==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 21-OCT-11 3UAA . COMPND 2 MOLECULE: BLUE COPPER OXIDASE CUEO; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR H.KOMORI,K.KATAOKA,T.SAKURAI,Y.HIGUCHI . 476 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18706.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 313 65.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 49 10.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 112 23.5 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 1.3 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 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 30 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.8 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 2 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 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 1 6 3 3 0 2 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 29 A A 0 0 156 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 102.8 -14.6 -11.8 43.6 2 30 A E - 0 0 172 1,-0.1 3,-0.0 193,-0.0 193,-0.0 -0.244 360.0 -89.8 -71.3 165.6 -13.9 -10.2 40.2 3 31 A R - 0 0 86 1,-0.1 -1,-0.1 191,-0.1 192,-0.1 -0.509 45.4-109.2 -74.2 147.7 -10.6 -8.5 39.5 4 32 A P - 0 0 70 0, 0.0 191,-2.1 0, 0.0 2,-0.1 -0.419 40.9-100.0 -67.2 152.7 -10.6 -4.7 40.3 5 33 A T B -a 195 0A 110 189,-0.2 191,-0.2 1,-0.1 3,-0.0 -0.412 43.8 -92.6 -75.5 151.8 -10.5 -2.4 37.3 6 34 A L - 0 0 6 189,-2.5 -1,-0.1 284,-0.2 183,-0.1 -0.449 43.1-121.7 -60.2 119.8 -7.2 -0.9 36.3 7 35 A P - 0 0 55 0, 0.0 184,-0.1 0, 0.0 -1,-0.1 -0.397 24.3-149.5 -62.6 140.5 -6.9 2.5 37.9 8 36 A I - 0 0 56 145,-0.1 3,-0.1 -2,-0.1 147,-0.1 -0.954 10.7-130.0-116.7 116.1 -6.4 5.2 35.4 9 37 A P - 0 0 19 0, 0.0 2,-0.1 0, 0.0 37,-0.0 -0.303 35.5-102.4 -57.1 139.4 -4.4 8.3 36.3 10 38 A D - 0 0 116 1,-0.1 39,-3.3 139,-0.0 2,-0.9 -0.396 28.2-125.3 -61.1 139.4 -6.2 11.6 35.5 11 39 A L E -f 49 0B 54 37,-0.2 2,-0.4 -2,-0.1 39,-0.2 -0.803 34.0-159.1 -87.9 104.2 -4.9 13.3 32.4 12 40 A L E +f 50 0B 40 37,-2.8 39,-3.6 -2,-0.9 2,-0.2 -0.762 16.9 173.0 -99.0 128.4 -4.0 16.8 33.6 13 41 A T - 0 0 93 -2,-0.4 39,-0.1 37,-0.2 6,-0.1 -0.716 39.3 -75.5-122.0 173.9 -3.7 20.0 31.4 14 42 A T - 0 0 50 -2,-0.2 6,-0.2 37,-0.2 -1,-0.1 -0.273 36.5-131.6 -76.8 158.8 -3.1 23.7 32.3 15 43 A D > - 0 0 82 4,-1.4 3,-2.5 1,-0.0 -1,-0.1 -0.195 45.1 -82.1 -93.7-175.6 -5.7 26.2 