==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 14-APR-03 1P1V . COMPND 2 MOLECULE: SUPEROXIDE DISMUTASE [CU-ZN]; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.S.ELAM,K.MALEK,J.A.RODRIGUEZ,P.A.DOUCETTE,A.B.TAYLOR, . 436 6 3 0 3 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20972.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 275 63.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 1.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 150 34.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 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 . 3 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 . 40 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 3 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 1 3 6 2 6 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 3 3 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 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 68 0, 0.0 105,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 136.8 23.4 40.5 9.3 2 2 A T + 0 0 85 144,-0.3 20,-3.0 1,-0.2 2,-0.4 0.642 360.0 36.8-114.5 -15.2 21.2 43.6 10.2 3 3 A K E +A 21 0A 76 143,-0.4 143,-2.3 18,-0.2 2,-0.3 -0.994 57.2 170.5-139.7 145.7 17.7 42.1 10.3 4 4 A A E -AB 20 145A 2 16,-2.2 16,-2.9 -2,-0.4 2,-0.3 -0.932 9.6-163.3-144.1 167.6 16.1 38.9 11.4 5 5 A V E -AB 19 144A 3 139,-2.2 139,-3.2 -2,-0.3 2,-0.4 -0.980 2.4-163.3-151.3 154.2 12.7 37.5 11.9 6 6 A C E -A 18 0A 1 12,-2.1 12,-2.6 -2,-0.3 2,-0.6 -0.970 11.3-149.8-147.9 129.0 11.0 34.6 13.7 7 7 A V E -A 17 0A 29 135,-0.5 2,-0.5 -2,-0.4 10,-0.2 -0.883 20.8-150.7 -96.9 118.8 7.5 33.1 13.4 8 8 A L E +A 16 0A 0 8,-2.9 8,-1.8 -2,-0.6 2,-0.3 -0.821 28.1 153.8 -95.1 126.3 6.4 31.7 16.7 9 9 A K B +E 140 0B 119 131,-2.4 131,-2.4 -2,-0.5 2,-0.2 -0.966 9.0 162.5-145.2 162.4 4.0 28.7 16.6 10 10 A G - 0 0 34 2,-0.4 129,-0.1 4,-0.4 128,-0.1 -0.760 55.2 -75.6-154.2-159.7 3.1 25.8 18.8 11 11 A D S S+ 0 0 175 127,-0.3 128,-0.1 -2,-0.2 127,-0.1 0.584 109.9 48.2 -88.7 -14.3 0.5 23.1 19.4 12 12 A G S S- 0 0 50 126,-0.6 -2,-0.4 2,-0.2 126,-0.0 -0.148 109.5 -71.6-109.7-155.3 -1.9 25.6 21.1 13 13 A P S S+ 0 0 93 0, 0.0 2,-0.5 0, 0.0 23,-0.1 0.456 88.9 112.4 -85.0 -0.5 -3.2 29.0 20.3 14 14 A V + 0 0 7 124,-0.2 -4,-0.4 23,-0.1 2,-0.3 -0.589 38.1 145.0 -82.7 128.3 -0.0 31.0 20.9 15 15 A Q E + C 0 36A 87 21,-1.9 21,-2.8 -2,-0.5 2,-0.3 -0.997 9.0 139.8-152.6 153.0 1.4 32.5 17.8 16 16 A G E -AC 8 35A 12 -8,-1.8 -8,-2.9 -2,-0.3 2,-0.4 -0.989 