==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 23-JUN-03 1PTZ . COMPND 2 MOLECULE: SUPEROXIDE DISMUTASE [CU-ZN]; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.DIDONATO,L.CRAIG,M.E.HUFF,M.M.THAYER,R.M.F.CARDOSO, . 306 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13959.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 201 65.7 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 . 100 32.7 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 . 5 1.6 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 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 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 . 5 2 0 2 4 2 4 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 1 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 56 0, 0.0 105,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 172.0 26.9 -5.7 5.7 2 2 A T + 0 0 68 1,-0.3 20,-3.1 150,-0.3 2,-0.3 0.588 360.0 33.2-108.8 -20.5 25.0 -3.9 3.0 3 3 A K E +A 21 0A 66 149,-0.3 149,-2.3 18,-0.2 2,-0.3 -0.994 64.2 168.9-138.9 143.8 26.8 -0.5 3.4 4 4 A A E -AB 20 151A 2 16,-2.2 16,-2.9 -2,-0.3 2,-0.3 -0.933 11.5-159.3-146.9 167.4 30.3 0.4 4.4 5 5 A V E -AB 19 150A 2 145,-2.2 145,-2.9 -2,-0.3 2,-0.4 -0.996 7.0-159.4-152.9 150.6 32.6 3.5 4.4 6 6 A A E -A 18 0A 0 12,-2.2 12,-2.4 -2,-0.3 2,-0.8 -0.985 9.7-153.6-134.7 121.1 36.2 4.4 4.5 7 7 A V E -A 17 0A 21 141,-0.5 2,-0.4 -2,-0.4 10,-0.2 -0.866 21.7-145.4 -95.9 110.2 37.5 7.8 5.6 8 8 A L E +A 16 0A 1 8,-2.5 8,-1.6 -2,-0.8 2,-0.3 -0.651 30.6 155.3 -83.2 126.2 40.8 8.3 3.9 9 9 A K B +E 146 0B 124 137,-2.3 137,-2.1 -2,-0.4 2,-0.2 -0.987 7.3 164.5-145.7 149.5 43.5 10.2 5.8 10 10 A G - 0 0 33 4,-0.5 135,-0.2 2,-0.4 134,-0.1 -0.664 54.9 -79.8-144.5-160.2 47.3 10.3 5.6 11 11 A D S S+ 0 0 175 133,-0.3 134,-0.1 -2,-0.2 133,-0.1 0.630 110.3 47.8 -87.3 -13.3 50.3 12.3 6.7 12 12 A G S S- 0 0 50 132,-0.6 -2,-0.4 2,-0.2 25,-0.0 -0.083 109.6 -72.2-106.8-153.9 49.8 14.8 3.8 13 13 A P S S+ 0 0 94 0, 0.0 2,-0.3 0, 0.0 25,-0.1 0.566 88.5 113.7 -82.8 -9.2 46.9 16.7 2.2 14 14 A V + 0 0 8 23,-0.2 -4,-0.5 130,-0.2 2,-0.3 -0.488 39.3 142.2 -69.7 124.2 45.2 13.7 0.6 15 15 A Q E + C 0 36A 89 21,-1.9 21,-3.4 -2,-0.3 2,-0.3 -0.989 7.2 127.1-157.3 159.2 41.8 13.0 2.2 16 16 A G E -AC 8 35A 7 -8,-1.6 -8,-2.5 -2,-0.3 2,-0.4 -0.974 43.6-100.1 170.7-178.4 38.3 11.8 1.3 17 17 A I E -AC 7 34A 47 17,-1.5 17,-1.6 -2,-0.3 2,-0.5 -0.999 22.6-164.2-133.7 133.2 35.5 9.4 1.9 18 18 A I E -AC 6 33A 0 -12,-2.4 -12,-2.2 -2,-0.4 2,-0.3 -0.980 9.4-153.9-121.6 127.8 34.6 6.3 -0.1 19 19 A N E -AC 5 32A 43 13,-3.7 13,-2.1 -2,-0.5 2,-0.4 -0.740 3.3-158.6-100.7 