==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 06-APR-00 1EQW . COMPND 2 MOLECULE: CU,ZN SUPEROXIDE DISMUTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA TYPHIMURIUM; . AUTHOR A.PESCE,A.BATTISTONI,M.E.STROPPOLO,F.POLIZIO,M.NARDINI, . 619 4 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25662.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 385 62.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 208 33.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 1.9 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 . 0 0.0 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 . 62 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 66 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 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 PARALLEL BRIDGES PER LADDER . 12 6 10 4 3 1 3 5 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 . 8 0 0 0 0 0 0 0 4 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 2 A N 0 0 144 0, 0.0 25,-1.4 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 -6.3 13.7 -11.3 18.7 2 3 A T E -A 25 0A 81 23,-0.2 2,-0.3 2,-0.0 23,-0.2 -0.805 360.0-170.5-119.6 160.1 16.4 -11.4 16.0 3 4 A L E -A 24 0A 20 21,-1.7 21,-3.6 -2,-0.3 2,-0.4 -0.987 10.5-151.6-147.2 132.5 16.4 -11.4 12.2 4 5 A T E -A 23 0A 77 -2,-0.3 2,-0.4 19,-0.2 19,-0.2 -0.920 9.1-171.9-113.5 138.3 19.4 -12.0 9.9 5 6 A V E -A 22 0A 5 17,-2.3 17,-2.4 -2,-0.4 2,-0.3 -0.975 15.6-143.1-130.8 117.6 19.7 -10.6 6.4 6 7 A K E -A 21 0A 146 -2,-0.4 2,-0.4 15,-0.2 15,-0.2 -0.644 18.1-148.2 -80.5 134.8 22.5 -11.5 4.1 7 8 A M E - 0 0 0 13,-2.3 12,-2.4 -2,-0.3 13,-0.4 -0.869 13.8-172.3-108.8 136.9 23.8 -8.7 1.9 8 9 A N E -AB 18 151A 48 143,-2.1 143,-2.3 -2,-0.4 10,-0.2 -0.977 32.0-103.3-129.8 140.3 25.2 -9.0 -1.6 9 9AA D E - B 0 150A 34 8,-3.3 7,-3.6 -2,-0.4 2,-0.5 -0.330 38.4-131.9 -58.6 138.2 26.9 -6.6 -4.0 10 9BA A E +A 15 0A 15 139,-3.3 2,-0.2 5,-0.2 5,-0.2 -0.846 29.4 178.8 -98.7 124.7 24.4 -5.4 -6.6 11 9CA L - 0 0 82 3,-2.3 56,-0.5 -2,-0.5 3,-0.1 -0.724 40.3-115.3-117.6 169.0 25.7 -5.5 -10.2 12 9DA S S S+ 0 0 62 -2,-0.2 53,-0.1 1,-0.2 3,-0.1 0.817 117.4 48.1 -74.9 -28.0 24.0 -4.7 -13.5 13 9EA S S S- 0 0 112 1,-0.2 2,-0.3 51,-0.1 -1,-0.2 0.629 127.4 -79.8 -85.1 -14.1 24.2 -8.3 -14.7 14 10 A G S S- 0 0 11 -3,-0.1 -3,-2.3 