33.8 16 44 A A T 3 S+ 0 0 114 1,-0.3 -2,-0.1 2,-0.2 -1,-0.0 0.808 135.0 56.1 -72.4 -18.9 -6.3 29.7 32.4 17 45 A R T 3 S- 0 0 168 2,-0.2 -1,-0.3 42,-0.0 3,-0.1 0.461 120.1-116.4 -83.2 5.4 -3.3 30.8 34.4 18 46 A N S < S+ 0 0 66 -3,-2.5 41,-2.4 1,-0.3 2,-0.4 0.827 71.5 138.7 68.8 30.1 -1.4 28.2 32.5 19 47 A R E -j 59 0C 47 39,-0.2 -4,-1.4 -6,-0.1 2,-0.4 -0.867 43.4-162.9-115.9 144.8 -0.8 26.4 35.8 20 48 A I E -j 60 0C 5 39,-2.3 41,-2.7 -2,-0.4 2,-0.5 -0.982 19.1-145.8-115.9 130.7 -0.9 22.7 36.8 21 49 A Q E -j 61 0C 116 -2,-0.4 2,-0.5 39,-0.2 41,-0.2 -0.900 15.6-175.9-104.7 125.3 -1.1 22.1 40.6 22 50 A L E -j 62 0C 0 39,-3.2 41,-3.0 -2,-0.5 2,-0.5 -0.984 5.5-165.2-122.1 120.8 0.7 19.1 42.1 23 51 A T E -j 63 0C 26 -2,-0.5 19,-2.7 39,-0.2 2,-0.6 -0.890 6.4-154.9-101.7 129.6 0.4 18.3 45.8 24 52 A I E +jK 64 41C 0 39,-3.5 41,-2.7 -2,-0.5 2,-0.3 -0.871 36.3 136.5-101.0 118.6 2.8 15.9 47.4 25 53 A G E - K 0 40C 12 15,-2.5 15,-2.4 -2,-0.6 2,-0.4 -0.976 49.6 -99.4-156.4 173.3 1.4 14.2 50.5 26 54 A A E + K 0 39C 66 39,-0.3 13,-0.2 -2,-0.3 2,-0.2 -0.776 44.5 141.2 -98.9 143.4 0.7 11.2 52.6 27 55 A G E - K 0 38C 15 11,-3.0 11,-2.3 17,-0.4 2,-0.4 -0.682 45.5 -80.5-150.8-158.6 -2.5 9.2 52.7 28 56 A Q E - K 0 37C 87 9,-0.2 2,-0.3 -2,-0.2 9,-0.2 -0.938 32.2-177.7-121.9 146.4 -3.6 5.6 53.0 29 57 A S E - K 0 36C 18 7,-2.6 7,-2.7 -2,-0.4 2,-0.4 -0.860 20.9-130.0-128.5 166.0 -3.9 2.8 50.4 30 58 A T E - K 0 35C 95 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.988 20.5-179.4-122.0 130.0 -5.2 -0.8 50.7 31 59 A F E > S- K 0 34C 16 3,-2.1 3,-2.1 -2,-0.4 160,-0.1 -0.996 76.7 -16.2-128.0 120.4 -3.3 -3.8 49.5 32 60 A G T 3 S- 0 0 76 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.894 129.3 -53.6 48.6 46.0 -4.8 -7.3 49.8 33 61 A G T 3 S+ 0 0 73 1,-0.1 2,-0.5 -3,-0.0 -1,-0.3 0.434 115.4 110.6 72.4 4.2 -7.3 -5.9 52.4 34 62 A K E < -K 31 0C 108 -3,-2.1 -3,-2.1 132,-0.1 -1,-0.1 -0.936 65.8-125.5-114.0 132.0 -4.7 -4.3 54.7 35 63 A T E -K 30 0C 61 -2,-0.5 2,-0.3 -5,-0.2 -5,-0.2 -0.345 29.4-176.8 -70.5 147.9 -4.3 -0.5 55.0 36 64 A A E -K 29 0C 0 -7,-2.7 -7,-2.6 131,-0.1 2,-0.4 -0.995 32.0-112.7-142.3 142.2 -0.8 1.1 54.4 37 65 A T E +K 28 0C 48 -2,-0.3 131,-0.4 -9,-0.2 2,-0.3 -0.599 48.8 169.4 -66.7 127.1 0.5 4.6 54.7 38 66 A T E -K 27 0C 0 -11,-2.3 -11,-3.0 -2,-0.4 2,-0.4 -0.917 26.5-133.7-136.3 166.5 1.4 5.6 51.2 39 67 A W E +K 26 