9 42.5 23 51 A T E -j 63 0C 40 -2,-0.5 19,-2.6 39,-0.2 2,-0.6 -0.939 7.9-152.6-110.7 127.2 0.0 18.2 46.2 24 52 A I E +jK 64 41C 0 39,-3.1 41,-2.7 -2,-0.5 2,-0.3 -0.866 35.8 149.0 -98.0 119.5 2.4 15.7 47.7 25 53 A G E - K 0 40C 13 15,-2.5 15,-2.4 -2,-0.6 2,-0.4 -0.977 46.4-109.1-155.2 163.9 0.9 14.0 50.7 26 54 A A E + K 0 39C 66 39,-0.3 13,-0.2 -2,-0.3 2,-0.2 -0.795 45.9 140.6 -96.7 135.1 0.5 11.1 53.0 27 55 A G E - K 0 38C 16 11,-3.5 11,-1.8 17,-0.4 2,-0.3 -0.530 44.8 -86.2-144.1-152.0 -2.7 9.0 53.0 28 56 A Q E - K 0 37C 88 9,-0.3 2,-0.3 -2,-0.2 9,-0.2 -0.990 29.0-176.4-134.4 146.2 -3.8 5.4 53.3 29 57 A S E - K 0 36C 17 7,-2.5 7,-2.7 -2,-0.3 2,-0.4 -0.883 20.9-130.1-131.3 165.5 -4.2 2.5 50.8 30 58 A T E - K 0 35C 95 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.979 20.2-178.2-122.6 130.2 -5.5 -1.0 51.2 31 59 A F E > S- K 0 34C 14 3,-2.3 3,-2.2 -2,-0.4 160,-0.1 -0.996 76.2 -17.0-129.6 122.8 -3.6 -4.0 49.9 32 60 A G T 3 S- 0 0 70 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.888 129.0 -53.3 46.6 44.8 -5.1 -7.5 50.4 33 61 A G T 3 S+ 0 0 71 1,-0.2 2,-0.4 133,-0.0 -1,-0.3 0.429 115.2 109.8 78.2 0.2 -7.4 -6.1 53.1 34 62 A K E < -K 31 0C 117 -3,-2.2 -3,-2.3 132,-0.1 2,-0.2 -0.930 65.4-127.5-113.0 131.8 -4.7 -4.5 55.3 35 63 A T E -K 30 0C 70 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.538 27.9-176.4 -77.7 141.7 -4.4 -0.7 55.5 36 64 A A E -K 29 0C 0 -7,-2.7 -7,-2.5 -2,-0.2 2,-0.3 -0.997 32.1-112.4-135.8 138.5 -0.9 0.9 54.9 37 65 A T E +K 28 0C 46 -2,-0.4 131,-0.4 -9,-0.2 2,-0.3 -0.566 48.1 174.8 -63.4 128.9 0.3 4.5 55.1 38 66 A T E -K 27 0C 0 -11,-1.8 -11,-3.5 -2,-0.3 2,-0.4 -0.913 24.3-134.4-137.3 161.5 1.1 5.5 51.5 39 67 A W E +K 26 0C 17 87,-2.5 7,-0.7 -2,-0.3 2,-0.3 -0.932 28.1 166.2-118.7 145.6 2.1 8.7 49.8 40 68 A G E -Kl 25 46C 0 -15,-2.4 -15,-2.5 3,-0.4 2,-0.5 -0.967 39.0-113.1-150.8 165.9 0.7 10.2 46.6 41 69 A Y E S-K 24 0C 2 5,-2.9 -17,-0.2 -2,-0.3 4,-0.2 -0.921 106.0 -9.1 -97.4 124.8 0.5 13.1 44.3 42 70 A N S S+ 0 0 76 -19,-2.6 2,-0.3 -2,-0.5 -1,-0.2 0.902 140.9 18.8 51.0 43.6 -3.1 14.5 44.2 43 71 A G S S- 0 0 44 -20,-0.4 -3,-0.4 -3,-0.3 -18,-0.3 -0.955 104.0 -62.1 155.5-170.3 -4.2 11.4 46.2 44 72 A N S S+ 0 0 88 -2,-0.3 -17,-0.4 1,-0.2 2,-0.3 0.659 108.6 11.7 -80.3 -22.7 -3.2 8.5 48.4 45 73 A L S S- 0 0 35 -4,-0.2 -5,-0.3 -7,-0.1 -1,-0.2 -0.980 113.3 -9.6-159.9 143.8 -0.8 6.7 46.1 46 74 A L B S-l 40 0C 12 81,-2.2 -5,-2.9 -7,-0.7 83,-0.2 -0.333 78.5-113.0 57.5-139.6 0.9 7.2 42.7 47 75 A G - 0 0 11 -7,-0.2 -5,-0.1 81,-0.1 83,-0.1 -0.977 23.7 -71.8-175.1 174.8 -0.2 10.4 40.8 48 76 A P - 0 0 7 0, 0.0 83,-2.5 0, 0.0 2,-0.6 -0.210 44.8-106.2 -78.3 174.7 -1.9 11.9 37.9 49 77 A A E -fg 11 131B 0 -39,-3.1 -37,-2.7 81,-0.2 2,-0.5 -0.936 31.7-147.1-103.0 112.3 -0.8 12.0 34.3 50 78 A V E -fg 12 132B 0 81,-3.1 83,-2.7 -2,-0.6 2,-0.5 -0.677 11.0-144.7 -82.7 124.1 0.4 15.5 33.5 51 79 A K E + g 0 133B 66 -39,-2.5 2,-0.3 -2,-0.5 -37,-0.2 -0.812 22.4 178.3 -95.7 124.9 -0.4 16.4 29.8 52 80 A L E - g 0 134B 4 81,-2.8 83,-2.5 -2,-0.5 2,-0.4 -0.888 17.6-145.9-124.6 156.0 2.2 18.6 28.0 53 81 A Q E > - g 0 135B 53 -2,-0.3 3,-2.1 81,-0.2 50,-0.3 -0.984 28.3-108.2-125.9 130.0 2.4 19.9 24.5 54 82 A R T 3 S+ 0 0 94 81,-2.7 50,-0.2 -2,-0.4 3,-0.1 -0.297 105.7 19.1 -53.4 130.8 5.7 20.5 22.6 55 83 A G T 3 S+ 0 0 66 48,-3.2 2,-0.4 1,-0.3 -1,-0.3 0.396 104.0 102.4 87.9 -1.8 6.3 24.2 22.2 56 84 A K < - 0 0 129 -3,-2.1 47,-1.5 47,-0.2 2,-0.4 -0.906 60.7-142.2-114.8 144.5 4.0 25.3 25.1 57 85 A A E - M 0 102C 31 -2,-0.4 2,-0.3 45,-0.2 45,-0.2 -0.821 18.4-176.4-103.2 142.1 5.0 26.3 28.5 58 86 A V E - M 0 101C 10 43,-2.1 43,-2.6 -2,-0.4 2,-0.5 -0.965 19.9-133.2-133.1 154.1 3.2 25.4 31.7 59 87 A T E -jM 19 100C 17 -41,-2.4 -39,-2.1 -2,-0.3 2,-0.5 -0.922 15.5-159.8-108.2 131.6 3.6 26.2 35.3 60 88 A V E -jM 20 99C 0 39,-3.1 39,-2.2 -2,-0.5 2,-0.6 -0.958 3.8-155.9-111.6 123.5 3.4 23.5 37.9 61 89 A D E -jM 21 98C 1 -41,-2.8 -39,-2.9 -2,-0.5 2,-0.6 -0.903 12.7-162.7 -98.3 119.1 2.7 24.5 41.6 62 90 A I E -jM 22 97C 4 35,-3.1 35,-2.2 -2,-0.6 2,-0.7 -0.916 4.6-166.9-113.7 112.4 4.1 21.8 43.9 63 91 A Y E -jM 23 96C 70 -41,-2.9 -39,-3.1 -2,-0.6 2,-1.0 -0.901 9.9-151.8-103.1 111.2 2.8 21.7 47.5 64 92 A N E +j 24 0C 1 31,-2.7 30,-2.2 -2,-0.7 31,-0.3 -0.774 23.5 167.4 -85.4 104.0 4.8 19.5 49.8 