==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 16-JUN-09 2WKO . COMPND 2 MOLECULE: SUPEROXIDE DISMUTASE [CU-ZN]; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.V.ANTONYUK,A.GALALELDEEN,R.STRANGE,L.WHITSON,N.NARAYANA, . 306 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14386.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 204 66.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 105 34.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 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 . 2 0.7 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 . 27 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 7 2.3 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 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 RESIDUES PER ALPHA HELIX . 2 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 . 6 1 1 2 4 0 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 . 0 0 0 0 0 0 0 0 0 2 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 0 100 0, 0.0 2,-0.3 0, 0.0 22,-0.2 0.000 360.0 360.0 360.0 152.1 20.4 2.8 26.5 2 2 A T E -A 22 0A 52 20,-2.4 20,-2.5 22,-0.1 2,-0.3 -0.929 360.0-158.9-126.7 155.0 23.8 1.9 25.0 3 3 A K E +AB 21 152A 84 149,-0.6 149,-2.1 -2,-0.3 2,-0.3 -0.946 10.2 179.1-124.3 149.5 25.8 -1.3 24.9 4 4 A A E -AB 20 151A 2 16,-1.8 16,-2.9 -2,-0.3 2,-0.3 -0.933 7.1-160.7-140.5 170.2 29.5 -1.7 24.3 5 5 A V E -AB 19 150A 3 145,-2.2 145,-2.9 -2,-0.3 2,-0.4 -0.990 4.0-163.2-155.2 149.7 31.9 -4.7 24.2 6 6 A C E -A 18 0A 1 12,-2.4 12,-2.9 -2,-0.3 2,-0.6 -0.998 8.4-154.9-143.4 132.1 35.6 -5.4 24.5 7 7 A V E -A 17 0A 32 141,-0.4 2,-0.4 -2,-0.4 141,-0.2 -0.956 21.2-144.0-110.5 115.5 37.6 -8.5 23.6 8 8 A L E +A 16 0A 0 8,-2.5 8,-1.1 -2,-0.6 2,-0.3 -0.678 25.8 169.3 -88.7 128.8 40.8 -8.7 25.6 9 9 A K B +C 146 0A 123 137,-2.6 137,-2.2 -2,-0.4 2,-0.2 -0.976 1.4 157.5-138.6 144.1 43.9 -10.1 23.8 10 10 A G - 0 0 35 4,-0.4 135,-0.2 2,-0.3 134,-0.1 -0.831 53.7 -85.5-151.1-169.9 47.6 -10.1 24.8 11 11 A D S S+ 0 0 180 133,-0.3 134,-0.1 -2,-0.2 133,-0.1 0.629 108.6 41.4 -82.8 -18.7 51.0 -11.9 24.3 12 12 A G S S- 0 0 50 132,-0.6 -2,-0.3 2,-0.1 25,-0.0 -0.049 112.9 -68.0-107.7-148.5 50.3 -14.6 26.8 13 13 A P S S+ 0 0 91 0, 0.0 2,-0.4 0, 0.0 25,-0.1 0.375 85.7 119.9 -91.9 3.4 47.2 -16.7 27.7 14 14 A V + 0 0 7 130,-0.3 -4,-0.4 23,-0.1 