==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 21-NOV-03 1RK7 . COMPND 2 MOLECULE: SUPEROXIDE DISMUTASE [CU-ZN]; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.BANCI,I.BERTINI,F.CRAMARO,R.DEL CONTE,M.S.VIEZZOLI . 153 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9172.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 73 47.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 1.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 28 18.3 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 . 1 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 . 23 15.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 3 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 2 1.3 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 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 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 2 0 1 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 94 0, 0.0 2,-0.8 0, 0.0 22,-0.2 0.000 360.0 360.0 360.0 -60.5 -8.1 -6.8 -13.5 2 2 A T E -A 22 0A 39 20,-0.6 2,-0.8 22,-0.2 20,-0.6 -0.729 360.0-179.1 -85.1 108.6 -5.2 -4.7 -12.4 3 3 A K E +AB 21 152A 76 -2,-0.8 149,-1.3 149,-0.5 18,-0.3 -0.807 9.9 178.7-111.6 88.3 -3.3 -6.5 -9.7 4 4 A A E -AB 20 151A 0 16,-3.3 16,-2.1 -2,-0.8 2,-0.3 -0.402 8.3-159.4 -84.9 164.7 -0.4 -4.2 -8.6 5 5 A V E -AB 19 150A 36 145,-2.5 145,-2.0 14,-0.3 14,-0.2 -0.972 15.0-173.9-144.4 155.5 2.1 -5.1 -6.0 6 6 A A E -A 18 0A 3 12,-1.7 12,-2.5 -2,-0.3 2,-1.1 -0.686 9.4-161.8-155.5 93.4 4.5 -3.2 -3.7 7 7 A V E -A 17 0A 87 10,-0.2 10,-0.2 -2,-0.2 141,-0.2 -0.682 28.7-129.0 -81.6 99.6 6.9 -5.1 -1.6 8 8 A L + 0 0 1 -2,-1.1 2,-0.2 8,-1.1 110,-0.1 -0.081 43.4 153.7 -46.2 145.3 8.0 -2.6 1.0 9 9 A K + 0 0 158 6,-0.1 137,-0.9 8,-0.0 6,-0.1 -0.811 19.0 86.0-178.3 136.1 11.7 -2.3 1.4 10 10 A G S S+ 0 0 40 4,-0.3 135,-0.2 -2,-0.2 5,-0.1 -0.518 80.9 48.9 171.6 -95.1 14.3 0.2 2.5 11 11 A D S S- 0 0 93 1,-0.1 4,-0.1 -2,-0.1 134,-0.0 0.856 107.7-112.9 -38.4 -46.0 15.3 0.8 6.1 12 12 A G S S+ 0 0 55 2,-0.3 -1,-0.1 0, 0.0 132,-0.0 -0.405 104.2 49.9 144.0 -61.0 15.8 -3.0 6.2 13 13 A P S S+ 0 0 77 0, 0.0 2,-1.3 0, 0.0 25,-0.1 0.867 85.4 92.7 -75.0 -39.1 13.2 -4.4 8.6 14 14 A V + 0 0 7 1,-0.2 -2,-0.3 23,-0.2 -4,-0.3 -0.400 43.2 149.1 -60.0 92.8 10.3 -2.6 6.9 15 15 A Q + 0 0 109 21,-2.5 -1,-0.2 -2,-1.3 -7,-0.1 -0.155 19.7 165.0-120.5 35.6 9.3 -5.3 4.5 16 16 A G - 0 0 0 20,-0.2 -8,-1.1 -9,-0.1 2,-0.4 0.135 29.6-138.3 -45.6 168.9 5.6 -4.5 4.3 17 17 A I E +AC 7 34A 60 17,-3.0 17,-1.2 -10,-0.2 2,-0.5 -0.870 24.0 173.6-142.2 103.6 3.5 -6.0 1.5 18 18 A I E -AC 6 33A 8 -12,-2.5 -12,-1.7 -2,-0.4 2,-0.4 -0.951 6.1-175.2-115.4 128.7 0.9 -3.9 -0.2 19 19 A N E -AC 5 32A 33 13,-2.3 13,-1.6 -2,-0.5 2,-0.6 -0.937 16.2-144.3-123.8 145.9 -1.0 -5.1 -3.2 20 20 A F E +AC 4 31A 4 -16,-2.1 -16,-3.3 -2,-0.4 2,-0.4 -0.934 21.5 178.1-114.7 111.9 -3.4 -3.3 -5.4 21 21 A E E +AC 3 30A 38 9,-2.0 9,-2.1 -2,-0.6 -18,-0.2 -0.912 14.2 173.6-115.1 140.2 -6.3 -5.3 -6.8 22 22 A Q E +A 2 0A 32 -20,-0.6 2,-3.0 -2,-0.4 -20,-0.6 -0.440 5.5 168.4-142.2 62.4 -9.2 -4.0 -9.0 23 23 A K + 0 0 162 -22,-0.2 2,-0.3 -21,-0.1 6,-0.0 -0.339 53.1 94.5 -75.1 59.8 -11.3 -7.0 -10.0 24 24 A E - 0 0 100 -2,-3.0 -22,-0.2 3,-0.2 3,-0.1 -0.978 62.6-154.7-154.5 139.2 -13.9 -4.6 -11.3 25 25 A S S S+ 0 0 127 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.0 0.576 108.4 13.4 -87.3 -12.3 -14.8 -3.1 -14.6 26 26 A N S S+ 0 0 141 2,-0.1 -1,-0.2 0, 0.0 76,-0.0 -0.050 111.3 99.0-153.0 34.3 -16.5 -0.2 -12.8 27 27 A G S S- 0 0 11 -5,-0.1 -3,-0.2 -3,-0.1 74,-0.1 -0.774 72.6 -93.6-123.3 167.9 -15.3 -0.6 -9.2 28 28 A P - 0 0 46 0, 0.0 2,-0.7 0, 0.0 74,-0.3 -0.215 46.4 -94.1 -75.0 168.9 -12.7 1.0 -7.0 29 29 A V E - D 0 101A 0 72,-3.6 72,-1.4 -7,-0.1 2,-1.2 -0.784 33.4-133.3 -90.0 113.6 -9.2 -0.4 -6.5 30 30 A K E -CD 21 100A 123 -9,-2.1 -9,-2.0 -2,-0.7 2,-0.5 -0.530 28.4-168.7 -68.9 97.6 -9.1 -2.7 -3.4 31 31 A V E +CD 20 99A 13 68,-2.6 68,-3.0 -2,-1.2 2,-0.3 -0.815 21.2 144.3 -94.9 124.7 -6.0 -1.4 -1.7 32 32 A W E +CD 19 98A 85 -13,-1.6 -13,-2.3 -2,-0.5 2,-0.2 -0.966 9.4 147.4-159.1 143.2 -4.8 -3.5 1.1 33 33 A G E -CD 18 97A 3 64,-0.7 64,-1.4 -2,-0.3 2,-0.3 -0.845 32.5-122.8-157.2-168.8 -1.4 -4.4 2.5 34 34 A S E -CD 17 96A 42 -17,-1.2 -17,-3.0 62,-0.3 62,-0.3 -0.901 16.3-144.7-157.0 122.8 0.6 -5.3 5.6 35 35 A I - 0 0 15 60,-2.7 2,-0.3 -19,-0.3 -21,-0.1 -0.376 9.9-163.9 -83.0 164.8 3.8 -3.7 7.0 36 36 A K + 0 0 106 58,-0.2 -21,-2.5 -2,-0.1 -20,-0.2 -0.793 67.2 31.8-155.8 105.7 6.5 -5.5 8.8 37 37 A G S S+ 0 0 36 55,-0.5 -23,-0.2 