==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 14-NOV-11 4A7G . COMPND 2 MOLECULE: SUPEROXIDE DISMUTASE [CU-ZN]; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR G.S.A.WRIGHT,N.M.KERSHAW,R.SHARMA,S.V.ANTONYUK,R.W.STRANGE,N . 306 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14375.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 192 62.7 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 . 106 34.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 0.3 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 . 22 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 9.8 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 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 . 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 0 3 2 1 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 87 0, 0.0 2,-0.4 0, 0.0 22,-0.2 0.000 360.0 360.0 360.0 156.0 9.2 4.5 30.2 2 2 A T E -A 22 0A 68 20,-2.6 20,-2.7 149,-0.0 2,-0.3 -0.886 360.0-166.3-109.9 138.9 8.3 3.3 26.7 3 3 A K E +A 21 0A 78 149,-0.4 149,-2.3 -2,-0.4 2,-0.3 -0.943 10.7 175.0-129.2 149.7 4.7 3.0 25.7 4 4 A A E -AB 20 151A 2 16,-2.2 16,-2.7 -2,-0.3 2,-0.3 -0.936 8.2-161.7-147.2 167.1 2.8 1.4 22.8 5 5 A V E -AB 19 150A 2 145,-2.2 145,-3.1 -2,-0.3 2,-0.4 -0.984 4.5-160.3-152.2 152.0 -0.8 0.8 21.8 6 6 A C E -A 18 0A 1 12,-2.4 12,-2.7 -2,-0.3 2,-0.6 -0.982 8.2-154.7-140.6 129.8 -2.9 -1.3 19.5 7 7 A V E -A 17 0A 38 141,-0.4 2,-0.5 -2,-0.4 10,-0.2 -0.908 21.1-149.5-100.5 116.9 -6.4 -0.8 18.2 8 8 A L E +A 16 0A 1 8,-2.6 8,-2.0 -2,-0.6 2,-0.3 -0.805 28.1 155.1 -93.8 126.5 -7.9 -4.2 17.4 9 9 A K B +E 146 0B 146 137,-2.3 137,-2.5 -2,-0.5 2,-0.2 -0.960 7.2 161.0-143.6 155.5 -10.4 -4.4 14.5 10 10 A G - 0 0 30 4,-0.4 135,-0.2 2,-0.4 134,-0.1 -0.799 54.7 -75.9-152.7-161.0 -11.7 -7.0 12.1 11 11 A D S S+ 0 0 175 133,-0.3 134,-0.1 -2,-0.2 133,-0.1 0.600 109.7 42.2 -85.1 -13.3 -14.5 -7.9 9.8 12 12 A G S S- 0 0 50 132,-0.6 -2,-0.4 2,-0.2 132,-0.0 -0.141 110.3 -66.4-112.2-149.9 -16.9 -8.9 12.6 13 13 A P S S+ 0 0 95 0, 0.0 2,-0.4 0, 0.0 25,-0.1 0.511 88.6 111.5 -86.4 -4.3 -17.9 -7.6 16.0 14 14 A V + 0 0 8 130,-0.2 -4,-0.4 23,-0.1 2,-0.3 -0.535 37.9 148.8 -79.0 125.8 -14.6 -8.1 17.8 15 15 A Q E + C 0 36A 99 21,-1.8 21,-2.9 -2,-0.4 2,-0.3 -0.994 9.4 151.3-152.2 151.2 -12.8 -4.9 18.7 16 16 A G E -AC 8 35A 9 -8,-2.0 -8,-2.6 -2,-0.3 2,-0.4 -0.980 35.0-122.1-167.1 176.4 -10.5 -3.7 21.5 17 17 A I E -AC 7 34A 53 17,-1.8 17,-1.7 -2,-0.3 2,-0.4 -0.996 24.3-171.4-133.7 125.8 -7.8 -1.4 22.7 18 18 A I E -AC 6 33A 0 -12,-2.7 -12,-2.4 -2,-0.4 2,-0.3 -0.982 4.5-160.7-123.8 130.7 -4.6 -2.8 24.2 19 19 A N E -AC 5 32A 48 13,-3.2 13,-2.3 -2,-0.4 2,-0.4 -0.820 2.3-163.1-108.1 148.3 -1.9 -0.7 25.9 20 20 A F E +AC 4 31A 1 -16,-2.7 -16,-2.2 -2,-0.3 2,-0.3 -0.984 8.0 178.5-129.8 139.6 1.7 -1.6 26.5 21 21 A E E -AC 3 30A 60 9,-2.1 9,-2.9 -2,-0.4 2,-0.5 -0.985 8.2-173.4-145.0 137.3 4.2 -0.0 28.9 22 22 A Q E -AC 2 29A 3 -20,-2.7 -20,-2.6 -2,-0.3 7,-0.2 -0.971 7.2-166.9-132.1 112.5 7.8 -0.9 29.7 23 23 A K S S+ 0 0 161 5,-0.6 2,-0.3 -2,-0.5 -1,-0.1 0.861 78.6 18.3 -68.2 -38.9 9.5 0.9 32.5 24 24 A E S > S- 0 0 109 4,-0.3 3,-2.2 -23,-0.1 -1,-0.2 -0.982 76.2-121.8-135.3 145.7 13.1 -0.3 31.6 25 25 A S T 3 S+ 0 0 88 -2,-0.3 82,-0.2 1,-0.3 81,-0.1 0.785 117.2 43.7 -62.0 -24.9 14.4 -1.8 28.4 26 26 A N T 3 S+ 0 0 137 79,-0.1 -1,-0.3 2,-0.0 -3,-0.0 0.236 106.0 87.2 -99.3 15.1 15.5 -4.9 30.4 27 27 A G S < S- 0 0 17 -3,-2.2 2,-0.0 1,-0.2 0, 0.0 -0.504 84.6 -78.4-110.0 177.3 12.3 -5.1 32.3 28 28 A P - 0 0 54 0, 0.0 -5,-0.6 0, 0.0 2,-0.5 -0.247 36.8-125.2 -72.8 158.5 8.8 -6.6 31.8 29 29 A V E -CD 22 101A 0 72,-3.0 72,-2.6 -7,-0.2 2,-0.4 -0.936 15.8-144.0-104.4 126.1 6.1 -5.1 29.6 30 30 A K E -CD 21 100A 114 -9,-2.9 -9,-2.1 -2,-0.5 2,-0.4 -0.746 17.0-167.1 -85.9 137.9 2.7 -4.5 31.2 31 31 A V E +CD 20 99A 0 68,-2.9 68,-2.7 -2,-0.4 2,-0.3 -0.996 16.6 156.8-129.7 122.6 -0.2 -5.2 28.8 32 32 A W E +CD 19 98A 97 -13,-2.3 -13,-3.2 -2,-0.4 2,-0.3 -0.999 11.4 88.7-150.5 153.0 -3.7 -4.0 29.6 33 33 A G E -CD 18 97A 18 64,-2.0 64,-3.0 -2,-0.3 2,-0.3 -0.991 55.8 -76.2 158.6-154.6 -7.0 -3.2 28.0 34 34 A S E -CD 17 96A 50 -17,-1.7 -17,-1.8 -2,-0.3 2,-0.4 -0.965 20.1-165.4-141.9 147.0 -10.3 -4.5 26.9 35 35 A I E -CD 16 95A 0 60,-1.7 60,-2.7 -2,-0.3 -19,-0.2 -0.990 17.5-172.9-135.5 130.7 -11.7 -6.6 24.0 36 36 A K E +C 15 0A 112 -21,-2.9 -21,-1.8 -2,-0.4 58,-0.2 -0.741 55.2 49.1-119.8 169.6 -15.4 -6.8 23.3 37 37 A G S S+ 0 0 37 55,-0.3 2,-0.3 1,-0.3 57,-0.2 0.626 76.9 142.4 77.1 18.6 -17.7 -8.7 21.0 38 38 A L - 0 0 9 55,-2.5 -1,-0.3 -3,-0.2 2,-0.1 -0.630 54.9-114.1 -90.9 148.1 -16.1 -12.1 21.9 39 39 A T - 0 0 98 -2,-0.3 50,-0.3 1,-0.1 -1,-0.1 -0.399 53.0 -84.4 -66.0 153.2 -17.8 -15.5 22.3 40 40 A E S S+ 0 0 112 -2,-0.1 2,-0.3 48,-0.1 50,-0.2 -0.341 92.9 32.2 -65.7 136.5 -17.5 -16.8 25.8 41 41 A G E S-F 89 0B 22 48,-2.4 48,-2.7 -3,-0.1 2,-0.3 -0.779 98.1 -16.7 118.6-162.8 -14.3 -18.6 26.6 42 42 A L E -F 88 0B 78 -2,-0.3 2,-0.4 46,-0.2 46,-0.2 -0.592 46.3-172.3 -86.6 144.7 -10.6 -18.5 25.7 43 43 A H E -F 87 0B 2 44,-2.4 44,-2.6 -2,-0.3 80,-0.2 -0.990 30.5-113.3-136.0 123.4 -9.3 -16.7 22.6 44 44 A G E -F 86 0B 0 78,-2.3 76,-2.6 -2,-0.4 2,-0.4 -0.237 29.8-162.7 -56.4 147.0 -5.6 -17.0 21.5 45 45 A F E + G 0 119B 3 40,-2.5 39,-1.2 74,-0.2 2,-0.3 -0.963 21.7 151.6-143.4 106.7 -3.7 -13.7 21.9 46 46 A H E -FG 83 118B 0 72,-1.9 72,-2.6 -2,-0.4 2,-0.6 -0.979 46.1-122.0-140.2 153.7 -0.4 -13.3 20.0 47 47 A V E - G 0 117B 0 35,-2.1 17,-2.9 -2,-0.3 70,-0.2 -0.863 36.5-153.8 -89.5 125.4 2.0 -10.9 18.4 48 48 A H E -HG 63 116B 0 68,-3.5 68,-1.3 -2,-0.6 15,-0.3 -0.624 22.1-109.4-100.1 161.5 2.5 -12.0 14.8 49 49 A E S S+ 0 0 71 13,-2.8 2,-0.4 -2,-0.2 12,-0.2 0.833 91.2 52.6 -62.6 -46.0 5.5 -11.2 12.7 50 50 A F - 0 0 12 10,-2.6 2,-0.5 12,-0.2 66,-0.3 -0.792 60.8-147.6-104.2 142.3 4.4 -8.6 10.2 51 51 A G + 0 0 2 254,-1.9 2,-0.6 63,-0.5 253,-0.3 -0.277 63.0 127.4 -89.8 46.0 2.6 -5.3 10.8 52 52 A D + 0 0 28 -2,-0.5 3,-0.1 7,-0.2 -2,-0.1 -0.932 26.3 163.3-113.7 115.4 0.9 -5.9 7.4 53 53 A N > + 0 0 43 -2,-0.6 3,-2.0 6,-0.1 -1,-0.1 0.073 33.8 126.7-115.3 22.6 -2.9 -5.7 7.2 54 54 A T T 3 S+ 0 0 65 1,-0.3 -1,-0.1 5,-0.1 3,-0.1 0.880 89.3 19.5 -48.4 -51.1 -3.1 -5.4 3.5 55 55 A A T 3 S- 0 0 72 1,-0.5 3,-0.3 -3,-0.1 -1,-0.3 0.056 127.3 -88.0-106.8 25.4 -5.5 -8.3 3.1 56 56 A G S X S- 0 0 22 -3,-2.0 3,-1.6 1,-0.2 -1,-0.5 -0.582 78.7 -30.7 92.6-165.6 -6.7 -8.3 6.7 57 57 A a G > S+ 0 0 16 1,-0.3 3,-1.5 -2,-0.2 -1,-0.2 0.700 125.1 72.9 -65.2 -20.9 -5.3 -10.2 9.6 58 58 A T G > S+ 0 0 101 -3,-0.3 3,-1.6 1,-0.3 -1,-0.3 0.819 85.9 66.9 -58.0 -32.1 -4.0 -13.0 7.4 59 59 A S G < S+ 0 0 26 -3,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.652 80.8 79.0 -68.4 -15.1 -1.3 -10.7 6.1 60 60 A A G < S- 0 0 0 -3,-1.5 -10,-2.6 -4,-0.2 -1,-0.3 0.607 87.9-152.3 -70.6 -14.2 0.4 -10.6 9.6 61 61 A G < - 0 0 16 -3,-1.6 -1,-0.2 -12,-0.2 3,-0.1 -0.298 37.0 -23.3 76.1-162.1 2.0 -14.0 9.0 62 62 A P S S- 0 0 72 0, 0.0 -13,-2.8 0, 0.0 -12,-0.2 -0.144 88.1 -62.3 -79.3 177.4 2.9 -16.4 11.8 63 63 A H B -H 48 0B 11 73,-0.3 2,-0.4 -15,-0.3 -15,-0.3 -0.333 65.7 -93.8 -57.2 142.5 3.6 -15.8 15.5 64 64 A F + 0 0 7 -17,-2.9 18,-2.5 52,-0.2 17,-0.3 -0.472 58.7 163.4 -61.8 119.6 6.6 -13.5 16.1 65 65 A N > + 0 0 48 -2,-0.4 3,-1.6 15,-0.2 -1,-0.1 -0.447 14.7 158.6-145.1 60.9 9.4 -16.0 16.6 66 66 A P T 3 S+ 0 0 45 0, 0.0 -1,-0.1 0, 0.0 14,-0.1 0.730 80.3 52.9 -65.0 -21.0 12.9 -14.4 16.2 67 67 A L T 3 S- 0 0 89 2,-0.0 13,-0.0 0, 0.0 -2,-0.0 0.358 106.5-123.4 -95.4 4.3 14.5 -17.3 18.2 68 68 A S < + 0 0 106 -3,-1.6 2,-0.2 1,-0.1 12,-0.1 0.922 58.5 150.0 57.8 47.0 13.0 -20.1 16.1 69 69 A R - 0 0 77 10,-0.1 2,-0.2 1,-0.1 -1,-0.1 -0.508 48.7 -96.7 -99.0 172.6 11.3 -21.9 19.0 70 70 A K - 0 0 120 -2,-0.2 66,-0.2 1,-0.1 -1,-0.1 -0.504 50.3 -86.5 -82.7 158.7 8.2 -23.9 19.2 71 71 A H + 0 0 4 64,-2.6 2,-0.2 8,-0.2 -1,-0.1 -0.377 61.1 145.4 -66.1 141.2 4.9 -22.5 20.3 72 72 A G - 0 0 1 8,-0.1 13,-0.3 64,-0.1 55,-0.3 -0.828 46.0 -77.0-150.6-167.5 4.1 -22.3 24.0 73 73 A G > - 0 0 1 53,-0.6 3,-2.0 -2,-0.2 10,-0.1 -0.573 48.3 -99.1 -97.8 170.5 2.3 -20.3 26.6 74 74 A P T 3 S+ 0 0 42 0, 0.0 28,-0.2 0, 0.0 29,-0.1 0.778 121.4 52.3 -64.9 -25.8 3.6 -17.1 28.2 75 75 A K T 3 S+ 0 0 204 3,-0.1 2,-0.3 26,-0.1 3,-0.1 0.335 93.4 95.0 -89.6 5.3 4.9 -18.9 31.3 76 76 A D < - 0 0 62 -3,-2.0 -4,-0.1 1,-0.1 3,-0.1 -0.714 68.3-144.5 -95.6 146.7 6.9 -21.4 29.3 77 77 A E S S+ 0 0 174 -2,-0.3 2,-1.2 1,-0.2 -1,-0.1 0.899 96.3 65.4 -69.2 -42.5 10.6 -21.2 28.4 78 78 A E S S+ 0 0 74 -7,-0.1 2,-0.3 -3,-0.1 -5,-0.2 -0.713 81.4 110.8 -84.4 100.4 9.8 -22.8 25.1 79 79 A R S S- 0 0 9 -2,-1.2 2,-0.2 -7,-0.2 -8,-0.2 -0.975 70.9 -98.4-157.4 161.7 7.6 -20.3 23.4 80 80 A H > - 0 0 14 -2,-0.3 3,-2.0 -8,-0.2 -15,-0.2 -0.575 39.3-116.9 -76.1 150.1 7.6 -17.8 20.5 81 81 A V T 3 S+ 0 0 4 -17,-0.3 -16,-0.2 1,-0.3 23,-0.1 0.911 116.9 55.0 -55.0 -38.8 8.3 -14.2 21.6 82 82 A G T 3 S+ 0 0 0 -18,-2.5 -35,-2.1 -35,-0.2 2,-1.2 0.406 76.9 117.2 -75.7 1.9 4.8 -13.4 20.5 83 83 A D E < +F 46 0B 0 -3,-2.0 -37,-0.2 -19,-0.2 3,-0.1 -0.575 24.0 156.9 -81.3 97.1 3.1 -16.0 22.6 84 84 A L E - 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