2,-0.3 -0.567 34.1 143.8 -75.4 127.4 45.0 -13.9 29.1 15 15 A Q E + D 0 36A 96 21,-1.6 21,-2.7 -2,-0.4 2,-0.3 -0.977 7.1 127.3-155.8 162.2 41.8 -13.5 27.1 16 16 A G E -AD 8 35A 13 -8,-1.1 -8,-2.5 -2,-0.3 2,-0.4 -0.950 44.5 -99.9 167.0 175.3 38.1 -12.7 27.7 17 17 A I E -AD 7 34A 64 17,-1.2 17,-1.2 -2,-0.3 2,-0.5 -0.993 24.1-164.5-128.9 127.5 35.1 -10.6 26.8 18 18 A I E -AD 6 33A 0 -12,-2.9 -12,-2.4 -2,-0.4 2,-0.3 -0.956 7.3-157.2-113.9 129.1 33.9 -7.6 28.8 19 19 A N E -AD 5 32A 52 13,-3.4 13,-2.3 -2,-0.5 2,-0.4 -0.799 2.7-160.3-101.2 143.7 30.4 -6.2 28.2 20 20 A F E -AD 4 31A 1 -16,-2.9 -16,-1.8 -2,-0.3 2,-0.3 -0.962 8.4-177.1-121.0 142.3 29.3 -2.7 29.1 21 21 A E E -AD 3 30A 27 9,-1.9 9,-2.8 -2,-0.4 2,-0.4 -0.978 8.3-179.8-142.4 132.2 25.7 -1.5 29.6 22 22 A Q E -A 2 0A 1 -20,-2.5 -20,-2.4 -2,-0.3 7,-0.1 -0.930 6.9-171.0-134.1 111.5 24.3 2.0 30.3 23 23 A K S S+ 0 0 120 5,-0.5 2,-0.3 -2,-0.4 -1,-0.1 0.843 72.0 23.0 -68.2 -40.1 20.5 2.4 30.6 24 24 A E S > S- 0 0 146 4,-0.3 3,-2.3 -23,-0.1 -1,-0.1 -0.936 96.0 -83.8-133.6 146.9 20.4 6.2 30.7 25 25 A S T 3 S- 0 0 104 -2,-0.3 83,-0.1 1,-0.3 -2,-0.1 -0.323 117.2 -3.3 -48.3 123.9 22.5 9.1 29.5 26 26 A N T 3 S+ 0 0 111 1,-0.2 -1,-0.3 81,-0.2 3,-0.1 0.576 104.4 126.7 57.9 16.0 25.1 9.6 32.3 27 27 A G S < S- 0 0 16 -3,-2.3 -1,-0.2 1,-0.2 74,-0.0 -0.214 72.2 -62.2 -75.2-177.1 23.6 6.9 34.5 28 28 A P - 0 0 49 0, 0.0 -5,-0.5 0, 0.0 2,-0.5 -0.270 47.1-131.9 -71.4 155.2 25.7 4.1 35.9 29 29 A V E - E 0 101A 0 72,-3.8 72,-2.8 75,-0.1 2,-0.5 -0.946 8.7-145.4-109.3 128.8 27.5 1.5 33.7 30 30 A K E -DE 21 100A 93 -9,-2.8 -9,-1.9 -2,-0.5 2,-0.5 -0.803 16.5-166.6 -84.5 134.6 27.3 -2.2 34.4 31 31 A V E +DE 20 99A 1 68,-3.4 68,-2.7 -2,-0.5 2,-0.3 -0.979 20.0 152.6-127.7 116.5 30.6 -3.9 33.5 32 32 A W E +DE 19 98A 106 -13,-2.3 -13,-3.4 -2,-0.5 2,-0.3 -1.000 7.2 94.6-150.9 152.8 30.6 -7.7 33.2 33 33 A G E -DE 18 97A 18 64,-1.7 64,-3.1 -2,-0.3 2,-0.4 -0.968 56.9 -80.2 163.0-158.2 32.2 -10.7 31.7 34 34 A S E -DE 17 96A 47 -17,-1.2 -17,-1.2 -2,-0.3 2,-0.5 -0.999 23.7-163.6-143.1 136.3 34.9 -13.3 32.3 35 35 A I E -DE 16 95A 0 60,-2.7 60,-3.4 -2,-0.4 -19,-0.2 -0.990 13.5-170.5-122.3 130.3 38.6 -13.3 31.9 36 36 A K E +D 15 0A 102 -21,-2.7 -21,-1.6 -2,-0.5 58,-0.2 -0.680 58.1 48.9-112.0 169.4 40.7 -16.5 31.8 37 37 A G S S+ 0 0 27 56,-0.5 2,-0.3 