147.6 31.2 4.6 0.3 20 20 A F E -AC 4 31A 1 -16,-2.9 -16,-2.2 -2,-0.3 2,-0.4 -0.970 8.8-177.2-125.4 140.6 30.5 0.9 -0.4 21 21 A E E +AC 3 30A 49 9,-2.0 9,-2.8 -2,-0.4 2,-0.4 -0.984 10.9 171.9-142.7 126.8 27.1 -0.5 -1.2 22 22 A Q - 0 0 5 -20,-3.1 7,-0.1 -2,-0.4 4,-0.1 -0.833 4.4-178.9-136.4 94.8 26.1 -4.2 -1.7 23 23 A K S S+ 0 0 100 -2,-0.4 2,-0.4 5,-0.3 -1,-0.1 0.694 70.5 47.0 -68.0 -20.8 22.4 -4.7 -1.9 24 24 A E S > S- 0 0 141 4,-0.4 3,-2.6 -22,-0.1 2,-0.1 -0.964 98.0 -92.8-129.4 144.3 22.7 -8.4 -2.4 25 25 A S T 3 S- 0 0 105 -2,-0.4 -2,-0.1 1,-0.3 -23,-0.1 -0.284 109.6 -12.4 -53.6 121.0 24.7 -11.1 -0.6 26 26 A N T 3 S+ 0 0 100 1,-0.2 -1,-0.3 -4,-0.1 3,-0.1 0.762 109.8 131.2 53.8 29.6 28.0 -11.6 -2.4 27 27 A G < - 0 0 13 -3,-2.6 -1,-0.2 1,-0.2 74,-0.1 -0.277 67.8 -51.0 -96.3-173.2 26.6 -9.5 -5.3 28 28 A P - 0 0 60 0, 0.0 2,-0.5 0, 0.0 -4,-0.4 -0.261 54.1-138.6 -62.1 148.3 28.2 -6.6 -7.1 29 29 A V E - D 0 101A 0 72,-3.0 72,-2.3 -7,-0.1 2,-0.5 -0.934 4.3-146.9-113.2 126.6 29.6 -3.8 -4.9 30 30 A K E -CD 21 100A 66 -9,-2.8 -9,-2.0 -2,-0.5 2,-0.5 -0.786 14.8-168.8 -91.0 132.0 29.2 -0.1 -5.8 31 31 A V E +CD 20 99A 1 68,-3.1 68,-3.5 -2,-0.5 2,-0.3 -0.981 19.5 151.8-124.1 116.6 32.2 2.0 -4.7 32 32 A W E +CD 19 98A 97 -13,-2.1 -13,-3.7 -2,-0.5 2,-0.3 -0.994 10.3 94.8-148.3 153.1 31.8 5.8 -4.8 33 33 A G E -CD 18 97A 15 64,-1.8 64,-2.3 -2,-0.3 2,-0.3 -0.977 56.7 -86.1 162.5-157.6 33.0 9.0 -3.2 34 34 A S E -CD 17 96A 55 -17,-1.6 -17,-1.5 -2,-0.3 2,-0.4 -0.996 20.2-162.1-147.9 148.8 35.7 11.6 -3.7 35 35 A I E -CD 16 95A 1 60,-1.5 60,-2.9 -2,-0.3 -19,-0.3 -0.998 15.0-170.3-131.1 132.4 39.3 12.1 -2.7 36 36 A K E +C 15 0A 97 -21,-3.4 -21,-1.9 -2,-0.4 58,-0.2 -0.752 57.7 52.7-120.5 169.3 41.0 15.5 -2.7 37 37 A G S S+ 0 0 37 55,-0.4 -23,-0.2 1,-0.3 57,-0.1 0.582 79.2 130.6 84.2 10.2 44.6 16.8 -2.4 38 38 A L - 0 0 12 55,-2.1 2,-0.4 -3,-0.2 -1,-0.3 -0.411 63.4-106.4 -91.8 169.5 45.9 14.5 -5.1 39 39 A T - 0 0 102 -2,-0.1 50,-0.3 82,-0.1 52,-0.1 -0.828 50.0 -92.3 -96.0 133.5 48.0 15.2 -8.2 40 40 A E S S+ 0 0 124 -2,-0.4 2,-0.2 51,-0.2 50,-0.2 -0.106 89.9 44.3 -45.0 133.8 46.1 15.2 -11.5 41 41 A G E S-F 89 0B 24 48,-2.2 48,-2.6 2,-0.1 2,-0.2 -0.721 97.4 -23.2 125.2-175.5 46.2 11.8 -13.1 42 42 A L E -F 88 0B 87 -2,-0.2 2,-0.4 46,-0.2 46,-0.2 -0.520 53.2-175.3 -75.7 136.4 45.9 8.1 -12.4 43 43 A R E -F 87 0B 38 44,-2.2 44,-2.2 -2,-0.2 80,-0.3 -0.996 31.0-105.0-136.4 129.5 46.4 6.9 -8.8 44 44 A G E -F 86 0B 0 78,-2.9 76,-2.7 -2,-0.4 2,-0.3 -0.132 33.9-168.7 -51.1 145.0 46.5 3.3 -7.5 45 45 A F E + G 0 119B 0 40,-2.5 39,-1.2 74,-0.2 2,-0.3 -0.898 19.1 147.6-144.1 106.3 