==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 24-OCT-06 2NNX . COMPND 2 MOLECULE: SUPEROXIDE DISMUTASE [CU-ZN]; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.P.SCHUERMANN,P.J.HART . 612 4 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26703.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 393 64.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 204 33.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 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 . 4 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 . 55 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 55 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 9 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.5 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 . 10 4 0 4 8 1 10 1 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 1 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 0 117 0, 0.0 2,-0.3 0, 0.0 22,-0.2 0.000 360.0 360.0 360.0 131.2 -20.5 -14.0 19.3 2 2 A T E -A 22 0A 44 20,-2.2 20,-2.3 22,-0.1 2,-0.3 -0.940 360.0-161.5-138.2 150.7 -18.5 -11.2 17.6 3 3 A K E -A 21 0A 82 149,-0.4 149,-1.9 -2,-0.3 2,-0.3 -0.966 8.8-178.6-130.4 151.8 -15.0 -10.6 16.3 4 4 A A E -AB 20 151A 1 16,-2.0 16,-2.6 -2,-0.3 2,-0.3 -0.938 6.9-160.2-140.8 162.8 -13.1 -7.4 15.5 5 5 A V E -AB 19 150A 3 145,-2.0 145,-2.9 -2,-0.3 2,-0.3 -0.977 0.5-162.7-143.5 152.1 -9.7 -6.6 14.1 6 6 A C E -A 18 0A 2 12,-2.1 12,-2.9 -2,-0.3 2,-0.6 -0.984 8.5-156.0-142.1 130.8 -7.4 -3.5 14.1 7 7 A V E -A 17 0A 34 141,-0.4 2,-0.5 -2,-0.3 10,-0.2 -0.940 17.8-153.8-104.0 113.2 -4.4 -2.6 12.0 8 8 A L E +A 16 0A 0 8,-2.2 8,-1.8 -2,-0.6 2,-0.3 -0.791 24.0 161.3 -90.9 126.3 -2.2 -0.1 13.8 9 9 A K B +E 146 0B 127 137,-2.0 137,-2.2 -2,-0.5 2,-0.2 -0.972 6.4 167.7-141.8 153.9 -0.1 2.2 11.7 10 10 A G - 0 0 34 4,-0.5 135,-0.2 2,-0.3 134,-0.1 -0.613 52.4 -82.0-142.8-159.0 1.7 5.5 12.2 11 11 A D S S+ 0 0 179 133,-0.4 134,-0.1 -2,-0.2 133,-0.1 0.481 109.3 40.8 -92.5 -10.3 4.3 7.8 10.8 12 12 A G S S- 0 0 53 132,-0.5 -2,-0.3 2,-0.2 132,-0.0 -0.104 112.2 -61.2-116.1-145.2 7.2 5.8 12.1 13 13 A P S S+ 0 0 99 0, 0.0 2,-0.4 0, 0.0 25,-0.1 0.601 89.1 112.9 -81.9 -12.5 8.2 2.1 12.6 14 14 A V + 0 0 5 23,-0.2 -4,-0.5 130,-0.2 2,-0.3 -0.473 37.5 152.3 -77.5 120.3 5.3 1.1 14.9 15 15 A Q E + C 0 36A 100 21,-2.2 