==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 03-OCT-12 4BCY . COMPND 2 MOLECULE: SUPEROXIDE DISMUTASE [CU-ZN]; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR W.AWAD,K.SARABOJI,J.DANIELSSON,L.LANG,M.KURNIK,S.L.MARKLUND, . 146 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7861.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 90 61.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 54 37.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 11 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 3 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 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 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 0 1 1 2 0 2 1 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 0 0 0 0 0 0 0 0 1 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 1 A A 0 0 72 0, 0.0 2,-0.4 0, 0.0 22,-0.2 0.000 360.0 360.0 360.0 138.2 12.3 -20.2 1.2 2 2 A T E -A 22 0A 44 20,-2.6 20,-2.5 22,-0.1 2,-0.4 -0.894 360.0-162.8-110.6 139.4 14.2 -16.9 1.2 3 3 A K E +A 21 0A 104 -2,-0.4 143,-2.4 18,-0.2 2,-0.3 -0.955 8.7 179.7-127.4 142.7 12.3 -13.6 1.8 4 4 A A E -AB 20 145A 0 16,-2.2 16,-2.6 -2,-0.4 2,-0.4 -0.947 9.5-158.5-139.0 160.5 13.3 -10.0 1.2 5 5 A V E -AB 19 144A 41 139,-2.6 139,-2.6 -2,-0.3 2,-0.4 -0.999 1.8-165.2-138.2 139.6 11.7 -6.6 1.6 6 6 A A E -AB 18 143A 0 12,-2.6 12,-2.9 -2,-0.4 2,-0.7 -0.997 10.7-152.6-121.7 131.2 12.4 -3.2 0.0 7 7 A V E -A 17 0A 83 135,-0.5 2,-0.5 -2,-0.4 10,-0.2 -0.912 16.8-146.9-103.1 109.9 11.0 -0.0 1.6 8 8 A L E +A 16 0A 1 8,-2.6 8,-1.9 -2,-0.7 2,-0.3 -0.701 27.5 161.7 -83.8 125.0 10.6 2.6 -1.2 9 9 A K B +C 140 0A 154 131,-2.2 131,-2.4 -2,-0.5 2,-0.2 -0.977 5.0 165.2-137.3 150.2 11.1 6.2 -0.2 10 10 A G - 0 0 37 4,-0.4 129,-0.2 2,-0.4 128,-0.1 -0.750 51.9 -86.4-145.6-165.1 11.8 9.4 -2.2 11 11 A D S S+ 0 0 180 127,-0.3 128,-0.1 -2,-0.2 127,-0.1 0.607 110.9 44.4 -85.3 -17.3 11.8 13.2 -2.1 12 12 A G S S- 0 0 49 126,-0.5 -2,-0.4 2,-0.1 126,-0.0 -0.092 113.2 -72.7-104.7-151.0 8.1 13.4 -3.0 13 13 A P S S+ 0 0 91 0, 0.0 2,-0.3 0, 0.0 25,-0.1 0.557 86.2 119.4 -88.2 -10.4 5.1 11.4 -1.8 14 14 