55,-0.3 57,-0.2 0.694 76.9 134.0 79.5 20.2 44.4 -17.3 31.9 38 38 A L - 0 0 2 55,-2.1 -1,-0.3 -3,-0.2 2,-0.1 -0.784 60.8-111.8-102.9 143.3 45.1 -15.1 34.9 39 39 A T - 0 0 99 -2,-0.3 50,-0.4 82,-0.1 52,-0.1 -0.471 50.1 -87.2 -71.4 145.7 47.1 -16.1 37.9 40 40 A E S S+ 0 0 135 -2,-0.1 2,-0.2 51,-0.1 50,-0.2 -0.232 93.7 40.6 -50.6 136.8 45.1 -16.4 41.1 41 41 A G E S-F 89 0A 25 48,-2.0 48,-2.7 -3,-0.1 2,-0.2 -0.748 97.2 -21.1 118.5-167.9 44.7 -13.1 42.9 42 42 A L E -F 88 0A 86 -2,-0.2 2,-0.4 46,-0.2 46,-0.2 -0.564 46.4-175.6 -87.7 139.5 44.1 -9.4 42.1 43 43 A H E -F 87 0A 3 44,-2.4 44,-2.5 -2,-0.2 80,-0.3 -0.994 29.5-115.7-134.2 124.5 44.8 -7.8 38.8 44 44 A G E -F 86 0A 0 78,-2.4 76,-2.9 -2,-0.4 2,-0.4 -0.245 28.3-161.9 -57.1 150.2 44.4 -4.0 38.1 45 45 A F E + G 0 119A 0 40,-2.2 39,-1.3 74,-0.2 2,-0.3 -0.976 19.0 157.4-148.5 110.6 41.7 -3.1 35.6 46 46 A H E -FG 83 118A 0 72,-2.1 72,-2.5 -2,-0.4 2,-0.6 -0.945 42.9-122.7-138.0 156.5 41.6 0.3 33.8 47 47 A V E - G 0 117A 0 35,-1.7 17,-2.9 -2,-0.3 70,-0.2 -0.919 36.4-152.8 -93.0 123.2 40.3 2.2 30.8 48 48 A H E -HG 63 116A 1 68,-3.4 68,-1.4 -2,-0.6 15,-0.2 -0.602 21.9-110.9 -96.0 161.2 43.4 3.7 29.1 49 49 A E S S+ 0 0 64 13,-2.6 2,-0.4 -2,-0.2 12,-0.2 0.821 91.1 53.7 -66.5 -41.9 43.2 6.9 27.1 50 50 A F - 0 0 15 10,-3.2 2,-0.6 12,-0.2 256,-0.2 -0.814 61.1-147.4-104.5 140.1 43.8 5.6 23.5 51 51 A G + 0 0 2 254,-1.7 2,-0.6 63,-0.5 253,-0.4 -0.248 63.0 128.2 -87.7 44.8 42.0 2.8 21.5 52 52 A D + 0 0 30 -2,-0.6 3,-0.1 7,-0.2 -2,-0.1 -0.912 22.4 158.4-109.7 110.6 45.4 2.3 19.8 53 53 A N > + 0 0 33 -2,-0.6 3,-1.9 6,-0.1 4,-0.1 0.043 36.7 116.4-117.3 22.7 46.7 -1.3 19.9 54 54 A T T 3 S+ 0 0 56 1,-0.3 -1,-0.1 2,-0.1 3,-0.1 0.828 93.5 30.5 -60.1 -39.8 49.2 -1.1 16.9 55 55 A A T > S- 0 0 63 1,-0.5 3,-0.8 -3,-0.1 -1,-0.3 -0.106 125.0-114.2-101.8 30.7 52.1 -1.8 19.3 56 56 A G G X S- 0 0 32 -3,-1.9 3,-1.8 1,-0.2 -1,-0.5 -0.351 74.4 -17.5 68.3-152.6 49.7 -3.9 21.4 57 57 A a G > S+ 0 0 17 1,-0.3 3,-1.3 2,-0.2 -1,-0.2 0.764 129.1 71.8 -60.5 -25.8 48.7 -2.8 25.0 58 58 A T G X S+ 0 0 114 -3,-0.8 3,-0.8 1,-0.2 -1,-0.3 0.816 91.6 55.5 -54.9 -37.1 51.8 -0.5 25.0 59 59 A S G < S+ 0 0 26 -3,-1.8 -1,-0.2 1,-0.2 -7,-0.2 0.577 81.6 89.9 -81.7 -1.7 50.2 2.0 22.6 60 60 A A G < S- 0 0 0 -3,-1.3 -10,-3.2 -4,-0.3 56,-0.2 0.652 82.8-145.7 -73.3 -14.5 47.1 