21,-3.7 -2,-0.4 2,-0.3 -0.982 8.6 149.2-145.1 146.9 3.0 -1.4 13.2 16 16 A G E -AC 8 35A 11 -8,-1.8 -8,-2.2 -2,-0.3 2,-0.4 -0.991 35.8-128.1-172.6 167.1 0.7 -4.1 14.4 17 17 A I E -AC 7 34A 68 17,-2.4 17,-1.8 -2,-0.3 2,-0.4 -0.995 23.2-170.9-129.7 123.1 -2.4 -6.3 14.2 18 18 A I E -AC 6 33A 0 -12,-2.9 -12,-2.1 -2,-0.4 2,-0.4 -0.973 4.7-159.8-121.5 126.4 -4.8 -6.7 17.1 19 19 A N E -AC 5 32A 46 13,-3.9 13,-2.5 -2,-0.4 2,-0.4 -0.838 1.8-162.2-104.0 140.7 -7.7 -9.2 17.3 20 20 A F E -AC 4 31A 1 -16,-2.6 -16,-2.0 -2,-0.4 2,-0.4 -0.964 8.2-178.6-120.0 138.5 -10.8 -8.9 19.5 21 21 A E E -AC 3 30A 82 9,-2.0 9,-3.3 -2,-0.4 2,-0.4 -0.993 7.6-178.1-139.6 133.7 -13.1 -11.8 20.3 22 22 A Q E -AC 2 29A 2 -20,-2.3 -20,-2.2 -2,-0.4 7,-0.1 -0.986 8.8-168.0-130.8 119.9 -16.2 -11.9 22.5 23 23 A K S S+ 0 0 192 5,-0.6 2,-0.3 -2,-0.4 -1,-0.1 0.785 75.7 20.7 -77.9 -27.6 -18.1 -15.1 22.9 24 24 A E S > S- 0 0 105 4,-0.3 3,-1.9 -23,-0.1 -1,-0.2 -0.988 85.5-104.6-148.8 147.3 -21.2 -13.7 24.5 25 25 A S T 3 S+ 0 0 72 -2,-0.3 82,-0.2 1,-0.3 81,-0.1 0.703 120.6 25.0 -51.3 -31.0 -22.9 -10.2 24.6 26 26 A N T 3 S+ 0 0 146 79,-0.1 -1,-0.3 80,-0.1 3,-0.1 0.446 102.8 113.1-109.0 3.1 -21.8 -9.3 28.1 27 27 A G S < S- 0 0 11 -3,-1.9 0, 0.0 1,-0.2 0, 0.0 0.010 76.7 -76.1 -72.7 171.7 -18.8 -11.6 28.3 28 28 A P - 0 0 61 0, 0.0 -5,-0.6 0, 0.0 2,-0.5 -0.297 44.5-128.2 -59.1 151.5 -15.1 -10.8 28.6 29 29 A V E -CD 22 101A 0 72,-3.4 72,-2.4 -7,-0.1 2,-0.5 -0.933 12.9-141.7-106.4 129.7 -13.3 -9.6 25.4 30 30 A K E -CD 21 100A 99 -9,-3.3 -9,-2.0 -2,-0.5 2,-0.5 -0.813 16.7-168.7 -91.5 123.6 -10.1 -11.4 24.3 31 31 A V E +CD 20 99A 0 68,-2.8 68,-3.2 -2,-0.5 2,-0.3 -0.975 20.5 150.9-114.8 119.3 -7.5 -8.9 22.9 32 32 A W E +CD 19 98A 85 -13,-2.5 -13,-3.9 -2,-0.5 2,-0.3 -0.996 10.2 93.3-150.5 153.9 -4.5 -10.5 21.2 33 33 A G E -CD 18 97A 16 64,-1.8 64,-2.1 -2,-0.3 2,-0.3 -0.983 58.3 -80.0 161.8-155.5 -2.0 -9.8 18.4 34 34 A S E -CD 17 96A 42 -17,-1.8 -17,-2.4 -2,-0.3 2,-0.4 -0.996 22.5-167.0-145.4 142.0 1.4 -8.3 17.9 35 35 A I E -CD 16 95A 0 60,-1.8 60,-3.2 -2,-0.3 -19,-0.3 -0.995 16.9-176.1-125.0 132.0 2.9 -4.8 17.6 36 36 A K E +C 15 0A 124 -21,-3.7 -21,-2.2 -2,-0.4 58,-0.2 -0.788 53.5 58.2-122.1 174.6 6.4 -4.2 16.3 37 37 A G S S+ 0 0 33 55,-0.4 2,-0.2 1,-0.3 -23,-0.2 0.629 77.3 139.8 82.8 17.9 8.8 -1.3 15.8 38 38 A