==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 05-SEP-12 4GY4 . COMPND 2 MOLECULE: PUTATIVE COPPER OXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES COELICOLOR; . AUTHOR I.NEDERLOF,A.GUPTA,G.W.CANTERS . 832 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28890.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 529 63.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 84 10.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 188 22.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 9 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.4 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 . 100 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 69 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 24 2.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.1 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 3 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 RESIDUES PER ALPHA HELIX . 0 0 0 6 0 0 0 6 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 . 10 12 3 6 0 6 6 0 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 . 6 0 6 3 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 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 39 A A 0 0 118 0, 0.0 149,-0.1 0, 0.0 146,-0.0 0.000 360.0 360.0 360.0 -13.4 -23.0 -29.6 -14.4 2 40 A R - 0 0 154 146,-0.3 145,-0.1 147,-0.2 144,-0.1 0.700 360.0 -7.8 71.9 124.8 -20.3 -31.8 -16.0 3 41 A T S S+ 0 0 64 142,-0.1 143,-0.2 145,-0.1 144,-0.1 0.405 79.5 7.0 62.1 169.9 -16.7 -32.3 -14.7 4 42 A A + 0 0 31 139,-0.1 2,-0.1 1,-0.1 -1,-0.1 0.117 17.0 173.1 63.2-169.0 -14.5 -30.8 -12.0 5 43 A P - 0 0 67 0, 0.0 141,-0.2 0, 0.0 140,-0.2 0.702 26.5-133.7-104.3-157.6 -13.7 -29.0 -9.6 6 44 A A - 0 0 48 138,-0.1 138,-0.2 38,-0.1 2,-0.1 1.000 44.1-175.8 -74.4 -76.7 -10.5 -28.8 -7.5 7 45 A G + 0 0 27 39,-0.1 39,-0.1 1,-0.1 38,-0.1 -0.176 48.6 130.1 91.5 164.3 -10.9 -28.7 -3.7 8 46 A G + 0 0 39 36,-0.2 2,-0.2 1,-0.1 -1,-0.1 0.360 30.3 153.3-124.3 137.4 -10.5 -28.6 -0.9 9 47 A E - 0 0 134 35,-0.1 39,-2.0 1,-0.0 2,-0.6 -0.487 48.9-105.9 -90.9 166.2 -12.7 -26.3 1.2 10 48 A V E -a 48 0A 91 37,-0.2 2,-0.4 -2,-0.2 39,-0.2 -0.886 40.1-162.4 -94.4 119.6 -13.5 -26.8 4.9 11 49 A R E -a 49 0A 89 37,-3.1 39,-3.1 -2,-0.6 2,-0.4 -0.869 8.6-159.0-108.0 136.7 -17.2 -27.9 5.2 12 50 A H E +a 50 0A 155 -2,-0.4 2,-0.3 37,-0.2 39,-0.2 -0.916 19.4 169.5-111.6 142.2 -19.3 -27.8 8.3 13 51 A L E -a 51 0A 45 37,-2.0 39,-3.2 -2,-0.4 2,-0.4 -0.998 26.7-137.6-155.6 142.8 -22.4 -30.1 8.6 14 52 A K E +a 52 0A 103 -2,-0.3 2,-0.3 37,-0.2 39,-0.2 -0.859 23.7 178.6-103.5 139.6 -24.9 -31.2 11.2 15 53 A M E -a 53 0A 0 37,-2.5 39,-2.1 -2,-0.4 2,-0.3 -0.997 6.9-165.7-141.8 147.9 -26.1 -34.8 11.5 16 54 A Y E -aB 54 28A 29 12,-2.5 12,-1.6 -2,-0.3 2,-0.5 -0.946 14.7-145.3-132.0 148.0 -28.5 -36.7 13.8 17 55 A A E -aB 55 27A 0 37,-2.1 39,-2.0 -2,-0.3 2,-0.4 -0.976 29.6-177.4-112.4 123.8 -29.3 -40.3 14.7 18 56 A E E - B 0 26A 29 8,-2.8 8,-2.4 -2,-0.5 2,-0.5 -0.941 31.5-130.3-125.9 141.7 -33.0 -40.9 15.4 19 57 A K E - B 0 25A 105 -2,-0.4 6,-0.2 6,-0.2 2,-0.1 -0.792 38.3-143.8 -77.4 125.3 -35.2 -43.8 16.5 20 58 A L > - 0 0 42 4,-3.5 3,-1.1 -2,-0.5 -1,-0.0 -0.466 20.8-112.1 -90.5 164.8 -38.1 -43.8 14.0 21 59 A A T 3 S+ 0 0 112 1,-0.2 -1,-0.1 -2,-0.1 4,-0.0 0.773 116.0 64.5 -64.5 -28.2 -41.8 -44.5 14.6 22 60 A D T 3 S- 0 0 124 1,-0.1 -1,-0.2 2,-0.1 3,-0.1 0.763 121.4-107.3 -60.9 -27.7 -41.4 -47.7 12.5 23 61 A G S < S+ 0 0 40 -3,-1.1 -2,-0.1 1,-0.4 -1,-0.1 0.184 86.0 120.2 107.6 -9.4 -39.0 -49.0 15.1 24 62 A Q - 0 0 48 -5,-0.1 -4,-3.5 110,-0.0 -1,-0.4 -0.235 59.6-129.3 -80.4 171.0 -36.1 -48.4 12.7 25 63 A M E +B 19 0A 13 108,-1.5 2,-0.3 -6,-0.2 -6,-0.2 -0.993 30.2 173.4-127.7 132.0 -33.1 -46.1 13.1 26 64 A G E -B 18 0A 0 -8,-2.4 -8,-2.8 -2,-0.4 2,-0.3 -0.907 27.1-126.3-137.2 161.6 -32.0 -43.5 10.7 27 65 A Y E +BC 17 35A 0 8,-1.0 8,-2.8 107,-0.4 2,-0.3 -0.759 31.4 168.8 -99.0 153.6 -29.6 -40.6 10.0 28 66 A G E -B 16 0A 0 -12,-1.6 -12,-2.5 -2,-0.3 6,-0.2 -0.980 44.6-127.9-155.6 162.4 -30.6 -37.1 8.9 29 67 A F S S+ 0 0 79 4,-0.5 2,-0.3 -2,-0.3 -15,-0.1 0.612 100.3 35.4 -82.6 -15.6 -29.3 -33.6 8.4 30 68 A E S > S- 0 0 118 3,-0.2 3,-1.8 -14,-0.1 2,-0.3 -0.980 95.5 -96.1-139.0 149.2 -32.2 -32.3 10.5 31 69 A K T 3 S+ 0 0 144 -2,-0.3 -2,-0.0 1,-0.3 -13,-0.0 -0.492 113.2 17.1 -65.4 123.4 -34.2 -33.5 13.6 32 70 A G T 3 S+ 0 0 62 -2,-0.3 -1,-0.3 -4,-0.0 -14,-0.0 0.305 109.4 84.7 95.4 -7.0 -37.4 -35.3 12.3 33 71 A K < + 0 0 151 -3,-1.8 -4,-0.5 2,-0.0 -3,-0.2 -0.208 55.5 142.3-120.0 40.5 -36.1 -35.7 8.8 34 72 A A - 0 0 19 -6,-0.2 2,-0.3 -5,-0.1 -6,-0.3 -0.454 28.0-169.5 -75.9 154.7 -34.0 -38.9 9.2 35 73 A S B -C 27 0A 49 -8,-2.8 -8,-1.0 -2,-0.1 -2,-0.0 -0.985 24.1-106.0-147.4 154.4 -34.1 -41.4 6.3 36 74 A V S S+ 0 0 29 -2,-0.3 2,-0.2 -10,-0.2 101,-0.1 -0.968 114.9 33.0-123.3 111.6 -33.1 -44.9 5.3 37 75 A P S S- 0 0 22 0, 0.0 100,-0.2 0, 0.0 3,-0.1 0.557 111.0-120.4 -71.0 163.2 -30.7 -44.8 3.6 38 76 A G - 0 0 5 98,-3.2 -10,-0.1 96,-0.2 -2,-0.1 -0.142 43.9 -69.9 -63.9 166.2 -29.2 -41.7 5.2 39 77 A P - 0 