1,-0.4 57,-0.1 -0.209 85.7 101.6 144.0 -45.5 9.1 -3.9 11.0 38 38 A L - 0 0 24 55,-0.2 -1,-0.4 1,-0.1 2,-0.3 0.255 68.2-116.7 -52.7-170.9 7.4 -0.9 12.5 39 39 A T - 0 0 105 54,-0.3 50,-0.3 -3,-0.1 2,-0.2 -0.994 38.1 -77.2-139.6 144.2 6.2 -0.9 16.0 40 40 A E S S+ 0 0 134 -2,-0.3 2,-0.3 48,-0.1 51,-0.0 -0.116 99.4 74.4 -40.4 95.8 2.7 -0.7 17.6 41 41 A G S S- 0 0 24 -2,-0.2 48,-1.5 52,-0.1 2,-0.4 -0.922 88.3 -50.7-177.5-160.3 2.3 3.0 17.3 42 42 A L - 0 0 60 -2,-0.3 2,-0.4 46,-0.2 46,-0.2 -0.856 44.6-179.6-104.8 136.4 1.6 5.9 14.9 43 43 A H - 0 0 3 -2,-0.4 44,-1.5 44,-0.4 80,-0.2 -0.987 35.1-101.2-139.5 125.7 3.5 6.2 11.6 44 44 A G B -E 86 0B 5 78,-0.7 76,-0.9 -2,-0.4 42,-0.2 0.107 46.6-102.0 -37.8 154.0 3.1 8.9 9.0 45 45 A F - 0 0 36 40,-1.7 -1,-0.1 92,-0.2 37,-0.0 -0.457 39.7 -93.4 -83.7 157.4 1.1 7.9 5.9 46 46 A H S S+ 0 0 16 -2,-0.1 38,-0.2 1,-0.1 71,-0.2 0.005 96.4 59.8 -59.8 173.2 2.6 7.1 2.6 47 47 A V + 0 0 16 69,-0.8 2,-0.2 1,-0.2 18,-0.1 0.996 65.8 137.4 65.2 77.6 3.0 9.7 -0.1 48 48 A H + 0 0 9 68,-0.3 2,-0.4 16,-0.1 -1,-0.2 -0.738 13.6 156.0-157.4 101.1 5.3 12.2 1.6 49 49 A E - 0 0 31 -2,-0.2 15,-0.2 1,-0.2 3,-0.1 -0.944 20.2-170.1-134.4 111.6 8.2 13.8 -0.2 50 50 A E S S- 0 0 101 -2,-0.4 2,-0.3 1,-0.2 -1,-0.2 0.984 70.9 -26.4 -60.0 -62.6 9.6 17.2 0.9 51 51 A E + 0 0 154 12,-0.0 -1,-0.2 10,-0.0 2,-0.2 -0.878 61.4 155.2-146.4 176.1 11.9 17.7 -2.1 52 52 A D + 0 0 47 -2,-0.3 -3,-0.0 -3,-0.1 4,-0.0 -0.476 14.6 173.1 156.9 131.0 13.8 15.9 -4.8 53 53 A N S S+ 0 0 157 -2,-0.2 -1,-0.0 8,-0.1 6,-0.0 0.152 82.3 60.0-136.6 12.3 15.1 16.6 -8.2 54 54 A T S S- 0 0 113 0, 0.0 -2,-0.0 0, 0.0 5,-0.0 0.682 92.7-137.5-110.7 -33.1 17.1 13.4 -8.8 55 55 A A - 0 0 38 1,-0.0 4,-0.1 7,-0.0 -3,-0.0 0.751 24.9-176.6 72.9 116.6 14.4 10.8 -8.4 56 56 A G S S+ 0 0 69 2,-0.1 3,-0.1 -4,-0.0 -1,-0.0 0.656 82.1 3.5-112.7 -30.4 15.2 7.7 -6.5 57 57 A a S S- 0 0 63 1,-0.3 2,-0.1 57,-0.1 89,-0.0 0.654 129.1 -14.1-118.3 -72.3 12.1 5.7 -6.9 58 58 A T - 0 0 42 56,-0.1 -1,-0.3 58,-0.0 2,-0.2 -0.140 58.7-133.0-114.7-149.9 9.6 7.5 -9.2 59 59 A S + 0 0 99 55,-0.2 -6,-0.0 -4,-0.1 -7,-0.0 -0.607 56.6 98.7-178.5 111.9 9.3 11.0 -10.7 60 60 A A S S- 0 0 110 -2,-0.2 54,-0.0 0, 0.0 0, 0.0 0.208 93.5 -22.6-159.6 -56.5 6.2 13.2 -10.9 61 61 A G - 0 0 42 -10,-0.0 