L - 0 0 10 55,-1.8 2,-0.3 -3,-0.2 -1,-0.3 -0.603 59.2-113.1 -95.1 149.2 8.6 -0.5 19.5 39 39 A T - 0 0 100 -2,-0.2 50,-0.3 82,-0.2 53,-0.1 -0.640 54.6 -89.0 -73.2 137.1 11.3 0.7 22.0 40 40 A E S S+ 0 0 123 -2,-0.3 2,-0.3 51,-0.2 50,-0.2 -0.203 91.9 36.6 -49.1 133.5 11.9 -2.1 24.6 41 41 A G E S-F 89 0B 26 48,-2.5 48,-3.3 -3,-0.1 2,-0.3 -0.777 97.2 -14.9 122.2-163.8 9.6 -1.7 27.6 42 42 A L E -F 88 0B 87 -2,-0.3 2,-0.4 46,-0.2 46,-0.2 -0.581 50.5-174.1 -85.5 136.8 6.0 -0.6 28.5 43 43 A H E -F 87 0B 2 44,-2.8 44,-2.6 -2,-0.3 80,-0.3 -0.996 30.7-108.4-133.7 129.1 3.8 1.3 26.1 44 44 A G E -F 86 0B 0 78,-2.8 76,-2.8 -2,-0.4 2,-0.4 -0.246 35.1-172.0 -54.4 136.1 0.4 2.8 26.8 45 45 A F E + G 0 119B 0 40,-2.5 39,-1.0 74,-0.2 2,-0.3 -0.984 20.4 134.9-142.5 112.7 -2.4 0.9 25.0 46 46 A R E -FG 83 118B 0 72,-1.8 72,-2.7 -2,-0.4 2,-0.5 -0.956 50.4-103.6-154.4 169.4 -6.0 2.2 25.0 47 47 A V E - G 0 117B 0 35,-1.9 17,-3.0 -2,-0.3 2,-0.3 -0.917 30.2-150.1-102.8 123.4 -9.2 2.9 23.0 48 48 A Q E -HG 63 116B 0 68,-3.4 68,-1.8 -2,-0.5 15,-0.3 -0.671 24.7-114.1 -87.2 150.8 -9.9 6.5 22.0 49 49 A E S S+ 0 0 12 13,-3.0 2,-0.3 -2,-0.3 12,-0.2 0.822 90.6 52.9 -56.9 -44.2 -13.5 7.6 21.6 50 50 A F - 0 0 1 10,-2.8 2,-0.6 12,-0.2 66,-0.3 -0.734 66.8-140.9-102.4 145.5 -13.7 8.3 17.9 51 51 A G + 0 0 2 254,-2.2 2,-0.6 63,-0.4 253,-0.3 -0.333 65.2 129.8 -88.1 50.8 -12.8 6.2 14.9 52 52 A D + 0 0 11 -2,-0.6 -2,-0.1 5,-0.1 3,-0.1 -0.928 20.9 155.5-118.1 110.0 -11.5 9.4 13.4 53 53 A N > + 0 0 35 -2,-0.6 3,-1.4 6,-0.2 4,-0.1 -0.058 34.1 121.9-122.1 27.7 -7.9 9.4 11.9 54 54 A T T 3 S+ 0 0 49 1,-0.3 3,-0.1 3,-0.1 -1,-0.1 0.828 89.5 26.6 -64.2 -36.4 -8.4 12.3 9.5 55 55 A A T > S- 0 0 50 1,-0.6 3,-0.5 -3,-0.1 -1,-0.3 -0.185 128.7 -93.4-115.0 37.2 -5.6 14.3 11.1 56 56 A G G X S- 0 0 34 -3,-1.4 3,-1.1 1,-0.2 -1,-0.6 -0.408 79.2 -27.1 80.2-159.6 -3.7 11.2 12.3 57 57 A a G > S+ 0 0 21 1,-0.2 3,-1.2 2,-0.2 4,-0.2 0.715 126.4 71.0 -67.0 -20.0 -4.2 9.8 15.8 58 58 A T G X S+ 0 0 21 -3,-0.5 3,-2.0 1,-0.2 -1,-0.2 0.856 86.2 65.2 -58.9 -42.7 -5.2 13.1 17.4 59 59 A S G < S+ 0 0 7 -3,-1.1 -1,-0.2 1,-0.3 -6,-0.2 0.656 85.2 75.0 -58.0 -20.0 -8.5 13.2 15.7 60 60 A A G < S- 0 0 0 -3,-1.2 -10,-2.8 -4,-0.3 -1,-0.3 0.660 89.7-161.1 -70.7 -15.9 -9.5 10.1 17.7 61 61 A G < - 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