41,-0.1 2,-0.3 -0.993 79.4 -4.0 152.5-156.9 22.8 -9.6 -11.4 15 11 A T E -A 10 0A 82 -2,-0.3 -5,-0.2 -5,-0.2 -6,-0.1 -0.549 61.1-165.8 -76.2 132.3 23.7 -10.5 -7.8 16 12 A G E - 0 0 20 -7,-3.6 -1,-0.1 -2,-0.3 -6,-0.1 -0.023 35.5 -30.1-100.7-156.8 27.3 -10.1 -6.8 17 13 A E E - 0 0 145 -9,-0.2 -8,-3.3 1,-0.1 2,-0.3 -0.149 61.0-110.1 -61.6 150.4 29.6 -11.1 -3.9 18 14 A N E -A 8 0A 70 -10,-0.2 -10,-0.2 1,-0.1 -1,-0.1 -0.649 28.5-174.9 -79.1 136.6 28.4 -11.6 -0.4 19 15 A I E - 0 0 4 -12,-2.4 19,-1.6 1,-0.4 2,-0.3 0.089 50.5 -84.4-120.8 21.2 29.7 -8.9 2.0 20 16 A G E - C 0 37A 13 -13,-0.4 -13,-2.3 17,-0.2 -1,-0.4 -0.773 50.8 -75.4 115.8-160.9 28.4 -10.2 5.3 21 17 A E E -AC 6 36A 69 15,-1.3 15,-1.9 -2,-0.3 2,-0.5 -0.969 19.5-137.8-144.9 158.9 25.1 -9.9 7.1 22 18 A I E -AC 5 35A 0 -17,-2.4 -17,-2.3 -2,-0.3 2,-0.6 -0.972 16.4-150.6-118.8 130.2 23.0 -7.6 9.2 23 19 A T E -AC 4 34A 29 11,-3.0 11,-3.1 -2,-0.5 2,-0.5 -0.901 9.6-158.1-104.3 124.8 21.3 -8.8 12.3 24 20 A V E +AC 3 33A 0 -21,-3.6 -21,-1.7 -2,-0.6 2,-0.3 -0.868 14.9 176.4-103.7 132.0 18.1 -6.9 13.3 25 21 A S E -AC 2 32A 24 7,-2.3 7,-3.3 -2,-0.5 2,-0.4 -0.957 28.8-117.4-134.1 153.7 16.8 -7.0 16.9 26 22 A E E + C 0 31A 80 -25,-1.4 5,-0.2 -2,-0.3 90,-0.1 -0.721 33.7 178.5 -91.0 138.1 13.9 -5.5 18.8 27 23 A T E > - C 0 30A 34 3,-1.4 3,-1.7 -2,-0.4 372,-0.0 -0.839 48.5 -97.5-130.3 168.7 14.7 -3.1 21.6 28 24 A P T 3 S+ 0 0 117 0, 0.0 3,-0.1 0, 0.0 372,-0.0 0.630 127.4 44.1 -62.3 -8.2 12.5 -1.0 24.0 29 25 A Y T 3 S- 0 0 36 1,-0.4 2,-0.2 370,-0.1 86,-0.1 0.337 123.4 -80.0-118.2 4.1 13.2 1.8 21.5 30 26 A G E < S-C 27 0A 2 -3,-1.7 -3,-1.4 86,-0.2 -1,-0.4 -0.774 73.4 -18.8 128.9-175.1 12.7 0.2 18.1 31 27 A L E -CD 26 112A 0 84,-2.0 81,-2.8 81,-1.1 2,-0.5 -0.510 53.3-153.9 -72.1 132.3 14.5 -2.0 15.6 32 28 A L E -CD 25 111A 26 -7,-3.3 -7,-2.3 -2,-0.2 2,-0.8 -0.943 0.9-157.0-110.5 122.1 18.3 -2.2 16.0 33 29 A F E -CD 24 110A 0 77,-3.5 77,-2.4 -2,-0.5 -9,-0.2 -0.868 9.9-174.1-102.5 105.6 20.3 -3.0 12.9 34 30 A T E -C 23 0A 35 -11,-3.1 -11,-3.0 -2,-0.8 2,-0.1 -0.864 13.7-154.1-102.1 106.1 23.7 -4.5 13.8 35 31 A P E -C 22 0A 1 0, 0.0 -13,-0.2 0, 0.0 -15,-0.0 -0.473 22.8-175.5 -82.6 151.9 25.9 -4.9 10.7 36 32 A H E +C 21 0A 89 -15,-1.9 -15,-1.3 -2,-0.1 2,-0.2 -0.560 41.7 140.2-138.4 62.8 28.7 -7.4 10.2 