==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 02-APR-11 3RE0 . COMPND 2 MOLECULE: SUPEROXIDE DISMUTASE [CU-ZN]; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR I.BERTINI,O.BLAZEVITS,V.CALDERONE,M.JAIFEI,M.VIERU,I.AMORI, . 555 8 4 2 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24981.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 363 65.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 205 36.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 7 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 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 0.4 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 . 53 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 5 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 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 RESIDUES PER ALPHA HELIX . 4 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 . 11 3 1 4 8 4 6 2 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 3 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 22,-0.2 0, 0.0 23,-0.1 0.000 360.0 360.0 360.0 70.3 2.5 -17.9 28.2 2 2 A T - 0 0 82 20,-0.4 20,-2.0 19,-0.1 2,-0.3 -0.158 360.0-165.1 -56.3 137.9 1.0 -14.6 29.4 3 3 A K E -A 21 0A 63 149,-0.4 149,-2.2 18,-0.2 2,-0.3 -0.935 9.5-169.8-128.7 148.9 -2.8 -14.5 29.8 4 4 A A E -AB 20 151A 1 16,-2.1 16,-2.5 -2,-0.3 2,-0.3 -0.843 2.8-163.2-134.4 173.3 -5.5 -11.8 30.1 5 5 A V E -AB 19 150A 1 145,-2.0 145,-2.8 -2,-0.3 2,-0.4 -0.987 3.1-159.7-156.7 150.5 -9.2 -11.7 31.0 6 6 A C E -A 18 0A 1 12,-2.8 12,-2.9 -2,-0.3 2,-0.5 -0.999 6.1-155.8-140.5 131.7 -12.1 -9.2 30.6 7 7 A V E -A 17 0A 28 141,-0.5 2,-0.4 -2,-0.4 10,-0.2 -0.960 19.4-148.6-107.2 121.4 -15.4 -9.1 32.5 8 8 A L E +A 16 0A 0 8,-2.7 8,-1.4 -2,-0.5 2,-0.3 -0.759 27.6 152.8 -96.0 139.7 -18.1 -7.2 30.5 9 9 A K B +C 146 0A 116 137,-1.8 137,-2.4 -2,-0.4 2,-0.3 -0.963 7.4 162.1-157.1 150.4 -20.8 -5.3 32.2 10 10 A G - 0 0 34 4,-0.5 135,-0.1 2,-0.4 134,-0.1 -0.915 55.3 -75.7-159.1-174.3 -23.0 -2.3 31.3 11 11 A D S S+ 0 0 179 -2,-0.3 134,-0.1 133,-0.1 133,-0.1 0.705 113.6 50.4 -62.8 -25.1 -26.3 -0.4 32.1 12 12 A G S S- 0 0 51 132,-0.6 -2,-0.4 2,-0.1 25,-0.0 0.122 108.3 -81.3 -93.1-150.3 -28.4 -3.1 30.4 13 13 A P S S+ 0 0 91 0, 0.0 2,-0.2 0, 0.0 25,-0.1 0.280 80.7 119.8-105.7 0.6 -28.4 -7.0 30.9 14 14 A V + 0 0 4 130,-0.2 -4,-0.5 