0C 17 87,-2.3 7,-0.8 -2,-0.3 2,-0.3 -0.930 28.1 162.9-119.8 147.2 2.4 8.8 49.4 40 68 A G E -Kl 25 46C 0 -15,-2.4 -15,-2.5 3,-0.4 2,-0.5 -0.963 40.3-106.7-150.8 172.3 1.2 10.3 46.2 41 69 A Y E S-K 24 0C 1 5,-2.9 -17,-0.2 -2,-0.3 4,-0.2 -0.926 106.0 -9.5 -97.3 126.3 0.9 13.4 44.0 42 70 A N S S+ 0 0 69 -19,-2.7 2,-0.3 -2,-0.5 -1,-0.2 0.905 140.8 23.9 50.7 46.0 -2.7 14.8 44.0 43 71 A G S S- 0 0 42 -20,-0.4 -3,-0.4 -3,-0.4 -18,-0.3 -0.955 103.9 -69.5 155.6-173.8 -3.8 11.7 45.9 44 72 A N S S+ 0 0 87 -2,-0.3 -17,-0.4 1,-0.2 2,-0.3 0.607 107.2 20.6 -85.6 -13.2 -2.7 8.9 48.2 45 73 A L S S- 0 0 37 -4,-0.2 -5,-0.3 -7,-0.1 -1,-0.2 -0.972 113.2 -19.6-160.0 138.0 -0.6 6.9 45.8 46 74 A L B S-l 40 0C 12 81,-2.2 -5,-2.9 -7,-0.8 83,-0.2 -0.315 80.1-112.8 56.3-135.4 1.3 7.4 42.5 47 75 A G - 0 0 13 -7,-0.2 -5,-0.1 81,-0.1 83,-0.1 -0.986 22.4 -67.0-179.0 175.1 0.0 10.4 40.5 48 76 A P - 0 0 8 0, 0.0 83,-2.1 0, 0.0 2,-0.6 -0.242 46.4-108.7 -76.9 172.2 -1.7 12.0 37.6 49 77 A A E -fg 11 131B 0 -39,-3.3 -37,-2.8 81,-0.2 2,-0.5 -0.943 30.8-144.6-104.0 113.9 -0.5 12.1 34.0 50 78 A V E -fg 12 132B 0 81,-3.1 83,-3.1 -2,-0.6 2,-0.5 -0.682 11.3-146.5 -80.9 122.9 0.6 15.6 33.1 51 79 A K E + g 0 133B 65 -39,-3.6 2,-0.3 -2,-0.5 83,-0.2 -0.805 22.1 177.0 -95.7 130.5 -0.2 16.4 29.5 52 80 A L E - g 0 134B 3 81,-2.5 83,-2.9 -2,-0.5 2,-0.4 -0.934 18.8-144.4-128.4 149.1 2.3 18.7 27.6 53 81 A Q E > - g 0 135B 48 -2,-0.3 3,-1.9 81,-0.2 50,-0.3 -0.966 28.9-108.0-119.4 134.4 2.5 20.0 24.1 54 82 A R T 3 S+ 0 0 101 81,-2.6 50,-0.2 -2,-0.4 3,-0.1 -0.320 104.9 19.0 -54.8 135.6 5.7 20.5 22.2 55 83 A G T 3 S+ 0 0 68 48,-3.0 2,-0.4 1,-0.2 -1,-0.3 0.483 104.6 101.6 78.6 6.3 6.5 24.3 21.8 56 84 A K < - 0 0 139 -3,-1.9 47,-1.4 47,-0.2 2,-0.3 -0.943 63.1-138.4-119.9 145.1 4.1 25.4 24.6 57 85 A A E - M 0 102C 32 -2,-0.4 2,-0.4 45,-0.2 45,-0.2 -0.756 18.1-173.3 -99.2 148.1 5.2 26.3 28.1 58 86 A V E - M 0 101C 10 43,-2.5 43,-3.3 -2,-0.3 2,-0.5 -0.993 16.9-138.4-136.3 149.9 3.5 25.3 31.3 59 87 A T E -jM 19 100C 20 -41,-2.4 -39,-2.3 -2,-0.4 2,-0.5 -0.909 15.1-159.8-105.6 131.7 4.0 26.3 34.9 60 88 A V E -jM 20 99C 0 39,-3.3 39,-2.6 -2,-0.5 2,-0.6 -0.971 4.4-156.1-113.6 125.4 3.8 23.7 37.6 61 89 A D E -jM 21 98C 10 -41,-2.7 -39,-3.2 -2,-0.5 2,-0.6 -0.922 13.5-163.6-100.7 116.3 3.1 24.6 41.2 62 90 A I E -jM 22 97C 5 35,-3.0 35,-2.1 -2,-0.6 2,-0.7 -0.913 4.2-166.9-109.2 