==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 26-FEB-99 1CB4 . COMPND 2 MOLECULE: PROTEIN (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) . 13681.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 196 64.9 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 . 104 34.4 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 . 31 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 7 2.3 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 1 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 . 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 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 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 61 0, 0.0 103,-0.1 0, 0.0 110,-0.1 0.000 360.0 360.0 360.0 133.7 28.3 71.3 21.2 2 2 A T + 0 0 101 148,-0.2 20,-2.4 1,-0.1 2,-0.3 0.526 360.0 48.6-105.8 -9.9 30.3 74.3 19.9 3 3 A K E +A 21 0A 87 147,-0.3 147,-1.6 18,-0.2 2,-0.3 -0.972 60.3 167.9-132.4 148.1 28.6 74.4 16.4 4 4 A A E -AB 20 149A 1 16,-1.9 16,-2.1 -2,-0.3 2,-0.3 -0.957 11.6-162.9-151.7 167.8 25.0 74.4 15.2 5 5 A V E -AB 19 148A 1 143,-1.9 143,-2.6 -2,-0.3 2,-0.3 -0.989 2.3-164.1-154.7 153.3 22.8 75.0 12.2 6 6 A C E -A 18 0A 2 12,-2.0 12,-2.5 -2,-0.3 2,-0.6 -0.983 10.5-151.2-144.3 131.8 19.1 75.6 11.4 7 7 A V E -A 17 0A 35 139,-0.4 2,-0.5 -2,-0.3 10,-0.2 -0.944 20.5-145.9-105.9 120.2 17.4 75.4 8.0 8 8 A L E +A 16 0A 0 8,-4.1 8,-1.4 -2,-0.6 2,-0.3 -0.789 29.6 156.7 -92.7 132.6 14.4 77.8 7.8 9 9 A K B +E 144 0B 104 135,-2.0 135,-2.4 -2,-0.5 2,-0.2 -0.979 6.3 160.8-147.6 154.5 11.4 76.7 5.9 10 10 A G - 0 0 36 4,-0.4 133,-0.2 2,-0.4 132,-0.1 -0.811 54.8 -74.1-154.1-165.6 7.7 77.6 5.9 11 11 A D S S+ 0 0 172 131,-0.3 132,-0.1 -2,-0.2 131,-0.1 0.686 110.8 35.6 -77.5 -17.6 4.5 77.5 3.9 12 12 A G S S- 0 0 49 130,-0.6 -2,-0.4 2,-0.1 130,-0.0 -0.028 111.5 -61.2-113.5-146.5 5.5 80.3 1.6 13 13 A P S S+ 0 0 97 0, 0.0 2,-0.4 0, 0.0 23,-0.1 0.398 85.4 115.8 -88.0 -3.9 8.7 81.5 -0.1 14 14 A V + 0 0 8 128,-0.3 -4,-0.4 21,-0.1 2,-0.3 -0.640 37.4 160.0 -72.7 127.4 10.9 82.4 2.9 15 15 A Q E + C 0 34A 103 19,-1.1 19,-2.7 -2,-0.4 2,-0.3 -0.968 3.9 146.8-140.4 153.8 13.9 80.1 3.1 16 16 A G E -AC 8 33A 13 -8,-1.4 -8,-4.1 -2,-0.3 2,-0.5 -0.952 36.0-127.8 179.1 163.6 17.3 80.3 4.9 17 17 A T E -AC 7 32A 47 15,-1.4 15,-1.3 -2,-0.3 2,-0.4 -0.979 21.2-169.0-125.2 121.8 20.3 78.8 6.6 18 18 A I E -AC 6 31A 0 -12,-2.5 -12,-2.0 -2,-0.5 2,-0.3 -0.932 3.2-163.1-113.5 132.7 21.5 80.0 10.0 19 19 A H E -AC 5 30A 81 11,-3.1 11,-1.8 -2,-0.4 2,-0.4 -0.782 2.9-162.5-112.7 145.6 24.9 78.9 11.5 20 20 A F E -AC 4 29A 2 -16,-2.1 -16,-1.9 -2,-0.3 2,-0.3 -0.983 6.9-176.1-129.3 142.2 25.8 79.3 15.2 21 21 A E E -AC 3 28A 83 7,-1.3 7,-2.5 -2,-0.4 2,-0.3 -0.993 23.2-129.3-143.6 134.6 29.3 79.1 16.7 22 22 A A E + C 0 27A 33 -20,-2.4 2,-0.2 -2,-0.3 5,-0.2 -0.634 27.4 174.7 -83.3 138.2 30.5 79.3 20.3 23 23 A K E > - C 0 26A 99 3,-2.3 3,-1.9 1,-0.3 2,-0.1 -0.760 62.1 -58.4-146.0 92.3 33.2 81.9 20.9 24 24 A G T 3 S- 0 0 76 1,-0.3 -1,-0.3 -2,-0.2 0, 0.0 -0.453 120.0 -19.5 65.2-130.6 34.2 82.3 24.6 25 25 A D T 3 S+ 0 0 164 -3,-0.1 2,-0.3 -2,-0.1 -1,-0.3 0.149 127.0 84.7 -95.7 21.4 31.0 83.3 26.4 26 26 A T E < -C 23 0A 32 -3,-1.9 -3,-2.3 75,-0.0 2,-0.5 -0.785 64.4-144.6-117.8 162.5 29.4 84.4 23.2 27 27 A V E -CD 22 99A 4 72,-2.4 72,-2.9 -2,-0.3 2,-0.6 -0.989 13.2-155.8-127.8 123.3 27.4 82.9 20.3 28 28 A V E -CD 21 98A 29 -7,-2.5 -7,-1.3 -2,-0.5 2,-0.5 -0.888 8.9-164.4-100.1 120.1 28.0 84.3 16.8 29 29 A V E +CD 20 97A 0 68,-3.6 68,-2.8 -2,-0.6 2,-0.3 -0.929 16.1 165.6-111.4 124.6 25.0 83.7 14.5 30 30 A T E +CD 19 96A 52 -11,-1.8 -11,-3.1 -2,-0.5 2,-0.3 -0.916 18.6 87.2-130.2 160.5 25.6 84.1 10.8 31 31 A G E -CD 18 95A 21 64,-1.5 64,-3.8 -2,-0.3 2,-0.3 -0.974 57.1 -93.7 145.2-158.2 23.8 83.2 7.5 32 32 A S E -CD 17 94A 46 -15,-1.3 -15,-1.4 -2,-0.3 2,-0.4 -0.987 14.4-152.3-160.2 146.6 21.1 84.6 5.3 33 33 A I E -CD 16 93A 0 60,-2.4 60,-3.3 -2,-0.3 -17,-0.2 -0.973 18.0-168.2-123.6 136.1 17.3 84.5 4.7 34 34 A T E +C 15 0A 59 -19,-2.7 -19,-1.1 -2,-0.4 58,-0.2 -0.681 58.6 48.4-122.8 170.0 15.7 85.1 1.3 35 35 A G S S+ 0 0 38 55,-0.3 2,-0.3 1,-0.2 57,-0.2 0.601 77.4 139.6 76.9 10.5 12.2 85.7 -0.0 36 36 A L - 0 0 8 55,-2.6 2,-0.4 -3,-0.2 -1,-0.2 -0.653 60.4-110.9 -90.7 151.7 11.4 88.3 2.6 37 37 A T - 0 0 103 -2,-0.3 50,-0.3 1,-0.1 52,-0.1 -0.596 53.5 -93.3 -72.4 128.6 9.6 91.6 2.1 38 38 A E S S+ 