==== 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 26-OCT-00 1E9Q . COMPND 2 MOLECULE: SUPEROXIDE DISMUTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR M.A.HOUGH,S.S.HASNAIN . 302 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13841.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 200 66.2 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 35.1 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 . 2 0.7 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 . 25 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 8 2.6 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 . 6 2 0 2 4 2 2 0 2 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 0 0 0 0 0 0 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 59 0, 0.0 103,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 158.3 -5.4 30.1 58.2 2 2 A T + 0 0 97 1,-0.2 20,-2.5 148,-0.2 2,-0.3 0.509 360.0 34.2-110.0 -17.6 -8.0 28.8 60.5 3 3 A S E +A 21 0A 38 147,-0.3 147,-2.1 18,-0.2 2,-0.3 -0.996 62.0 172.1-143.9 142.7 -6.4 25.4 61.2 4 4 A A E -AB 20 149A 1 16,-2.1 16,-2.5 -2,-0.3 2,-0.3 -0.912 10.6-158.6-144.2 169.6 -2.8 24.2 61.4 5 5 A V E -AB 19 148A 0 143,-2.5 143,-3.1 -2,-0.3 2,-0.3 -0.994 2.3-165.8-148.3 158.5 -0.9 21.0 62.4 6 6 A C E -A 18 0A 2 12,-2.3 12,-2.8 -2,-0.3 2,-0.5 -0.984 10.4-151.5-151.1 131.1 2.6 20.1 63.6 7 7 A V E -A 17 0A 43 139,-0.4 2,-0.5 -2,-0.3 10,-0.2 -0.949 19.6-145.1-104.6 123.5 4.2 16.6 63.7 8 8 A L E +A 16 0A 0 8,-2.8 8,-1.7 -2,-0.5 2,-0.3 -0.787 28.8 159.3 -93.2 126.0 6.8 16.4 66.5 9 9 A S B +C 144 0A 67 135,-2.2 135,-2.4 -2,-0.5 2,-0.2 -0.980 4.0 157.7-139.7 158.2 9.9 14.3 65.9 10 10 A G - 0 0 35 4,-0.5 133,-0.1 2,-0.4 132,-0.1 -0.725 55.5 -77.8-155.5-159.1 13.4 14.2 67.4 11 11 A D S S+ 0 0 169 131,-0.3 132,-0.1 -2,-0.2 131,-0.1 0.572 109.2 53.5 -91.1 -12.9 16.4 11.9 67.8 12 12 A G S S- 0 0 49 130,-0.6 -2,-0.4 2,-0.1 23,-0.0 -0.194 109.0 -79.8-103.0-159.9 14.9 9.9 70.7 13 13 A P S S+ 0 0 99 0, 0.0 2,-0.3 0, 0.0 23,-0.1 0.390 87.3 116.4 -85.9 0.4 11.6 8.1 70.9 14 14 A V + 0 0 11 128,-0.3 -4,-0.5 21,-0.1 2,-0.3 -0.571 34.9 150.3 -76.8 132.7 9.4 11.1 71.5 15 15 A Q E + D 0 34A 116 19,-1.8 19,-2.9 -2,-0.3 2,-0.3 -0.968 9.1 154.0-150.0 167.7 