23,-0.2 2,-0.3 -0.569 35.8 159.9 -70.4 138.3 -25.4 -8.0 28.7 15 15 A Q E + D 0 36A 77 21,-1.5 21,-2.6 -2,-0.2 2,-0.3 -0.986 1.7 135.1-153.3 147.4 -22.6 -9.8 30.6 16 16 A G E -AD 8 35A 14 -8,-1.4 -8,-2.7 -2,-0.3 2,-0.4 -0.987 39.8-110.9-178.4-177.5 -19.8 -12.1 29.9 17 17 A I E -AD 7 34A 63 17,-1.3 17,-1.3 -2,-0.3 2,-0.4 -0.993 24.8-169.4-130.0 127.2 -16.2 -13.2 30.4 18 18 A I E -AD 6 33A 0 -12,-2.9 -12,-2.8 -2,-0.4 2,-0.3 -0.957 3.4-162.5-123.4 138.9 -13.5 -13.1 27.8 19 19 A N E -AD 5 32A 41 13,-2.8 13,-1.4 -2,-0.4 2,-0.4 -0.861 2.0-165.6-117.9 149.7 -10.1 -14.6 27.9 20 20 A F E -AD 4 31A 0 -16,-2.5 -16,-2.1 -2,-0.3 2,-0.3 -0.975 6.6-179.7-129.9 147.4 -7.0 -13.9 25.9 21 21 A E E -AD 3 30A 26 9,-1.9 9,-3.0 -2,-0.4 2,-0.4 -0.967 13.7-175.7-151.0 134.5 -3.9 -16.0 25.7 22 22 A Q - 0 0 7 -20,-2.0 -20,-0.4 -2,-0.3 7,-0.1 -0.854 6.3-175.6-132.0 90.8 -0.7 -15.4 23.7 23 23 A K S S+ 0 0 131 -2,-0.4 2,-0.4 5,-0.2 -1,-0.1 0.745 74.2 35.7 -64.9 -28.0 1.4 -18.5 24.3 24 24 A E S S- 0 0 148 4,-0.4 -1,-0.1 -23,-0.1 0, 0.0 -0.999 86.7-122.1-133.2 137.6 4.4 -17.2 22.3 25 25 A S S S+ 0 0 95 -2,-0.4 82,-0.1 1,-0.2 81,-0.1 0.620 103.5 36.0 -57.2 -28.3 5.4 -13.5 22.3 26 26 A N S S+ 0 0 138 79,-0.1 -1,-0.2 2,-0.0 81,-0.1 0.934 107.1 65.1 -82.4 -56.2 5.2 -12.7 18.6 27 27 A G S S- 0 0 16 1,-0.1 74,-0.0 78,-0.0 -3,-0.0 0.464 87.5 -30.2 -75.8-159.1 2.3 -14.8 17.3 28 28 A P - 0 0 55 0, 0.0 2,-0.5 0, 0.0 -4,-0.4 0.176 42.8-135.3 -64.2 161.8 -1.5 -15.1 17.6 29 29 A V E - E 0 101A 0 72,-2.9 72,-2.6 -7,-0.1 2,-0.4 -0.987 16.2-145.9-110.8 123.8 -3.8 -14.3 20.5 30 30 A K E -DE 21 100A 96 -9,-3.0 -9,-1.9 -2,-0.5 2,-0.4 -0.719 17.7-171.1 -80.1 139.1 -6.5 -16.9 21.3 31 31 A V E +DE 20 99A 1 68,-2.1 68,-0.6 -2,-0.4 2,-0.3 -0.956 14.7 152.8-139.2 120.6 -9.6 -15.3 22.6 32 32 A W E +DE 19 98A 79 -13,-1.4 -13,-2.8 -2,-0.4 2,-0.3 -0.978 11.3 105.0-144.6 154.4 -12.5 -17.2 24.0 33 33 A G E -DE 18 97A 17 64,-1.4 64,-1.6 -2,-0.3 2,-0.3 -0.921 53.7 -95.7 170.3-147.9 -15.4 -16.9 26.4 34 34 A S E -DE 17 96A 50 -17,-1.3 -17,-1.3 -2,-0.3 2,-0.3 -0.953 20.5-159.3-157.5 151.0 -19.1 -16.4 26.2 35 35 A I E -DE 16 95A 0 60,-1.3 60,-3.0 -2,-0.3 -19,-0.2 -0.984 10.0-174.4-141.5 133.1 -21.5 -13.4 26.3 36 36 A K E +D 15 0A 110 -21,-2.6 -21,-1.5 -2,-0.3 58,-0.2 -0.709 56.1 66.5-116.8 170.8 -25.3 -13.5 27.2 37 37 A G S S+ 0 0 37 1,-0.3 2,-0.4 