65 93 A Q + 0 0 130 -41,-2.7 -39,-0.3 -2,-1.0 -40,-0.1 0.240 45.4 103.4 -99.4 11.1 2.3 18.3 52.5 66 94 A L S S- 0 0 8 2,-0.2 28,-0.5 -42,-0.2 4,-0.1 -0.359 79.9-123.0 -76.0 170.1 4.7 15.7 53.8 67 95 A T S S+ 0 0 142 26,-0.1 2,-0.3 -2,-0.1 -1,-0.1 0.317 92.4 60.8 -97.3 7.0 6.6 16.3 57.1 68 96 A E S S- 0 0 48 24,-0.1 -2,-0.2 1,-0.1 26,-0.2 -0.918 93.6 -94.3-128.7 157.7 9.9 15.7 55.3 69 97 A E + 0 0 84 -2,-0.3 2,-0.3 24,-0.1 -2,-0.1 -0.218 46.5 168.9 -60.6 158.8 11.7 17.4 52.5 70 98 A T B -N 91 0D 0 21,-1.1 21,-2.4 19,-0.1 2,-0.3 -0.926 21.9-144.2-155.9 175.6 11.3 16.1 48.9 71 99 A T - 0 0 0 -2,-0.3 2,-0.5 19,-0.2 45,-0.3 -0.915 13.9-134.1-137.2 166.0 12.0 17.1 45.3 72 100 A L - 0 0 6 17,-0.3 2,-0.4 -2,-0.3 14,-0.1 -0.928 21.0-172.3-132.7 109.5 10.1 16.5 42.1 73 101 A H E -H 113 0B 1 40,-2.8 40,-1.9 -2,-0.5 2,-1.0 -0.823 20.2-142.4-103.5 137.5 12.0 15.2 39.1 74 102 A W E > -H 112 0B 1 10,-0.6 3,-1.6 -2,-0.4 2,-0.4 -0.801 23.6-149.9-100.7 87.2 10.5 14.9 35.6 75 103 A H E 3 S+H 111 0B 0 36,-1.3 36,-2.1 -2,-1.0 57,-0.1 -0.521 79.7 12.9 -66.0 116.8 12.2 11.7 34.3 76 104 A G T 3 S+ 0 0 6 -2,-0.4 2,-0.5 1,-0.3 -1,-0.2 0.140 95.8 119.9 104.1 -17.3 12.6 11.9 30.5 77 105 A L < - 0 0 2 -3,-1.6 2,-1.1 34,-0.2 344,-0.4 -0.740 60.6-137.4 -91.3 126.7 11.8 15.6 30.2 78 106 A E + 0 0 20 -2,-0.5 26,-0.4 343,-0.1 -3,-0.1 -0.691 49.9 139.9 -84.6 95.2 14.6 17.8 28.6 79 107 A V - 0 0 0 -2,-1.1 381,-0.2 -5,-0.1 5,-0.1 -0.917 57.0 -82.0-136.9 157.9 14.5 20.9 30.9 80 108 A P >> - 0 0 43 0, 0.0 3,-1.6 0, 0.0 4,-0.6 -0.227 43.5-110.7 -58.3 153.6 17.1 23.2 32.4 81 109 A G H >> S+ 0 0 4 380,-2.7 3,-1.1 1,-0.3 4,-0.5 0.837 113.4 69.6 -52.6 -36.9 18.7 22.1 35.7 82 110 A E H 34 S+ 0 0 99 379,-0.4 -1,-0.3 1,-0.3 3,-0.1 0.801 113.0 27.7 -54.9 -31.4 16.9 24.8 37.6 83 111 A V H <4 S+ 0 0 23 -3,-1.6 -1,-0.3 1,-0.1 -2,-0.2 0.319 93.9 98.5-112.9 5.5 13.5 23.0 37.1 84 112 A D H << S- 0 0 0 -3,-1.1 -10,-0.6 -4,-0.6 -2,-0.1 0.691 78.2-139.9 -72.5 -22.2 14.9 19.4 36.8 85 113 A G < + 0 0 11 -4,-0.5 30,-0.1 -12,-0.2 -3,-0.1 0.815 42.6 154.7 67.6 30.8 14.1 18.6 40.4 86 114 A G > - 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