0 0 136 -2,-0.4 2,-0.3 51,-0.2 50,-0.2 0.032 90.0 46.4 -39.1 144.3 12.1 94.4 2.4 39 39 A G E S-F 87 0B 28 48,-3.6 48,-3.9 -3,-0.1 2,-0.3 -0.729 96.8 -22.9 115.2-165.9 12.4 95.9 5.9 40 40 A D E -F 86 0B 64 46,-0.3 2,-0.4 -2,-0.3 46,-0.2 -0.670 48.6-173.6 -94.3 131.3 12.7 94.5 9.4 41 41 A H E -F 85 0B 3 44,-3.7 44,-3.3 -2,-0.3 78,-0.1 -0.992 30.1-112.3-127.5 134.0 11.6 91.1 10.5 42 42 A G E -F 84 0B 0 78,-1.8 76,-2.8 -2,-0.4 2,-0.4 -0.371 29.4-164.2 -60.1 141.4 11.6 89.8 14.1 43 43 A F E + G 0 117B 0 40,-2.4 39,-1.1 74,-0.2 2,-0.3 -0.949 21.1 158.8-134.9 98.4 14.1 87.0 14.6 44 44 A H E -FG 81 116B 0 72,-2.0 72,-2.7 -2,-0.4 2,-0.6 -0.965 43.6-125.1-128.6 156.6 13.7 84.9 17.7 45 45 A V E - G 0 115B 0 35,-2.1 17,-2.9 -2,-0.3 70,-0.2 -0.850 34.4-155.9 -92.1 113.5 14.4 81.5 19.4 46 46 A H E -HG 61 114B 3 68,-3.3 68,-1.0 -2,-0.6 15,-0.3 -0.584 21.5-111.5 -90.3 162.7 11.1 80.0 20.4 47 47 A Q S S+ 0 0 67 13,-3.2 2,-0.3 -2,-0.2 12,-0.2 0.915 88.4 53.6 -65.2 -48.2 10.9 77.4 23.2 48 48 A F - 0 0 24 10,-2.5 2,-0.4 12,-0.3 66,-0.3 -0.717 59.6-148.7-100.0 146.9 10.0 74.0 21.5 49 49 A G + 0 0 2 252,-2.0 2,-0.7 63,-0.5 251,-0.3 -0.275 59.8 129.7 -94.6 39.2 11.7 72.2 18.7 50 50 A D + 0 0 28 -2,-0.4 3,-0.4 7,-0.2 9,-0.1 -0.866 26.0 166.8-100.1 107.7 8.3 70.9 17.7 51 51 A N > + 0 0 49 -2,-0.7 3,-1.4 1,-0.2 -1,-0.1 0.132 43.0 113.7-101.7 19.6 7.4 71.3 14.0 52 52 A T T 3 S+ 0 0 59 1,-0.3 -1,-0.2 5,-0.1 3,-0.1 0.728 89.7 31.3 -67.4 -21.0 4.4 68.9 14.1 53 53 A Q T >> S- 0 0 138 1,-0.7 3,-1.0 -3,-0.4 4,-0.6 -0.365 120.1-105.2-124.4 45.3 2.0 71.9 13.4 54 54 A G T <4 S- 0 0 28 -3,-1.4 -1,-0.7 1,-0.2 3,-0.4 -0.241 80.1 -26.6 65.2-145.0 4.4 74.0 11.4 55 55 A a T >4 S+ 0 0 14 1,-0.2 3,-1.2 86,-0.2 -1,-0.2 0.691 128.5 73.3 -79.4 -14.3 5.8 77.0 13.2 56 56 A T G X4 S+ 0 0 97 -3,-1.0 3,-1.4 1,-0.3 -1,-0.2 0.865 87.2 61.0 -74.8 -27.1 2.9 77.4 15.6 57 57 A S G 3< S+ 0 0 17 -4,-0.6 -1,-0.3 -3,-0.4 -7,-0.2 0.636 80.6 87.8 -77.6 -3.1 3.9 74.3 17.7 58 58 A A G < S- 0 0 0 -3,-1.2 -10,-2.5 1,-0.2 -1,-0.3 0.652 85.5-151.2 -67.0 -7.1 7.2 76.1 18.5 59 59 A G < - 0 0 20 -3,-1.4 -1,-0.2 -12,-0.2 3,-0.1 -0.327 36.1 -36.2 70.2-155.9 5.4 77.8 21.5 60 60 A P S S- 0 0 73 0, 0.0 -13,-3.2 