37 33 A L E -CE 20 106A 3 69,-1.9 69,-2.0 -17,-0.2 2,-0.3 -0.633 29.4-177.7-114.2 168.9 29.8 -6.3 6.8 38 34 A N + 0 0 83 -19,-1.6 67,-0.2 67,-0.3 66,-0.1 -0.863 56.7 56.0-148.4 175.7 33.0 -5.8 4.8 39 35 A G S S+ 0 0 45 64,-0.3 2,-0.3 -2,-0.3 66,-0.1 0.849 72.8 126.6 60.0 41.3 34.0 -4.5 1.4 40 36 A L - 0 0 11 64,-1.4 -1,-0.2 -3,-0.1 3,-0.1 -0.793 67.9 -97.5-119.0 164.1 32.3 -1.0 1.5 41 37 A T - 0 0 84 -2,-0.3 59,-0.1 1,-0.1 62,-0.1 -0.720 51.3 -99.7 -84.3 130.3 33.9 2.4 0.9 42 38 A P S S+ 0 0 63 0, 0.0 2,-0.3 0, 0.0 59,-0.2 -0.049 86.3 42.0 -45.0 145.1 34.8 4.1 4.2 43 39 A G E S-J 100 0B 26 57,-2.7 57,-2.9 58,-0.2 2,-0.5 -0.776 98.8 -28.4 119.0-162.1 32.3 6.7 5.3 44 40 A I E -J 99 0B 38 -2,-0.3 2,-0.4 55,-0.2 55,-0.2 -0.850 52.4-165.8-104.2 127.8 28.5 7.0 5.6 45 41 A H E -J 98 0B 4 53,-2.5 53,-2.9 -2,-0.5 87,-0.3 -0.889 30.3-104.6-114.4 141.9 26.2 5.2 3.2 46 42 A G - 0 0 0 85,-2.8 83,-2.4 -2,-0.4 2,-0.4 -0.369 41.4-171.5 -57.1 134.3 22.5 5.6 2.5 47 43 A F E +F 128 0A 1 48,-0.4 48,-1.2 81,-0.2 2,-0.3 -0.908 15.3 151.1-138.1 108.6 20.7 2.8 4.2 48 44 A H E -FG 127 94A 0 79,-1.5 79,-3.0 -2,-0.4 2,-0.5 -0.935 45.6-113.9-139.7 159.4 17.0 2.2 3.6 49 45 A V E -F 126 0A 0 44,-2.6 25,-2.9 -2,-0.3 2,-0.3 -0.809 37.1-152.2 -87.8 125.3 14.3 -0.5 3.5 50 46 A H E -FH 125 73A 0 75,-3.0 75,-1.9 -2,-0.5 23,-0.2 -0.749 15.4-122.3-103.5 154.2 12.9 -0.8 -0.0 51 47 A T S S+ 0 0 54 21,-2.6 20,-0.2 -2,-0.3 -1,-0.1 0.930 83.9 65.7 -57.1 -60.6 9.4 -2.0 -1.0 52 48 A N S S- 0 0 71 18,-2.3 2,-2.2 20,-0.2 -2,-0.1 -0.445 78.0-126.8 -78.3 141.7 9.9 -5.0 -3.3 53 49 A P S S+ 0 0 69 0, 0.0 2,-0.3 0, 0.0 100,-0.1 -0.344 80.8 94.7 -78.1 54.9 11.4 -8.4 -2.1 54 50 A S - 0 0 30 -2,-2.2 98,-0.1 98,-0.1 -2,-0.1 -0.995 47.6-177.1-152.2 143.5 13.9 -8.3 -4.9 55 51 A a + 0 0 20 -2,-0.3 12,-0.5 14,-0.1 13,-0.1 0.219 47.8 132.4-118.7 8.3 17.5 -7.2 -5.5 56 52 A M - 0 0 102 11,-0.2 13,-2.3 10,-0.1 14,-0.3 -0.278 61.9-105.1 -64.4 147.0 17.5 -8.0 -9.2 57 53 A P - 0 0 26 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.383 39.1-174.2 -72.2 149.6 18.8 -5.4 -11.7 58 53AA G E -K 65 0C 8 7,-2.4 7,-1.6 -2,-0.1 2,-0.3 -0.449 18.9-114.4-125.0-160.2 16.4 -3.4 -13.8 59 53BA M E +K 64 0C 108 5,-0.3 2,-0.4 -2,-0.2 5,-0.2 -0.976 24.5 176.2-149.7 132.5 16.7 -0.9 -16.7 60 53CA K E > -K 63 0C 