43.4 2.3 -5.5 46 46 A H E -FG 83 118B 0 72,-1.9 72,-3.0 -2,-0.3 2,-0.6 -0.932 46.6-119.7-141.0 164.6 43.3 -1.0 -3.5 47 47 A V E - G 0 117B 0 35,-1.9 17,-2.7 -2,-0.3 70,-0.3 -0.912 36.0-153.0-101.4 121.3 41.9 -2.8 -0.5 48 48 A H E -HG 63 116B 1 68,-3.9 68,-1.9 -2,-0.6 15,-0.3 -0.627 22.0-109.1 -95.1 158.1 44.8 -4.0 1.7 49 49 A E S S+ 0 0 63 13,-3.0 2,-0.4 -2,-0.2 12,-0.2 0.855 91.3 50.4 -53.7 -50.2 44.7 -7.0 4.0 50 50 A F - 0 0 43 10,-2.6 2,-1.0 12,-0.2 256,-0.2 -0.783 58.9-149.7-105.5 139.3 44.7 -5.4 7.5 51 51 A G + 0 0 1 254,-1.6 2,-0.6 63,-0.7 253,-0.4 -0.358 59.2 134.0 -92.2 53.3 42.6 -2.7 9.0 52 52 A D + 0 0 30 -2,-1.0 3,-0.3 7,-0.2 9,-0.1 -0.911 26.0 166.9-112.2 108.2 45.6 -1.9 11.1 53 53 A N > + 0 0 44 -2,-0.6 3,-1.4 1,-0.2 -1,-0.1 0.058 42.4 114.5-106.9 23.0 46.6 1.7 11.4 54 54 A T T 3 S+ 0 0 61 1,-0.3 -1,-0.2 5,-0.1 3,-0.1 0.796 92.0 29.3 -64.5 -26.2 49.0 1.4 14.3 55 55 A A T > S- 0 0 52 1,-0.6 3,-1.1 -3,-0.3 4,-0.5 -0.314 120.0-103.3-126.3 47.4 51.8 2.5 12.0 56 56 A G T < S- 0 0 31 -3,-1.4 -1,-0.6 1,-0.2 3,-0.5 -0.332 80.7 -27.6 65.9-148.2 49.9 4.7 9.6 57 57 A a T > S+ 0 0 16 1,-0.2 3,-1.2 86,-0.2 -1,-0.2 0.676 129.3 73.3 -76.5 -15.1 49.0 3.2 6.2 58 58 A T G X S+ 0 0 99 -3,-1.1 3,-1.8 1,-0.2 -1,-0.2 0.881 87.0 61.3 -66.9 -36.7 52.1 0.9 6.2 59 59 A S G 3 S+ 0 0 23 -3,-0.5 -1,-0.2 -4,-0.5 -7,-0.2 0.549 82.4 82.9 -68.9 -3.4 50.6 -1.5 8.8 60 60 A A G < S- 0 0 1 -3,-1.2 -10,-2.6 1,-0.2 -1,-0.3 0.673 87.2-156.6 -72.1 -15.9 47.7 -2.2 6.4 61 61 A G < - 0 0 18 -3,-1.8 -1,-0.2 -12,-0.2 3,-0.1 -0.300 32.9 -22.4 76.2-159.7 50.1 -4.7 4.8 62 62 A P S S- 0 0 75 0, 0.0 -13,-3.0 0, 0.0 -12,-0.2 -0.090 87.2 -63.0 -79.1 179.8 49.8 -6.0 1.2 63 63 A H B -H 48 0B 8 73,-0.3 2,-0.3 -15,-0.3 -15,-0.3 -0.388 64.5 -94.4 -65.6 143.3 46.8 -6.1 -1.1 64 64 A F + 0 0 7 -17,-2.7 18,-2.3 52,-0.2 17,-0.5 -0.435 59.1 162.9 -59.2 118.3 43.9 -8.3 0.1 65 65 A N > + 0 0 45 -2,-0.3 3,-1.6 15,-0.2 -1,-0.1 -0.434 14.0 156.9-144.9 66.6 44.7 -11.6 -1.7 66 66 A P T 3 S+ 0 0 58 0, 0.0 -1,-0.1 0, 0.0 14,-0.1 0.658 80.1 54.6 -65.7 -17.2 42.9 -14.6 -0.1 67 67 A L T 3 S- 0 0 84 2,-0.0 -2,-0.0 0, 0.0 13,-0.0 0.375 106.1-127.4 -97.6 3.5 43.1 -16.6 -3.4 68 68 A S < + 0 0 105 -3,-1.6 2,-0.2 1,-0.1 12,-0.1 0.914 56.5 145.6 51.2 53.4 46.9 -16.2 -3.6 69 69 A R - 0 0 75 10,-0.1 -1,-0.1 1,-0.1 2,-0.1 -0.582 50.7 -91.0-110.6 175.2 47.0 -14.8 -7.1 70 70 A K - 0 0 79 -2,-0.2 66,-0.2 1,-0.1 2,-0.1 -0.409 50.1 -86.6 -84.2 163.6 49.2 -12.2 -8.8 71 71 A H + 0 0 5 64,-2.3 2,-0.3 8,-0.2 -1,-0.1 -0.421 62.0 148.1 -68.6 142.4 48.5 -8.5 -8.9 72 72 A G - 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