0 24 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 -0.237 54.9-104.1 -62.6 146.8 -28.6 -38.5 3.2 40 78 A L - 0 0 55 -3,-0.1 2,-0.5 97,-0.1 99,-0.2 -0.507 27.3-156.1 -71.0 135.5 -25.8 -38.5 0.6 41 79 A I E -f 139 0B 7 97,-1.7 99,-2.7 -2,-0.2 2,-0.5 -0.974 13.8-176.3-112.9 116.7 -22.6 -36.7 1.5 42 80 A E E +f 140 0B 78 -2,-0.5 2,-0.3 97,-0.2 99,-0.2 -0.960 9.8 160.5-117.7 128.0 -20.6 -35.6 -1.6 43 81 A V E -f 141 0B 6 97,-2.7 99,-2.7 -2,-0.5 2,-0.3 -0.873 33.8-113.8-136.0 169.6 -17.2 -33.9 -1.4 44 82 A N E > -f 142 0B 21 -2,-0.3 3,-2.6 97,-0.2 99,-0.2 -0.824 46.0 -87.6-105.0 148.0 -14.1 -33.1 -3.5 45 83 A E T 3 S+ 0 0 3 97,-2.8 53,-0.2 -2,-0.3 3,-0.1 -0.327 118.4 31.7 -54.1 122.0 -10.6 -34.6 -3.0 46 84 A G T 3 S+ 0 0 22 1,-0.4 -1,-0.3 -39,-0.1 50,-0.2 0.014 88.9 130.6 113.9 -25.0 -8.9 -32.3 -0.5 47 85 A D < - 0 0 1 -3,-2.6 49,-1.2 48,-0.1 2,-0.4 -0.249 47.3-148.0 -59.9 144.1 -12.0 -31.3 1.4 48 86 A T E -aD 10 95A 31 -39,-2.0 -37,-3.1 47,-0.2 2,-0.5 -0.960 14.7-160.4-110.0 137.1 -12.1 -31.4 5.2 49 87 A L E -aD 11 94A 6 45,-3.0 45,-2.9 -2,-0.4 2,-0.6 -0.969 8.2-165.7-127.7 117.3 -15.5 -32.2 6.6 50 88 A H E -aD 12 93A 44 -39,-3.1 -37,-2.0 -2,-0.5 2,-0.6 -0.914 9.5-164.0-104.0 117.2 -16.5 -31.5 10.2 51 89 A I E -aD 13 92A 0 41,-3.3 41,-2.4 -2,-0.6 2,-1.1 -0.900 12.7-152.9-106.4 115.5 -19.7 -33.2 11.3 52 90 A E E -aD 14 91A 89 -39,-3.2 -37,-2.5 -2,-0.6 2,-0.4 -0.767 28.7-167.2 -81.9 100.3 -21.5 -32.0 14.4 53 91 A F E -aD 15 90A 0 37,-2.7 37,-2.5 -2,-1.1 2,-0.4 -0.792 13.3-171.7-101.8 133.7 -23.1 -35.4 15.3 54 92 A T E -aD 16 89A 21 -39,-2.1 -37,-2.1 -2,-0.4 2,-0.9 -0.979 14.9-149.9-128.1 121.6 -25.9 -35.8 17.9 55 93 A N E +a 17 0A 0 33,-1.9 32,-2.0 -2,-0.4 -37,-0.1 -0.794 16.7 176.8 -87.8 106.4 -27.3 -39.1 19.1 56 94 A T + 0 0 61 -39,-2.0 -37,-0.2 -2,-0.9 -1,-0.1 0.326 49.2 100.7 -91.7 7.8 -30.9 -38.5 20.0 57 95 A M S S- 0 0 9 2,-0.2 30,-0.5 -40,-0.2 4,-0.1 -0.389 80.5-119.9 -93.3 168.4 -31.5 -42.2 20.9 58 96 A D S S+ 0 0 120 28,-0.1 2,-0.3 -2,-0.1 -1,-0.1 0.511 95.4 58.6 -84.6 -7.3 -31.7 -44.0 24.3 59 97 A V S S- 0 0 62 26,-0.1 -2,-0.2 1,-0.0 28,-0.2 -0.768 99.4 -85.1-116.1 165.7 -28.7 -46.3 23.4 60 98 A R + 0 0 98 -2,-0.3 2,-0.3 61,-0.1 25,-0.2 -0.462 51.2 177.4 -70.0 139.2 -25.1 -45.5 22.4 61 99 A A B -I 84 0C 0 23,-1.7 23,-2.6 -2,-0.2 2,-0.3 -0.938 9.5-166.3-141.2 163.0 -24.5 -44.8 18.7 62 100 A S - 0 0 0 -2,-0.3 2,-0.5 21,-0.2 59,-0.1 -0.910 21.4-128.6-144.5 169.1 -21.7 -43.8 16.4 63 101 A L + 0 0 0 19,-0.3 2,-0.4 -2,-0.3 56,-0.2 -0.980 30.2 177.5-124.1 