A V + 0 0 7 23,-0.3 -4,-0.4 124,-0.2 2,-0.3 -0.396 36.8 146.5 -66.1 120.0 5.9 8.1 -3.5 15 15 A Q E + D 0 36A 100 21,-2.3 21,-2.9 -2,-0.3 2,-0.3 -0.995 11.2 145.7-150.3 154.2 6.3 5.3 -1.0 16 16 A G E -AD 8 35A 12 -8,-1.9 -8,-2.6 -2,-0.3 2,-0.5 -0.985 39.5-113.8-176.4 169.9 5.7 1.7 -0.5 17 17 A I E -AD 7 34A 100 17,-1.0 17,-0.9 -2,-0.3 2,-0.5 -0.979 29.2-169.0-117.7 121.1 6.6 -1.7 0.8 18 18 A I E -AD 6 33A 0 -12,-2.9 -12,-2.6 -2,-0.5 2,-0.3 -0.946 4.6-157.6-115.2 127.4 7.7 -4.4 -1.7 19 19 A N E -AD 5 32A 47 13,-3.1 13,-2.3 -2,-0.5 2,-0.4 -0.747 5.0-167.1-101.2 148.0 8.0 -8.1 -0.7 20 20 A F E +AD 4 31A 0 -16,-2.6 -16,-2.2 -2,-0.3 2,-0.3 -0.984 6.4 179.2-128.4 142.9 10.1 -10.8 -2.4 21 21 A E E -AD 3 30A 37 9,-2.0 9,-2.8 -2,-0.4 2,-0.4 -0.986 8.5-176.2-146.2 139.2 9.9 -14.6 -1.9 22 22 A Q E -AD 2 29A 2 -20,-2.5 -20,-2.6 -2,-0.3 7,-0.2 -0.976 8.1-166.6-136.5 116.4 11.8 -17.4 -3.5 23 23 A K S S+ 0 0 143 5,-0.6 2,-0.3 -2,-0.4 -1,-0.1 0.847 78.0 29.5 -73.4 -38.4 10.9 -21.0 -2.5 24 24 A E S > S- 0 0 129 4,-0.3 3,-2.5 -23,-0.1 -1,-0.1 -0.935 85.5-115.2-123.2 147.8 14.0 -22.7 -4.1 25 25 A S T 3 S+ 0 0 85 -2,-0.3 76,-0.3 1,-0.3 75,-0.1 0.716 121.2 29.5 -55.3 -23.5 17.5 -21.2 -4.5 26 26 A N T 3 S+ 0 0 142 73,-0.1 -1,-0.3 74,-0.1 3,-0.1 -0.049 102.9 106.8-124.3 29.0 16.9 -21.5 -8.3 27 27 A G S < S- 0 0 15 -3,-2.5 0, 0.0 1,-0.2 0, 0.0 -0.484 79.9 -73.9 -98.8 172.8 13.1 -21.1 -8.4 28 28 A P - 0 0 67 0, 0.0 -5,-0.6 0, 0.0 2,-0.5 -0.295 43.8-127.1 -62.8 155.3 11.0 -18.1 -9.5 29 29 A V E -DE 22 95A 0 66,-2.8 66,-2.5 69,-0.2 2,-0.4 -0.914 13.7-148.2-105.7 126.8 10.8 -15.0 -7.3 30 30 A K E -DE 21 94A 73 -9,-2.8 -9,-2.0 -2,-0.5 2,-0.4 -0.803 15.5-170.5 -90.4 133.8 7.4 -13.7 -6.4 31 31 A V E +DE 20 93A 0 62,-2.8 62,-2.7 -2,-0.4 2,-0.3 -0.994 16.5 150.7-128.1 127.7 7.3 -9.9 -5.9 32 32 A W E +DE 19 92A 102 -13,-2.3 -13,-3.1 -2,-0.4 2,-0.3 -0.983 7.5 98.5-153.3 162.0 4.3 -8.0 -4.5 33 33 A G E -DE 18 91A 16 58,-2.0 58,-3.1 -2,-0.3 2,-0.4 -0.921 56.1 -79.0 150.9-170.3 3.1 -5.0 -2.6 34 34 A S E -DE 17 90A 56 -17,-0.9 -17,-1.0 -2,-0.3 2,-0.5 -0.980 22.6-158.9-129.4 142.2 1.6 -1.6 -3.0 35 35 A I E -DE 16 