2.5 24.7 61 61 A G < - 0 0 19 -3,-0.8 -1,-0.2 -4,-0.2 3,-0.1 -0.366 35.4 -37.2 81.5-166.3 48.6 5.4 26.6 62 62 A P S S- 0 0 72 0, 0.0 -13,-2.6 0, 0.0 -12,-0.2 -0.085 86.0 -53.2 -81.0-175.9 48.0 6.2 30.3 63 63 A H B -H 48 0A 9 73,-0.3 2,-0.5 -15,-0.2 -15,-0.3 -0.342 65.5-100.1 -56.9 137.6 44.8 6.0 32.4 64 64 A F + 0 0 8 -17,-2.9 18,-2.6 52,-0.2 17,-0.4 -0.519 58.2 161.1 -63.6 113.6 41.9 7.8 30.9 65 65 A N > + 0 0 46 -2,-0.5 3,-1.5 15,-0.2 -1,-0.1 -0.507 13.2 157.6-140.9 63.7 41.9 11.0 32.9 66 66 A P T 3 S+ 0 0 60 0, 0.0 -1,-0.1 0, 0.0 14,-0.1 0.807 79.6 53.0 -65.7 -26.9 40.0 13.9 31.3 67 67 A L T 3 S- 0 0 84 0, 0.0 -2,-0.0 0, 0.0 13,-0.0 0.200 108.1-124.0 -91.5 16.7 39.5 15.8 34.6 68 68 A S < + 0 0 106 -3,-1.5 2,-0.2 1,-0.1 12,-0.1 0.877 57.5 147.9 40.6 58.4 43.3 15.7 35.4 69 69 A R - 0 0 107 10,-0.1 2,-0.2 1,-0.1 -1,-0.1 -0.486 49.3 -96.8-103.7-178.3 43.0 13.9 38.8 70 70 A K - 0 0 118 -2,-0.2 66,-0.2 1,-0.1 65,-0.1 -0.614 49.7 -84.3 -92.0 161.6 45.3 11.5 40.6 71 71 A H + 0 0 8 64,-2.3 2,-0.3 -2,-0.2 -1,-0.1 -0.356 60.5 146.5 -65.5 137.2 45.0 7.7 40.5 72 72 A G - 0 0 2 8,-0.1 13,-0.3 64,-0.1 55,-0.3 -0.876 49.7 -73.7-149.3-175.1 42.6 6.1 43.0 73 73 A G > - 0 0 2 53,-0.7 3,-1.2 -2,-0.3 10,-0.1 -0.444 52.2-102.6 -76.5 165.5 40.2 3.2 43.5 74 74 A P T 3 S+ 0 0 32 0, 0.0 29,-0.1 0, 0.0 -1,-0.1 0.695 121.1 49.7 -64.4 -24.3 36.8 3.3 41.8 75 75 A K T 3 S+ 0 0 157 3,-0.1 2,-0.1 26,-0.1 4,-0.1 0.463 90.4 105.5 -97.1 -0.7 35.0 4.2 45.0 76 76 A D S < S- 0 0 64 -3,-1.2 3,-0.1 1,-0.1 -4,-0.1 -0.403 71.7-136.3 -73.3 151.6 37.4 7.0 45.8 77 77 A E S S+ 0 0 192 1,-0.2 2,-0.8 -2,-0.1 -1,-0.1 0.859 99.5 56.7 -71.7 -40.1 36.4 10.7 45.3 78 78 A E S S+ 0 0 93 -7,-0.1 2,-0.3 -9,-0.1 -1,-0.2 -0.849 81.3 121.0 -98.4 110.0 39.8 11.3 43.7 79 79 A R - 0 0 13 -2,-0.8 2,-0.2 -7,-0.1 -8,-0.2 -0.977 62.9-101.4-157.3 161.7 40.3 9.0 40.8 80 80 A H > - 0 0 10 -2,-0.3 3,-1.6 -8,-0.2 -15,-0.2 -0.591 39.8-116.0 -78.3 154.5 40.9 8.9 37.0 81 81 A V T 3 S+ 0 0 4 -17,-0.4 -16,-0.2 1,-0.3 22,-0.1 0.897 117.2 55.3 -59.7 -33.3 37.8 8.3 35.0 82 82 A G T 3 S+ 0 0 0 -18,-2.6 -35,-1.7 -35,-0.2 2,-1.0 0.539 76.5 118.3 -78.0 -4.4 39.4 5.0 33.9 83 83 A D E < +F 46 0A 0 -3,-1.6 -37,-0.2 -19,-0.3 21,-0.1 -0.496 23.5 157.5 -75.0 97.6 40.1 3.7 37.4 84 84 A L E - 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