6.8 11.9 68.9 16 16 A G E -AD 8 33A 11 -8,-1.7 -8,-2.8 -2,-0.3 2,-0.4 -0.975 34.3-120.6 178.9 169.4 3.4 13.5 68.6 17 17 A T E -AD 7 32A 45 15,-1.8 15,-1.6 -2,-0.3 2,-0.4 -0.999 24.5-169.2-131.2 127.1 0.8 15.3 66.5 18 18 A I E -AD 6 31A 0 -12,-2.8 -12,-2.3 -2,-0.4 2,-0.3 -0.943 3.5-161.1-119.0 135.3 -0.5 18.7 67.6 19 19 A H E -AD 5 30A 86 11,-3.4 11,-2.4 -2,-0.4 2,-0.4 -0.882 1.9-161.5-117.0 149.1 -3.5 20.4 66.0 20 20 A F E -AD 4 29A 3 -16,-2.5 -16,-2.1 -2,-0.3 2,-0.4 -0.984 8.2-179.1-131.5 136.7 -4.4 24.1 66.2 21 21 A E E -AD 3 28A 101 7,-1.9 7,-3.1 -2,-0.4 2,-0.3 -0.979 25.4-129.3-141.1 129.1 -7.7 25.7 65.5 22 22 A A E + D 0 27A 35 -20,-2.5 2,-0.3 -2,-0.4 5,-0.2 -0.582 31.5 171.9 -72.6 130.4 -8.8 29.4 65.6 23 23 A K E > - D 0 26A 121 3,-2.5 3,-2.1 -2,-0.3 2,-0.1 -0.904 60.8 -45.6-141.8 111.4 -11.9 29.9 67.7 24 24 A G T 3 S- 0 0 89 -2,-0.3 -1,-0.0 1,-0.3 -2,-0.0 -0.432 121.2 -27.3 65.3-134.5 -13.0 33.4 68.4 25 25 A D T 3 S+ 0 0 141 -2,-0.1 -1,-0.3 -3,-0.1 2,-0.2 0.086 128.1 78.0-102.9 26.7 -9.9 35.4 69.5 26 26 A T E < S-D 23 0A 32 -3,-2.1 -3,-2.5 75,-0.0 2,-0.4 -0.761 71.2-131.8-123.4 169.5 -8.2 32.3 70.8 27 27 A V E -DE 22 99A 3 72,-2.3 72,-2.4 -2,-0.2 2,-0.5 -0.995 17.5-148.1-118.1 134.7 -6.3 29.3 69.4 28 28 A V E -DE 21 98A 21 -7,-3.1 -7,-1.9 -2,-0.4 2,-0.5 -0.897 12.5-161.5-102.1 127.5 -7.3 25.8 70.7 29 29 A V E +DE 20 97A 0 68,-3.3 68,-2.6 -2,-0.5 2,-0.3 -0.946 18.9 162.6-113.3 119.7 -4.3 23.4 70.7 30 30 A T E +DE 19 96A 55 -11,-2.4 -11,-3.4 -2,-0.5 2,-0.3 -0.843 16.5 90.1-132.3 166.6 -5.1 19.7 70.9 31 31 A G E -DE 18 95A 21 64,-1.2 64,-3.1 -2,-0.3 2,-0.3 -0.930 56.2 -92.9 144.7-167.5 -3.2 16.4 70.2 32 32 A S E -DE 17 94A 48 -15,-1.6 -15,-1.8 -2,-0.3 2,-0.4 -0.990 16.5-156.6-149.6 153.9 -1.0 13.9 72.0 33 33 A I E -DE 16 93A 0 60,-2.0 60,-2.9 -2,-0.3 2,-0.3 -0.996 16.4-166.2-133.4 130.7 2.7 13.2 72.5 34 34 A T E +D 15 0A 53 -19,-2.9 -19,-1.8 -2,-0.4 58,-0.2 -0.813 58.5 44.9-119.5 168.0 4.1 9.8 73.3 35 35 A G S S+ 0 0 38 55,-0.3 2,-0.2 56,-0.3 57,-0.2 0.614 77.2 136.8 80.6 13.9 7.4 8.4 74.6 36 36 A L - 0 0 9 55,-2.0 -1,-0.3 -3,-0.2 2,-0.2 -0.510 60.7-106.8 -89.1 162.2 7.8 11.0 77.4 37 37 A T - 0 0 101 -2,-0.2 50,-0.3 82,-0.2 53,-0.1 -0.603 52.7 -91.6 -82.7 143.8 8.9 10.3 81.0 38 38 A E S S+ 0 0 139 -2,-0.2 2,-0.2 51,-0.2 50,-0.2 -0.284 92.0 47.0 -57.7 147.9 5.9 10.6 83.3 39 39 A G E S-F 87 0A 31 48,-2.1 48,-3.0 -3,-0.1 2,-0.2 -0.689 97.1 -27.8 119.7-169.8 5.5 14.2 84.7 40 40 A D E -F 86 0A 67 46,-0.2 2,-0.4 -2,-0.2 46,-0.2 -0.532 47.7-171.4 -86.1 148.2 5.5 17.7 83.3 41 41 A H E -F 85 0A 2 44,-2.3 44,-2.3 -2,-0.2 78,-0.1 -0.993 29.1-111.8-140.9 129.4 7.3 18.8 80.2 42 42 A G E -F 84 0A 0 78,-2.4 76,-2.9 -2,-0.4 2,-0.4 -0.304 31.7-166.2 -62.8 148.7 7.8 22.4 78.9 43 43 A F E + G 0 117A 0 40,-2.3 39,-1.1 74,-0.2 2,-0.3 -0.950 18.1 156.7-144.4 105.5 5.9 23.1 75.7 44 44 A H E -FG 81 116A 0 72,-1.9 72,-2.5 -2,-0.4 2,-0.6 -0.961 44.3-119.4-135.6 159.3 6.6 26.2 73.7 45 45 A V E - G 0 115A 0 35,-2.3 17,-2.5 -2,-0.3 70,-0.2 -0.866 36.8-154.5 -91.8 121.7 6.5 27.9 70.3 46 46 A H E -HG 61 114A 2 68,-3.5 68,-1.8 -2,-0.6 15,-0.3 -0.642 20.9-110.7 -96.5 161.9 10.0 28.7 69.3 47 47 A Q S S+ 0 0 62 13,-2.8 2,-0.4 -2,-0.2 12,-0.2 0.813 87.6 50.7 -61.6 -51.4 10.9 31.5 66.8 48 48 A F - 0 0 21 10,-2.9 2,-0.6 12,-0.2 254,-0.2 -0.787 59.4-146.4-105.5 146.5 12.1 29.9 63.7 49 49 A G + 0 0 2 252,-1.9 2,-0.6 63,-0.5 251,-0.3 -0.273 60.6 129.3 -93.8 49.5 10.7 27.1 61.5 50 50 A D + 0 0 27 -2,-0.6 3,-0.3 7,-0.2 -2,-0.1 -0.917 27.8 169.3-114.5 110.9 14.3 26.0 60.7 51 51 A N > + 0 0 51 -2,-0.6 3,-1.2 1,-0.2 -1,-0.1 0.034 43.9 114.6-106.3 22.7 15.0 22.3 61.3 52 52 A T T 3 S+ 0 0 58 1,-0.3 -1,-0.2 5,-0.1 3,-0.1 0.770 89.8 30.4 -65.9 -29.5 18.4 22.3 59.6 53 53 A Q T >> S- 0 0 139 1,-0.6 3,-1.3 -3,-0.3 4,-0.5 -0.482 119.7-105.2-120.5 50.2 20.1 21.5 62.9 54 54 A G G X4 S- 0 0 30 -3,-1.2 -1,-0.6 1,-0.3 3,-0.5 -0.250 82.4 -26.5 62.1-136.8 17.3 19.5 64.4 55 55 A a G >4 S+ 0 0 13 1,-0.2 3,-1.2 86,-0.2 -1,-0.3 0.654 128.1 78.0 -83.3 -16.0 15.5 21.4 67.1 56 56 A T G X4 S+ 0 0 102 -3,-1.3 3,-1.1 1,-0.2 -1,-0.2 0.848 87.7 56.5 -64.2 -31.4 18.5 23.5 68.0 57 57 A S G << S+ 0 0 18 -3,-0.5 -1,-0.2 -4,-0.5 -7,-0.2 0.493 81.6 87.0 -81.7 -1.4 18.0 25.8 64.9 58 58 A A G < S- 0 0 0 -3,-1.2 -10,-2.9 1,-0.2 -1,-0.3 0.630 86.4-152.1 -66.9 -18.4 14.4 26.7 66.0 59 59 A G < - 0 0 19 -3,-1.1 -1,-0.2 -12,-0.2 3,-0.1 -0.292 33.1 -29.9 77.7-166.2 16.0 29.5 