89A 0 54,-2.3 54,-2.6 -2,-0.4 2,-0.3 -0.978 17.6-172.3-116.6 129.5 3.1 1.7 -4.0 36 36 A K E +D 15 0A 115 -21,-2.9 -21,-2.3 -2,-0.5 52,-0.2 -0.767 55.6 50.6-117.7 165.0 1.2 4.9 -3.1 37 37 A G S S+ 0 0 30 49,-0.4 -23,-0.3 -2,-0.3 51,-0.2 0.517 80.1 118.1 88.1 6.1 1.6 8.6 -3.9 38 38 A L - 0 0 14 49,-2.3 2,-0.3 -3,-0.2 -1,-0.2 0.032 60.8-118.8 -81.6-163.7 1.9 8.1 -7.7 39 39 A T - 0 0 96 48,-0.1 44,-0.3 -3,-0.1 47,-0.1 -0.886 47.7 -68.3-131.3 166.9 -0.4 9.4 -10.4 40 40 A E S S+ 0 0 113 45,-0.3 2,-0.3 -2,-0.3 44,-0.2 -0.337 94.1 50.8 -61.0 126.8 -2.5 7.4 -12.9 41 41 A G E S-F 83 0A 25 42,-2.3 42,-2.6 -2,-0.1 2,-0.4 -0.960 87.1 -43.7 149.1-165.1 -0.3 5.6 -15.4 42 42 A L E -F 82 0A 87 -2,-0.3 2,-0.4 40,-0.2 40,-0.2 -0.867 44.1-172.4-107.1 139.0 2.7 3.3 -16.0 43 43 A F E -F 81 0A 10 38,-2.4 38,-2.6 -2,-0.4 74,-0.3 -0.994 28.6-109.6-136.0 129.8 6.0 3.6 -14.2 44 44 A G E -F 80 0A 0 72,-2.7 70,-2.5 -2,-0.4 2,-0.4 -0.237 31.6-167.4 -56.9 144.8 9.3 1.8 -14.7 45 45 A F E + G 0 113A 0 34,-2.5 33,-0.9 68,-0.2 2,-0.3 -0.947 20.8 147.2-144.6 107.1 10.2 -0.6 -12.0 46 46 A H E -FG 77 112A 0 66,-2.1 66,-2.6 -2,-0.4 2,-0.6 -0.961 49.0-114.7-143.4 158.9 13.7 -2.1 -11.8 47 47 A V E - G 0 111A 0 29,-2.0 11,-2.9 -2,-0.3 64,-0.2 -0.873 40.4-158.1 -91.2 124.6 16.5 -3.4 -9.7 48 48 A H E -HG 57 110A 4 62,-3.5 62,-1.7 -2,-0.6 9,-0.3 -0.636 24.7-115.4-104.7 164.5 19.5 -1.1 -10.0 49 49 A E S S+ 0 0 91 7,-2.7 8,-0.1 -2,-0.2 -1,-0.1 0.752 74.1 116.7 -70.9 -28.2 23.2 -1.7 -9.4 50 50 A E + 0 0 80 6,-0.3 60,-0.3 1,-0.2 -2,-0.1 -0.118 19.4 149.5 -52.8 131.0 23.6 0.7 -6.5 51 51 A E 0 0 93 58,-0.1 -1,-0.2 91,-0.1 91,-0.0 0.592 360.0 360.0-121.2 -41.2 24.5 -0.9 -3.2 52 52 A D 0 0 173 0, 0.0 56,-0.0 0, 0.0 -2,-0.0 0.732 360.0 360.0 -68.3 360.0 26.5 1.8 -1.5 53 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 54 60 A A 0 0 126 0, 0.0 82,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 26.4 21.9 7.6 -11.1 55 61 A G - 0 0 20 1,-0.1 3,-0.1 -7,-0.0 -5,-0.0 -0.179 360.0 -94.3 -73.9 163.3 23.5 4.2 -11.7 56 62 A P - 0 0 73 0, 0.0 -7,-2.7 0, 0.0 -6,-0.3 -0.046 48.3 -78.2 -72.6 170.4 22.5 1.6 -14.3 57 63 A H B -H 48 