0, 0.0 -12,-0.3 -0.056 85.2 -53.4 -93.1-175.1 6.6 81.2 22.7 61 61 A H B -H 46 0B 10 -15,-0.3 2,-0.6 73,-0.2 -15,-0.3 -0.323 64.2 -97.6 -61.6 142.5 10.0 82.9 23.0 62 62 A F + 0 0 9 -17,-2.9 18,-2.7 16,-0.1 17,-0.5 -0.521 59.5 160.5 -62.3 112.0 12.6 81.0 24.8 63 63 A N > + 0 0 44 -2,-0.6 3,-1.4 15,-0.2 -1,-0.1 -0.585 11.4 159.9-137.6 69.8 12.3 82.7 28.3 64 64 A P T 3 S+ 0 0 52 0, 0.0 -1,-0.1 0, 0.0 14,-0.1 0.882 81.0 49.9 -65.0 -31.4 13.9 80.5 31.0 65 65 A L T 3 S- 0 0 67 12,-0.1 12,-0.1 1,-0.0 13,-0.0 0.122 108.1-124.8 -93.2 22.8 14.2 83.5 33.4 66 66 A S < + 0 0 104 -3,-1.4 2,-0.1 1,-0.1 12,-0.1 0.834 55.3 153.4 30.9 61.5 10.6 84.6 32.9 67 67 A K - 0 0 72 10,-0.2 2,-0.3 1,-0.1 -1,-0.1 -0.406 48.0 -90.5 -99.2 178.7 11.5 88.2 31.8 68 68 A K - 0 0 129 -2,-0.1 66,-0.2 1,-0.1 -1,-0.1 -0.644 51.0 -90.5 -90.6 150.5 9.6 90.6 29.6 69 69 A H + 0 0 8 64,-2.3 2,-0.2 -2,-0.3 -1,-0.1 -0.369 62.8 151.1 -57.2 136.2 10.2 90.7 25.8 70 70 A G - 0 0 3 8,-0.1 13,-0.3 64,-0.1 55,-0.2 -0.667 44.9 -82.0-145.3-161.1 13.0 93.2 24.9 71 71 A G > - 0 0 2 53,-0.3 3,-1.2 5,-0.2 10,-0.1 -0.634 48.6 -96.9-107.5 170.4 15.7 93.7 22.3 72 72 A P T 3 S+ 0 0 46 0, 0.0 29,-0.1 0, 0.0 10,-0.1 0.796 120.9 52.4 -56.7 -37.8 19.1 92.0 22.3 73 73 A K T 3 S+ 0 0 113 26,-0.0 2,-0.1 3,-0.0 4,-0.1 0.708 93.0 93.3 -74.8 -19.8 20.9 94.9 23.9 74 74 A D < - 0 0 46 -3,-1.2 -4,-0.1 1,-0.1 3,-0.0 -0.314 67.7-143.8 -78.1 158.4 18.5 95.1 26.9 75 75 A D S S+ 0 0 144 1,-0.2 2,-1.0 -2,-0.1 -1,-0.1 0.767 94.0 65.3 -86.1 -31.5 18.9 93.4 30.2 76 76 A E S S+ 0 0 87 -9,-0.1 2,-0.3 -7,-0.1 -5,-0.2 -0.828 83.5 108.4 -95.8 102.0 15.3 92.8 30.6 77 77 A R S S- 0 0 7 -2,-1.0 -8,-0.2 -7,-0.1 -10,-0.2 -0.983 71.9 -90.4-163.8 165.3 14.6 90.4 27.7 78 78 A H > - 0 0 14 -2,-0.3 3,-1.2 -8,-0.2 -15,-0.2 -0.493 38.3-121.2 -74.4 154.1 13.8 86.8 26.7 79 79 A V T 3 S+ 0 0 2 -17,-0.5 -16,-0.2 1,-0.2 23,-0.2 0.931 114.8 51.4 -63.0 -34.9 16.9 84.6 26.2 80 80 A G T 3 S+ 0 0 0 -18,-2.7 -35,-2.1 -35,-0.2 2,-1.1 0.456 77.7 113.6 -81.8 1.3 15.5 84.1 22.6 81 81 A D E < +F 44 0B 0 -3,-1.2 -37,-0.2 -19,-0.3 3,-0.1 -0.594 28.0 161.1 -76.2 99.4 15.0 87.8 21.7 82 82 A L E - 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