68.1 60 60 A P S S- 0 0 73 0, 0.0 -13,-2.8 0, 0.0 -12,-0.2 -0.035 86.7 -57.6 -77.8-175.9 14.5 30.9 71.3 61 61 A H B -H 46 0A 11 -15,-0.3 2,-0.3 73,-0.2 -15,-0.3 -0.421 64.5 -97.1 -64.6 144.2 10.9 31.3 72.4 62 62 A F + 0 0 10 -17,-2.5 18,-2.3 52,-0.2 17,-0.4 -0.449 58.1 162.3 -62.7 118.0 8.8 33.3 70.1 63 63 A N > + 0 0 45 -2,-0.3 3,-1.6 15,-0.2 -1,-0.1 -0.432 14.7 158.3-145.5 72.2 8.8 36.7 71.7 64 64 A P T 3 S+ 0 0 53 0, 0.0 -1,-0.1 0, 0.0 14,-0.1 0.688 80.1 54.8 -70.0 -21.5 7.8 39.6 69.5 65 65 A L T 3 S- 0 0 76 2,-0.0 -2,-0.0 0, 0.0 13,-0.0 0.229 106.2-125.6 -97.3 11.3 6.9 41.8 72.4 66 66 A S < + 0 0 108 -3,-1.6 2,-0.2 1,-0.2 12,-0.1 0.875 56.5 146.7 47.6 55.8 10.3 41.4 74.0 67 67 A K - 0 0 70 10,-0.1 -1,-0.2 1,-0.1 2,-0.1 -0.575 50.4 -97.0-109.4 175.9 9.2 40.2 77.4 68 68 A K - 0 0 127 -2,-0.2 66,-0.2 1,-0.1 -1,-0.1 -0.493 51.6 -85.0 -85.9 168.3 10.6 37.8 80.0 69 69 A H + 0 0 7 64,-2.6 2,-0.2 8,-0.2 -1,-0.1 -0.365 60.3 146.7 -71.6 143.1 9.5 34.1 80.2 70 70 A G - 0 0 1 8,-0.1 13,-0.3 64,-0.1 55,-0.3 -0.843 47.8 -75.0-153.3-168.1 6.4 33.2 82.2 71 71 A G > - 0 0 2 53,-0.6 3,-1.8 -2,-0.2 10,-0.1 -0.551 52.0 -98.9 -93.9 168.1 3.5 30.8 82.3 72 72 A P T 3 S+ 0 0 37 0, 0.0 29,-0.1 0, 0.0 -1,-0.1 0.767 122.7 52.3 -60.9 -26.3 0.5 31.1 79.9 73 73 A K T 3 S+ 0 0 193 3,-0.1 2,-0.2 26,-0.0 4,-0.1 0.511 91.1 102.3 -89.1 -1.2 -1.7 32.8 82.5 74 74 A D < - 0 0 42 -3,-1.8 3,-0.1 1,-0.1 -4,-0.1 -0.459 67.6-143.4 -83.6 148.3 1.0 35.5 83.2 75 75 A E S S+ 0 0 176 1,-0.2 2,-1.0 -2,-0.2 -1,-0.1 0.894 98.4 58.1 -72.1 -38.0 0.9 39.0 81.9 76 76 A E S S+ 0 0 85 -7,-0.1 2,-0.3 -9,-0.1 -1,-0.2 -0.795 83.4 112.0 -97.8 99.4 4.7 38.9 81.5 77 77 A R - 0 0 11 -2,-1.0 2,-0.2 -7,-0.1 -8,-0.2 -0.975 69.0 -96.1-155.4 164.9 5.4 35.9 79.2 78 78 A H > - 0 0 16 -2,-0.3 3,-1.9 -8,-0.2 -15,-0.2 -0.640 36.1-118.9 -78.9 155.6 6.6 35.2 75.7 79 79 A V T 3 S+ 0 0 3 -17,-0.4 23,-0.2 1,-0.3 -16,-0.2 0.913 117.1 55.0 -59.3 -39.7 3.9 34.7 73.1 80 80 A G T 3 S+ 0 0 0 -18,-2.3 -35,-2.3 -35,-0.2 2,-1.1 0.423 78.0 114.6 -73.6 2.2 5.3 31.2 72.7 81 81 A D E < +F 44 0A 0 -3,-1.9 -37,-0.2 -19,-0.2 -1,-0.1 -0.601 25.9 156.8 -81.5 96.5 4.9 30.3 76.4 82 82 A L E - 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