55,-0.3 -23,-0.2 0.470 75.5 128.8 94.0 4.8 -27.9 -10.8 27.1 38 38 A L - 0 0 9 55,-2.2 -1,-0.3 -23,-0.1 3,-0.1 -0.771 60.4-119.5-104.5 146.5 -27.9 -10.3 23.5 39 39 A T - 0 0 97 -2,-0.4 50,-0.2 1,-0.1 2,-0.1 -0.048 55.6 -82.3 -52.8 143.9 -30.4 -10.2 20.7 40 40 A E S S+ 0 0 127 51,-0.2 2,-0.3 48,-0.1 50,-0.2 -0.613 91.6 27.6 -68.5 148.3 -29.8 -12.9 18.0 41 41 A G E S-F 89 0A 25 48,-2.5 48,-3.2 -2,-0.1 2,-0.3 -0.766 96.1 -8.5 106.6-149.3 -27.3 -12.2 15.4 42 42 A L E -F 88 0A 89 -2,-0.3 2,-0.4 46,-0.2 46,-0.2 -0.623 47.2-172.4 -95.2 134.6 -24.2 -10.3 15.0 43 43 A H E -F 87 0A 2 44,-3.0 44,-2.3 -2,-0.3 80,-0.3 -0.987 30.4-112.0-129.4 135.0 -22.6 -7.8 17.3 44 44 A G E -F 86 0A 0 78,-1.9 76,-3.6 -2,-0.4 2,-0.4 -0.271 32.0-166.3 -53.9 139.3 -19.6 -5.5 16.9 45 45 A F E + G 0 119A 0 40,-2.1 39,-0.9 74,-0.2 2,-0.3 -0.917 19.8 160.6-141.3 101.1 -16.8 -6.6 19.2 46 46 A H E -FG 83 118A 0 72,-2.5 72,-3.0 -2,-0.4 2,-0.5 -0.945 42.3-128.4-136.9 150.8 -13.9 -4.1 19.6 47 47 A V E - G 0 117A 0 35,-1.8 17,-2.9 -2,-0.3 2,-0.2 -0.798 32.9-160.6 -92.2 123.9 -11.0 -2.9 21.6 48 48 A H E -HG 63 116A 2 68,-3.2 68,-1.4 -2,-0.5 15,-0.3 -0.703 24.0-109.5-104.8 168.0 -11.2 0.8 22.5 49 49 A E S S+ 0 0 66 13,-2.9 2,-0.4 -2,-0.2 12,-0.2 0.818 87.1 53.0 -74.8 -48.2 -8.4 2.9 23.5 50 50 A F - 0 0 18 10,-2.3 2,-1.1 12,-0.2 256,-0.2 -0.746 60.3-144.7 -99.8 139.5 -8.8 3.9 27.2 51 51 A G + 0 0 2 254,-1.9 2,-0.6 63,-0.5 253,-0.3 -0.295 62.0 132.9 -83.9 50.1 -9.3 1.6 30.2 52 52 A D + 0 0 26 -2,-1.1 3,-0.3 7,-0.2 9,-0.1 -0.884 26.6 164.8-116.4 108.6 -11.5 4.3 31.5 53 53 A N > + 0 0 42 -2,-0.6 3,-1.2 1,-0.2 -1,-0.1 0.045 39.6 116.7-109.8 29.4 -14.9 3.4 33.0 54 54 A T T 3 S+ 0 0 63 1,-0.3 -1,-0.2 5,-0.1 3,-0.1 0.694 90.3 26.9 -78.6 -23.3 -15.6 6.7 34.8 55 55 A A T > S- 0 0 68 1,-0.7 3,-0.7 -3,-0.3 -1,-0.3 -0.181 122.3 -99.9-119.9 41.8 -18.7 7.5 32.7 56 56 A G G X S- 0 0 27 -3,-1.2 3,-2.0 1,-0.2 -1,-0.7 -0.305 80.8 -25.8 64.8-161.5 -19.6 3.9 31.8 57 57 A a G > S+ 0 0 15 1,-0.3 3,-1.4 2,-0.2 -1,-0.2 0.736 127.9 75.0 -59.4 -22.6 -18.5 2.5 28.4 58 58 A T G X S+ 0 0 109 -3,-0.7 3,-1.4 1,-0.2 -1,-0.3 0.824 87.8 60.7 -56.3 -33.2 -18.5 6.0 26.9 59 59 A S G < S+ 0 0 23 -3,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.617 81.4 80.6 -80.2 -9.4 -15.2 6.8 28.6 60 60 A A G < S- 0 0 0 -3,-1.4 -10,-2.3 -4,-0.3 -1,-0.3 0.600 88.0-159.1 -62.4 -13.1 -13.4 4.0 26.8 61 61 A G < - 0 0 18 -3,-1.4 -1,-0.2 -4,-0.2 3,-0.1 -0.241 33.7 -14.4 67.2-151.3 -13.2 6.5 24.0 62 62 A P S S- 0 0 72 0, 0.0 -13,-2.9 0, 0.0 -12,-0.2 -0.103 85.4 -65.4 -86.2 178.4 -12.6 5.5 20.4 63 63 A H B -H 48 0A 14 -15,-0.3 2,-0.8 73,-0.2 -15,-0.3 -0.248 58.8-102.0 -54.4 145.7 -11.4 2.3 18.7 64 64 A F + 0 0 6 -17,-2.9 18,-2.5 52,-0.1 17,-0.4 -0.709 59.5 156.1 -76.2 115.6 -7.8 1.4 19.5 65 65 A N > + 0 0 48 -2,-0.8 3,-2.3 15,-0.2 -1,-0.1 -0.395 9.7 162.7-145.1 55.9 -6.1 2.6 16.3 66 66 A P T 3 S+ 0 0 46 0, 0.0 -1,-0.1 0, 0.0 14,-0.1 0.727 80.7 47.7 -58.6 -26.3 -2.5 3.3 17.1 67 67 A L T 3 S- 0 0 57 -3,-0.1 -3,-0.0 396,-0.0 396,-0.0 0.214 107.0-122.2 -96.2 10.1 -1.6 3.2 13.3 68 68 A S < + 0 0 97 -3,-2.3 2,-0.1 1,-0.1 12,-0.1 0.885 54.5 156.2 51.2 48.2 -4.4 5.5 12.1 69 69 A R - 0 0 78 10,-0.1 2,-0.2 1,-0.1 -1,-0.1 -0.443 46.9 -95.8 -92.0 175.0 -6.0 3.0 9.7 70 70 A K - 0 0 112 -2,-0.1 66,-0.2 1,-0.1 -1,-0.1 -0.630 49.7 -90.8 -85.0 151.4 -9.5 2.9 8.4 71 71 A H + 0 0 6 64,-2.3 2,-0.2 -2,-0.2 66,-0.1 -0.381 63.5 146.0 -59.7 135.4 -12.1 0.7 10.1 72 72 A G - 0 0 2 8,-0.1 13,-0.3 64,-0.1 55,-0.3 -0.853 47.9 -71.8-154.5-170.8 -12.3 -2.8 8.6 73 73 A G > - 0 0 2 53,-0.6 3,-1.6 -2,-0.2 10,-0.1 -0.527 48.5-103.6 -93.8 164.8 -12.8 -6.5 9.5 74 74 A P T 3 S+ 0 0 45 0, 0.0 -1,-0.1 0, 0.0 29,-0.1 0.775 119.9 56.3 -65.7 -17.1 -10.4 -8.6 11.4 75 75 A K T 3 S+ 0 0 208 3,-0.1 2,-0.1 26,-0.0 4,-0.1 0.703 90.4 94.5 -85.8 -18.2 -9.3 -10.3 8.2 76 76 A D S < S- 0 0 62 -3,-1.6 -4,-0.1 2,-0.2 50,-0.0 -0.375 70.2-140.4 -71.8 147.8 -8.4 -7.1 6.3 77 77 A E S S+ 0 0 155 1,-0.1 2,-0.9 -2,-0.1 -1,-0.1 0.771 100.3 65.8 -62.5 -35.2 -5.0 -5.5 6.0 78 78 A E S S+ 0 0 91 -9,-0.1 2,-0.3 -7,-0.1 -5,-0.2 -0.845 80.9 112.4-100.4 107.1 -6.8 -2.2 6.4 79 79 A R - 0 0 13 -2,-0.9 -8,-0.2 -7,-0.1 2,-0.1 -0.967 68.1 -99.7-168.3 147.4 -8.2 -2.3 10.0 80 80 A H > - 0 0 8 -2,-0.3 3,-0.9 -8,-0.2 -15,-0.2 -0.492 37.4-118.6 -65.8 152.3 -7.9 -0.8 13.4 81 81 A V T 3 S+ 0 0 6 -17,-0.4 -16,-0.2 1,-0.2 23,-0.2 0.935 118.1 52.9 -52.7 -43.4 -5.8 -2.8 15.9 82 82 A G T 3 S+ 0 0 0 -18,-2.5 -35,-1.8 -35,-0.2 2,-1.5 0.565 77.6 113.5 -73.6 -9.7 -9.0 -3.0 17.9 83 83 A D E < +F 46 0A 0 -3,-0.9 -37,-0.2 -19,-0.3 3,-0.1 -0.414 27.5 157.8 -67.2 85.8 -11.2 -4.3 15.0 84 84 A L E - 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