47 3,-1.7 3,-0.5 -2,-0.3 -2,-0.0 -0.938 66.9 -21.5-143.1 116.7 15.9 2.7 -17.0 61 53DA D T 3 S- 0 0 166 -2,-0.4 -1,-0.1 1,-0.2 3,-0.1 0.927 130.1 -29.4 53.7 58.7 16.5 5.0 -19.9 62 53EA G T 3 S+ 0 0 71 1,-0.2 2,-0.3 -3,-0.0 -1,-0.2 0.327 119.8 79.8 94.6 -8.6 19.3 3.2 -21.8 63 53FA K E < S-K 60 0C 154 -3,-0.5 -3,-1.7 2,-0.0 2,-0.7 -0.922 74.3-116.4-136.9 160.9 21.1 1.4 -18.9 64 53GA E E -K 59 0C 82 -2,-0.3 -5,-0.3 -5,-0.2 -52,-0.1 -0.831 34.8-158.5 -91.0 117.3 21.0 -1.6 -16.6 65 53HA V E > -K 58 0C 47 -7,-1.6 -7,-2.4 -2,-0.7 3,-1.7 -0.886 19.8-115.3-106.8 116.2 20.6 -0.3 -13.1 66 54 A P T 3 S- 0 0 32 0, 0.0 82,-0.3 0, 0.0 -54,-0.2 -0.128 91.9 -4.3 -49.3 131.2 21.7 -2.5 -10.1 67 55 A A T > S+ 0 0 0 -12,-0.5 3,-1.6 -56,-0.5 4,-0.2 0.706 83.3 143.9 56.7 25.9 18.9 -3.7 -7.8 68 56 A L G X + 0 0 50 -3,-1.7 3,-2.0 1,-0.3 -1,-0.1 0.856 61.6 66.7 -61.5 -34.9 16.3 -1.6 -9.6 69 57 A M G 3 S+ 0 0 100 -13,-2.3 -1,-0.3 1,-0.3 -14,-0.1 0.541 79.3 80.6 -65.4 -6.2 13.7 -4.3 -9.1 70 58 A A G < S- 0 0 0 -3,-1.6 -18,-2.3 -14,-0.3 -1,-0.3 0.712 92.5-148.8 -71.8 -18.3 13.8 -3.6 -5.3 71 59 A G < - 0 0 18 -3,-2.0 -1,-0.2 -4,-0.2 3,-0.1 -0.425 30.9 -38.9 82.7-161.8 11.5 -0.7 -6.1 72 60 A G S S- 0 0 40 1,-0.2 -21,-2.6 -2,-0.1 -20,-0.2 -0.166 80.5 -58.1 -91.6-173.2 11.6 2.6 -4.1 73 61 A H B -H 50 0A 16 -23,-0.2 -23,-0.3 1,-0.1 2,-0.2 -0.461 66.6 -94.4 -68.0 135.8 11.9 3.4 -0.4 74 62 A L + 0 0 16 -25,-2.9 19,-2.6 51,-0.2 20,-0.3 -0.312 58.9 161.6 -52.9 111.3 9.3 1.7 1.8 75 63 A D > + 0 0 20 -2,-0.2 3,-1.6 16,-0.2 -1,-0.1 -0.627 13.8 173.8-139.8 79.2 6.6 4.4 2.1 76 64 A P T 3 S+ 0 0 61 0, 0.0 -1,-0.1 0, 0.0 15,-0.1 0.891 82.5 46.3 -50.8 -50.1 3.2 3.1 3.2 77 65 A E T 3 S- 0 0 161 13,-0.2 14,-0.0 1,-0.1 -2,-0.0 0.072 107.2-123.2 -87.4 27.4 1.5 6.5 3.6 78 66 A K < + 0 0 179 -3,-1.6 13,-0.1 1,-0.1 -1,-0.1 0.789 53.4 157.6 33.5 50.4 2.8 7.7 0.2 79 67 A T - 0 0 49 2,-0.1 -1,-0.1 11,-0.1 3,-0.1 0.939 35.1-152.2 -63.8 -46.9 4.5 10.8 1.7 80 68 A G + 0 0 57 1,-0.2 2,-0.4 -5,-0.0 -1,-0.1 0.657 57.7 112.9 80.6 16.2 6.8 11.0 -1.2 81 68AA K - 0 0 125 8,-0.1 10,-1.6 61,-0.0 2,-1.0 -0.982 60.0-149.0-129.8 128.0 9.4 12.7 1.1 82 69 A H + 0 0 0 -2,-0.4 61,-0.2 8,-0.2 8,-0.1 -0.769 35.8 150.8 -92.4 97.5 12.7 11.3 2.3 83 70 A L - 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