2,-2.7 4,-0.0 3,-0.4 -0.507 43.0-153.7-176.3 99.6 6.2 15.8 -8.1 62 62 A P S S+ 0 0 32 0, 0.0 3,-0.1 0, 0.0 -10,-0.0 -0.302 84.7 78.3 -75.0 56.6 8.0 15.5 -4.7 63 63 A H S S- 0 0 133 -2,-2.7 -13,-0.1 1,-0.6 -12,-0.0 -0.065 101.0-108.1-154.7 36.9 5.4 17.8 -3.1 64 64 A F - 0 0 33 -3,-0.4 -1,-0.6 -15,-0.2 -16,-0.1 -0.323 55.9 -55.4 67.8-149.9 2.5 15.6 -2.5 65 65 A N >> - 0 0 43 -18,-0.1 4,-2.5 -3,-0.1 3,-0.7 -0.956 28.3-131.0-131.2 149.3 -0.6 16.0 -4.7 66 66 A P T 34 S+ 0 0 103 0, 0.0 4,-0.1 0, 0.0 -2,-0.0 0.455 104.6 71.4 -75.0 -0.5 -2.9 19.0 -5.4 67 67 A L T 34 S+ 0 0 60 2,-0.1 13,-1.1 1,-0.1 3,-0.1 0.861 112.5 23.1 -81.0 -39.8 -5.8 16.7 -4.6 68 68 A S T <4 S- 0 0 0 -3,-0.7 2,-3.5 11,-0.3 11,-1.2 0.814 78.8-179.7 -93.1 -39.1 -5.0 16.6 -0.9 69 69 A R < + 0 0 174 -4,-2.5 2,-0.3 9,-0.2 -1,-0.1 -0.307 69.5 27.0 70.5 -60.8 -3.1 19.9 -0.7 70 70 A K S S- 0 0 103 -2,-3.5 9,-0.5 13,-0.1 66,-0.2 -0.907 96.0 -98.2-130.7 158.0 -2.5 19.4 3.0 71 71 A H + 0 0 35 64,-2.1 65,-0.1 -2,-0.3 64,-0.1 0.819 67.4 172.8 -40.2 -37.4 -2.3 16.4 5.3 72 72 A G + 0 0 3 63,-0.5 -3,-0.0 1,-0.1 -4,-0.0 0.183 24.4 121.5 48.7-177.2 -6.0 17.2 6.0 73 73 A G S S+ 0 0 19 12,-0.1 -1,-0.1 -3,-0.0 12,-0.1 -0.745 81.2 33.1 132.7 -85.0 -8.1 14.9 8.1 74 74 A P S S+ 0 0 108 0, 0.0 -2,-0.0 0, 0.0 -1,-0.0 0.784 131.3 37.2 -75.0 -29.2 -9.5 16.7 11.2 75 75 A K S S- 0 0 171 0, 0.0 -3,-0.0 0, 0.0 0, 0.0 0.727 98.5-149.1 -91.4 -27.7 -9.7 20.0 9.3 76 76 A D + 0 0 93 1,-0.1 -4,-0.1 -6,-0.0 -5,-0.1 0.958 35.3 157.3 53.7 90.5 -10.8 18.3 6.1 77 77 A E S S- 0 0 112 -7,-0.2 -1,-0.1 -9,-0.1 -6,-0.1 0.521 75.5 -56.6-115.9 -16.7 -9.3 20.6 3.4 78 78 A E + 0 0 80 -8,-0.1 -10,-0.2 -7,-0.0 -9,-0.2 -0.209 57.7 170.4 173.9 -68.0 -9.2 18.1 0.6 79 79 A R + 0 0 83 -11,-1.2 -11,-0.3 -9,-0.5 -10,-0.1 0.803 31.2 142.2 30.9 45.5 -7.2 14.9 1.3 80 80 A H + 0 0 130 -13,-1.1 -12,-0.2 -15,-0.1 -1,-0.2 0.591 58.0 57.2 -85.7 -13.3 -8.7 13.6 -1.9 81 81 A V S S- 0 0 19 2,-0.2 2,-0.3 -16,-0.1 -3,-0.0 -0.040 118.6 -66.9 -97.7-157.8 -5.4 11.9 -2.7 82 82 A G S S+ 0 0 8 1,-0.1 2,-0.5 -2,-0.1 -2,-0.1 -0.150 101.7 104.8 -88.4 38.8 -3.4 9.4 -0.7 83 83 A D + 0 0 3 -2,-0.3 -2,-0.2 1,-0.1 -13,-0.1 -0.817 29.7 136.3-123.7 89.1 -2.7 11.9 2.0 84 84 A L - 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