0A 3 73,-0.4 2,-0.3 -9,-0.3 -9,-0.3 -0.336 61.1 -87.9 -62.2 148.3 20.1 -1.4 -14.1 58 64 A F + 0 0 8 -11,-2.9 18,-2.4 52,-0.2 17,-0.3 -0.509 61.2 164.0 -62.1 121.3 21.5 -4.4 -12.3 59 65 A N > + 0 0 42 -2,-0.3 3,-1.7 15,-0.2 -1,-0.1 -0.438 14.6 157.6-147.5 60.1 23.1 -6.2 -15.2 60 66 A P T 3 S+ 0 0 43 0, 0.0 -1,-0.1 0, 0.0 14,-0.1 0.725 80.4 53.6 -65.4 -20.7 25.6 -9.0 -14.1 61 67 A L T 3 S- 0 0 75 2,-0.0 -2,-0.0 0, 0.0 13,-0.0 0.311 108.2-122.7 -96.4 6.3 25.3 -10.8 -17.5 62 68 A S < + 0 0 106 -3,-1.7 2,-0.2 1,-0.1 12,-0.1 0.933 58.5 148.5 55.6 53.2 26.1 -7.7 -19.6 63 69 A R - 0 0 105 10,-0.1 2,-0.2 1,-0.1 -1,-0.1 -0.564 48.1-101.6-106.8 173.2 22.9 -7.7 -21.6 64 70 A K - 0 0 132 -2,-0.2 66,-0.2 1,-0.1 65,-0.1 -0.592 49.2 -84.2 -92.5 161.8 20.8 -4.9 -23.2 65 71 A H + 0 0 9 64,-2.7 2,-0.3 8,-0.2 -1,-0.1 -0.338 58.4 149.1 -67.3 143.3 17.5 -3.6 -21.7 66 72 A G - 0 0 1 64,-0.1 13,-0.3 8,-0.1 55,-0.3 -0.905 48.5 -77.4-152.5-178.9 14.3 -5.3 -22.3 67 73 A G > - 0 0 3 53,-0.8 3,-1.8 -2,-0.3 10,-0.1 -0.449 55.3 -98.7 -76.7 166.5 10.9 -6.1 -20.8 68 74 A P T 3 S+ 0 0 36 0, 0.0 28,-0.2 0, 0.0 29,-0.1 0.791 123.3 47.4 -62.1 -26.3 10.7 -8.9 -18.2 69 75 A K T 3 S+ 0 0 156 26,-0.1 2,-0.2 3,-0.0 4,-0.1 0.343 89.1 109.1 -99.2 8.4 9.5 -11.5 -20.7 70 76 A D S < S- 0 0 51 -3,-1.8 -4,-0.1 1,-0.1 50,-0.0 -0.583 71.1-132.9 -83.8 146.3 12.2 -10.6 -23.4 71 77 A E S S+ 0 0 188 -2,-0.2 2,-0.7 1,-0.2 -1,-0.1 0.844 101.4 53.9 -64.3 -34.4 15.0 -13.0 -24.2 72 78 A E S S+ 0 0 85 -7,-0.1 2,-0.3 -9,-0.1 -1,-0.2 -0.914 80.8 120.8-103.5 109.7 17.4 -10.0 -24.0 73 79 A R - 0 0 14 -2,-0.7 -8,-0.2 -7,-0.1 2,-0.2 -0.984 60.9 -99.6-157.9 162.1 17.1 -8.1 -20.7 74 80 A H > - 0 0 12 -2,-0.3 3,-1.8 -8,-0.2 -15,-0.2 -0.530 38.1-115.5 -75.0 154.2 19.0 -7.0 -17.7 75 81 A V T 3 S+ 0 0 9 -17,-0.3 -16,-0.2 1,-0.3 23,-0.2 0.917 117.7 54.6 -55.4 -38.2 18.6 -9.1 -14.5 76 82 A G T 3 S+ 0 0 0 -18,-2.4 -29,-2.0 -29,-0.2 2,-1.4 0.432 76.3 118.5 -76.8 1.8 16.9 -6.0 -13.0 77 83 A D E < +F 46 0A 0 -3,-1.8 -31,-0.2 -19,-0.2 -1,-0.1 -0.523 21.7 153.7 -81.6 91.2 14.3 -5.5 -15.7 78 84 A L E - 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