112.5 4.5 21.9 43.5 63 91 A Y E -jM 23 96C 68 -41,-3.0 -39,-3.5 -2,-0.6 2,-0.9 -0.868 9.7-151.7-102.1 115.8 3.2 21.8 47.0 64 92 A N E +j 24 0C 1 31,-2.5 30,-2.1 -2,-0.7 31,-0.3 -0.762 23.0 167.9 -87.5 106.8 5.2 19.6 49.4 65 93 A Q + 0 0 128 -41,-2.7 -39,-0.3 -2,-0.9 -1,-0.2 0.251 46.1 103.2-101.4 10.6 2.8 18.5 52.1 66 94 A L S S- 0 0 10 2,-0.2 28,-0.6 -41,-0.2 4,-0.1 -0.381 78.3-126.0 -74.7 169.1 5.2 15.8 53.4 67 95 A T S S+ 0 0 139 26,-0.1 2,-0.3 -2,-0.1 -1,-0.1 0.237 90.4 63.3-100.7 11.2 7.1 16.5 56.6 68 96 A E S S- 0 0 49 24,-0.1 -2,-0.2 23,-0.0 26,-0.1 -0.919 95.3 -91.5-128.4 158.2 10.4 15.8 54.9 69 97 A E + 0 0 80 -2,-0.3 2,-0.3 24,-0.1 -2,-0.1 -0.325 47.7 170.2 -62.7 147.5 12.3 17.4 52.0 70 98 A T B -N 91 0D 0 21,-1.4 21,-2.3 19,-0.1 2,-0.3 -0.899 20.9-146.3-145.7 175.4 11.7 16.1 48.5 71 99 A T - 0 0 0 -2,-0.3 2,-0.5 19,-0.2 45,-0.3 -0.920 12.6-136.5-136.3 162.3 12.5 17.1 44.9 72 100 A L - 0 0 6 17,-0.4 2,-0.4 -2,-0.3 14,-0.1 -0.962 21.3-175.0-129.4 115.4 10.5 16.6 41.7 73 101 A H E -H 113 0B 2 40,-2.6 40,-2.1 -2,-0.5 2,-1.0 -0.859 23.3-140.0-110.3 140.7 12.2 15.4 38.5 74 102 A W E > -H 112 0B 0 10,-0.5 3,-1.5 -2,-0.4 2,-0.5 -0.816 25.5-150.5 -98.8 87.3 10.8 15.0 35.0 75 103 A H E 3 S+H 111 0B 0 36,-1.2 36,-2.6 -2,-1.0 57,-0.1 -0.538 80.4 11.0 -69.3 120.0 12.4 11.8 33.9 76 104 A G T 3 S+ 0 0 5 -2,-0.5 2,-0.4 1,-0.4 -1,-0.3 0.057 99.5 118.4 100.9 -15.1 12.8 11.8 30.1 77 105 A L < - 0 0 3 -3,-1.5 2,-1.0 34,-0.3 332,-0.4 -0.659 62.9-135.9 -85.7 132.8 11.9 15.5 29.8 78 106 A E + 0 0 16 -2,-0.4 26,-0.3 -3,-0.1 24,-0.1 -0.771 46.9 142.4 -92.9 100.7 14.7 17.7 28.4 79 107 A V - 0 0 2 -2,-1.0 369,-0.2 -5,-0.1 5,-0.1 -0.891 54.4 -85.1-135.9 159.7 14.8 20.9 30.6 80 108 A P >> - 0 0 48 0, 0.0 3,-1.8 0, 0.0 4,-0.6 -0.286 45.2-107.0 -66.1 156.8 17.4 23.2 32.0 81 109 A G H >> S+ 0 0 3 368,-2.4 3,-1.4 1,-0.3 4,-0.6 0.853 113.5 67.8 -50.5 -40.1 19.1 22.2 35.2 82 110 A E H 34 S+ 0 0 107 367,-0.3 -1,-0.3 1,-0.3 3,-0.1 0.785 114.6 28.4 -61.7 -23.0 17.3 24.8 37.3 83 111 A V H <4 S+ 0 0 27 -3,-1.8 -1,-0.3 371,-0.1 -2,-0.2 0.358 92.2 98.2-118.9 12.1 14.0 23.0 36.8 84 112 A D H << S- 0 0 0 -3,-1.4 -10,-0.5 -4,-0.6 -2,-0.1 0.705 79.1-140.0 -68.1 -22.0 15.4 19.4 36.4 85 113 A G < + 0 0 10 -4,-0.6 30,-0.1 -12,-0.2 -3,-0.1 0.837 42.0 156.4 64.4 33.7 14.6 18.7 40.0 86 114 A G > - 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