115.3 -20.7 -42.6 12.9 64 102 A H E -G 118 0B 5 54,-2.3 54,-2.5 -2,-0.5 2,-0.3 -0.976 9.4-158.9-123.6 132.3 -18.1 -44.7 11.1 65 103 A V E -G 117 0B 11 -2,-0.4 2,-0.3 9,-0.4 52,-0.2 -0.861 8.6-139.8-117.3 143.8 -16.8 -44.0 7.6 66 104 A H S S+ 0 0 0 50,-2.0 2,-0.7 -2,-0.3 50,-0.1 -0.730 79.2 1.7 -91.6 145.1 -15.1 -46.1 4.9 67 105 A G S S+ 0 0 2 -2,-0.3 2,-0.2 410,-0.2 -1,-0.1 0.040 96.8 109.6 79.9 -28.5 -12.3 -44.8 2.7 68 106 A L S S- 0 0 6 -2,-0.7 2,-1.8 1,-0.1 28,-0.2 -0.543 80.1-102.1 -90.3 151.8 -11.8 -41.2 4.1 69 107 A D B +E 95 0A 6 26,-2.1 26,-2.0 -2,-0.2 2,-0.5 -0.504 57.2 159.9 -70.9 83.5 -8.9 -40.0 6.2 70 108 A A - 0 0 9 -2,-1.8 24,-0.1 24,-0.2 -3,-0.0 -0.943 35.1-129.4-109.2 128.9 -10.5 -40.1 9.6 71 109 A E > - 0 0 89 -2,-0.5 3,-1.6 22,-0.4 448,-0.1 -0.128 33.3 -97.0 -65.7 169.5 -8.2 -40.1 12.7 72 110 A I G > S+ 0 0 15 446,-0.6 3,-1.5 448,-0.4 4,-0.3 0.805 125.2 60.7 -61.0 -30.9 -8.7 -42.7 15.5 73 111 A S G 3 S+ 0 0 54 1,-0.3 -1,-0.3 2,-0.1 3,-0.2 0.675 109.0 44.3 -69.8 -18.2 -10.7 -40.2 17.5 74 112 A S G < S+ 0 0 7 -3,-1.6 -9,-0.4 1,-0.1 -1,-0.3 -0.014 81.9 104.9-111.7 26.0 -13.2 -40.2 14.6 75 113 A D S < S- 0 0 8 -3,-1.5 -2,-0.1 -11,-0.1 -1,-0.1 0.803 76.3-140.1 -74.6 -31.2 -13.2 -44.0 14.2 76 114 A G + 0 0 0 -4,-0.3 44,-0.3 1,-0.3 2,-0.3 0.861 52.7 131.8 73.8 38.9 -16.6 -44.2 15.8 77 115 A T > > - 0 0 1 -5,-0.3 5,-2.8 6,-0.1 6,-0.6 -0.894 61.9-134.6-123.1 153.0 -15.9 -47.4 17.8 78 116 A A G > 5S+ 0 0 36 42,-0.3 3,-2.0 -2,-0.3 -1,-0.1 0.821 96.7 76.5 -69.7 -32.8 -16.6 -48.4 21.4 79 117 A M G 3 5S+ 0 0 54 1,-0.3 -1,-0.2 46,-0.2 473,-0.1 0.787 110.9 24.3 -51.1 -36.4 -13.1 -49.9 21.7 80 118 A N G < 5S- 0 0 21 -3,-0.5 -1,-0.3 -8,-0.1 -2,-0.2 -0.099 114.8-103.0-124.1 34.7 -11.5 -46.4 22.0 81 119 A K T < 5S+ 0 0 142 -3,-2.0 -3,-0.2 1,-0.1 -2,-0.1 0.856 79.8 133.5 46.7 46.8 -14.5 -44.4 23.3 82 120 A S < + 0 0 0 -5,-2.8 -19,-0.3 2,-0.1 -4,-0.2 0.457 46.6 87.3-101.8 -6.5 -15.1 -42.9 19.9 83 121 A D S S- 0 0 6 -6,-0.6 2,-0.4 -7,-0.1 -21,-0.2 -0.094 79.5-105.0 -81.3-173.8 -18.9 -43.5 20.0 84 122 A V B -I 61 0C 0 -23,-2.6 -23,-1.7 -8,-0.1 3,-0.1 -0.957 19.5-125.2-126.9 136.6 -21.5 -41.2 21.4 85 123 A E > - 0 0 91 -2,-0.4 3,-2.2 -25,-0.2 -30,-0.3 -0.313 49.3 -79.6 -67.2 153.8 -23.6 -41.3 24.7 86 124 A P T 3 S+ 0 0 64 0, 0.0 -30,-0.2 0, 0.0 -1,-0.1 -0.396 123.1 9.0 -53.2 128.3 -27.4 -41.1 24.5 87 125 A G T 3 S+ 0 0 55 -32,-2.0 -31,-0.1 -30,-0.5 -29,-0.1 0.248 107.2 133.6 80.9 -11.8 -28.3 -37.4 24.1 88 126 A G < - 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