39.2-112.3-174.6-178.4 3.3 35.6 16.8 17 17 A I E -AC 7 34A 66 17,-1.7 17,-1.5 -2,-0.3 2,-0.5 -0.999 23.6-168.5-133.2 127.4 6.0 37.3 14.8 18 18 A I E -AC 6 33A 0 -12,-2.6 -12,-2.1 -2,-0.4 2,-0.3 -0.978 6.3-158.5-121.7 133.8 9.1 38.9 16.3 19 19 A N E -AC 5 32A 46 13,-3.3 13,-2.2 -2,-0.5 2,-0.4 -0.796 1.6-160.1-109.5 149.7 11.4 41.1 14.3 20 20 A F E -AC 4 31A 1 -16,-2.9 -16,-2.2 -2,-0.3 2,-0.4 -0.984 8.2-179.3-129.0 141.1 15.1 41.9 15.1 21 21 A E E -AC 3 30A 67 9,-2.1 9,-3.0 -2,-0.4 2,-0.4 -0.985 7.2-178.1-143.2 133.5 17.1 44.8 13.8 22 22 A Q - 0 0 4 -20,-3.0 7,-0.1 -2,-0.4 -2,-0.0 -0.871 3.4-175.7-135.4 99.2 20.8 45.7 14.5 23 23 A K S S+ 0 0 166 -2,-0.4 2,-0.4 5,-0.3 -1,-0.1 0.802 77.4 33.2 -59.4 -40.7 22.0 48.9 12.9 24 24 A E S > S- 0 0 125 4,-0.4 3,-2.5 1,-0.1 -1,-0.1 -0.978 76.8-133.8-125.6 134.5 25.6 48.4 14.0 25 25 A S T 3 S+ 0 0 78 -2,-0.4 82,-0.2 1,-0.3 81,-0.1 0.785 111.6 40.9 -64.3 -24.0 27.3 45.1 14.4 26 26 A N T 3 S+ 0 0 166 79,-0.1 -1,-0.3 -3,-0.0 -3,-0.0 0.177 108.1 86.1-102.9 17.1 28.7 46.2 17.8 27 27 A G S < S- 0 0 16 -3,-2.5 2,-0.0 1,-0.2 0, 0.0 -0.409 85.8 -73.1-108.6-179.0 25.4 47.9 18.9 28 28 A P - 0 0 54 0, 0.0 2,-0.5 0, 0.0 -4,-0.4 -0.242 40.0-124.4 -71.6 163.1 22.1 46.8 20.5 29 29 A V E - D 0 101A 0 72,-3.2 72,-2.6 75,-0.2 2,-0.4 -0.949 14.3-140.6-107.8 126.2 19.4 44.8 18.8 30 30 A K E -CD 21 100A 100 -9,-3.0 -9,-2.1 -2,-0.5 2,-0.4 -0.764 18.3-166.8 -83.7 133.2 15.9 46.1 18.6 31 31 A V E +CD 20 99A 0 68,-2.8 68,-2.6 -2,-0.4 2,-0.3 -0.993 19.6 152.4-122.4 121.6 13.3 43.3 19.2 32 32 A W E +CD 19 98A 92 -13,-2.2 -13,-3.3 -2,-0.4 2,-0.3 -0.998 11.0 91.0-154.8 151.1 9.6 44.0 18.3 33 33 A G E -CD 18 97A 18 64,-2.0 64,-3.2 -2,-0.3 2,-0.3 -0.969 58.1 -81.9 159.1-154.9 6.4 42.4 17.3 34 34 A S E -CD 17 96A 44 -17,-1.5 -17,-1.7 -2,-0.3 2,-0.4 -0.992 20.3-162.9-150.6 138.3 3.3 40.8 18.8 35 35 A I E -CD 16 95A 0 60,-2.1 60,-3.3 -2,-0.3 -19,-0.2 -0.994 18.0-172.1-123.5 131.7 2.4 37.5 20.3 36 36 A K E +C 15 0A 102 -21,-2.8 -21,-1.9 -2,-0.4 58,-0.2 -0.716 55.0 51.0-121.1 167.9 -1.2 36.5 20.7 37 37 A G S S+ 0 0 36 55,-0.3 2,-0.2 1,-0.3 57,-0.2 0.629 77.3 136.5 83.0 14.5 -3.2 33.7 22.3 38 38 A L - 0 0 9 55,-2.2 -1,-0.3 -3,-0.2 2,-0.2 -0.527 60.9-106.0 -89.7 154.9 -1.5 34.1 25.7 39 39 A T - 0 0 95 -2,-0.2 50,-0.3 82,-0.2 -1,-0.1 -0.562 52.4 -89.5 -71.5 146.8 -2.9 34.1 29.1 40 40 A E S S+ 0 0 137 -2,-0.2 2,-0.3 51,-0.2 50,-0.2 -0.360 93.3 35.0 -53.4 131.9 -3.0 37.6 30.7 41 41 A G E S-F 89 0B 28 48,-2.5 48,-2.8 -3,-0.1 2,-0.2 -0.768 99.3 -13.0 120.3-163.2 0.3 38.3 32.6 42 42 A L E -F 88 0B 86 -2,-0.3 2,-0.4 46,-0.2 46,-0.2 -0.549 48.2-172.7 -86.6 142.5 4.0 37.6 32.3 43 43 A H E -F 87 0B 0 44,-2.5 44,-2.7 -2,-0.2 80,-0.3 -0.987 29.7-112.9-136.8 122.0 5.5 35.0 30.0 44 44 A G E -F 86 0B 0 78,-2.9 76,-2.7 -2,-0.4 2,-0.4 -0.164 29.8-161.1 -52.3 142.3 9.2 33.9 29.9 45 45 A F E + G 0 119B 2 40,-2.7 39,-1.1 74,-0.2 2,-0.3 -0.956 20.8 160.5-138.0 109.1 10.9 35.0 26.7 46 46 A H E -FG 83 118B 1 72,-2.4 72,-3.0 -2,-0.4 2,-0.7 -0.950 42.4-133.7-134.6 149.9 14.1 33.2 25.7 47 47 A V E - G 0 117B 0 35,-2.1 17,-2.8 -2,-0.3 2,-0.2 -0.942 33.6-156.4 -96.5 116.9 16.6 32.4 23.0 48 48 A H E -HG 63 116B 1 68,-3.3 68,-1.7 -2,-0.7 15,-0.3 -0.643 22.3-111.4 -92.0 155.2 17.3 28.7 23.3 49 49 A E S S+ 0 0 63 13,-2.9 2,-0.4 -2,-0.2 12,-0.2 0.845 90.1 53.3 -61.1 -45.3 20.5 27.2 21.9 50 50 A F - 0 0 19 10,-2.7 2,-1.0 12,-0.2 242,-0.2 -0.789 61.7-147.4-106.7 137.5 19.5 25.1 19.0 51 51 A G + 0 0 2 240,-1.7 2,-0.6 63,-0.8 239,-0.3 -0.368 60.9 129.0 -87.4 52.8 17.3 26.0 16.0 52 52 A D + 0 0 30 -2,-1.0 3,-0.3 7,-0.2 -2,-0.1 -0.941 23.7 163.0-113.9 105.5 16.0 22.4 16.0 53 53 A N > + 0 0 36 -2,-0.6 3,-1.6 1,-0.2 -1,-0.1 0.007 40.4 115.1-111.2 26.9 12.3 22.1 15.9 54 54 A T T 3 S+ 0 0 58 1,-0.3 -1,-0.2 5,-0.1 3,-0.1 0.821 91.8 33.0 -61.0 -31.5 12.2 18.5 14.9 55 55 A A T >> S- 0 0 59 1,-0.5 3,-1.4 -3,-0.3 4,-0.5 -0.402 121.8-111.6-114.2 47.6 10.6 17.8 18.2 56 56 A G T <4 S- 0 0 35 -3,-1.6 -1,-0.5 1,-0.3 3,-0.4 -0.263 79.7 -20.9 54.9-138.8 8.8 21.1 18.4 57 57 A a T >4 S+ 0 0 14 1,-0.2 3,-1.1 80,-0.2 -1,-0.3 0.675 128.3 72.7 -76.9 -16.6 10.1 23.4 21.0 58 58 A T G X4 S+ 0 0 111 -3,-1.4 3,-1.6 1,-0.2 -1,-0.2 0.887 88.9 59.5 -65.2 -38.6 11.7 20.7 23.1 59 59 A S G 3< S+ 0 0 25 -4,-0.5 -1,-0.2 -3,-0.4 -7,-0.2 0.509 81.7 86.6 -73.6 1.6 14.6 20.1 20.7 60 60 A A G < S- 0 0 0 -3,-1.1 -10,-2.7 1,-0.2 -1,-0.3 0.648 83.9-155.6 -73.6 -10.9 15.7 23.7 21.1 61 61 A G < - 0 0 20 -3,-1.6 -1,-0.2 -12,-0.2 3,-0.1 -0.318 34.1 -22.0 72.9-158.2 17.7 22.6 24.1 62 62 A P S S- 0 0 66 0, 0.0 -13,-2.9 0, 0.0 -12,-0.2 -0.082 87.0 -60.2 -83.9-177.8 18.8 24.9 26.9 63 63 A H B -H 48 0B 14 -15,-0.3 2,-0.4 67,-0.2 -15,-0.3 -0.378 62.9-100.8 -59.7 141.6 19.1 28.7 27.1 64 64 A F + 0 0 4 -17,-2.8 18,-2.6 52,-0.2 17,-0.3 -0.522 56.5 160.9 -65.2 123.2 21.7 30.1 24.7 65 65 A N > + 0 0 35 -2,-0.4 3,-1.4 15,-0.2 -1,-0.1 -0.420 12.0 152.4-147.6 60.0 24.7 30.6 26.9 66 66 A P T 3 S+ 0 0 54 0, 0.0 -1,-0.1 0, 0.0 44,-0.1 0.697 77.4 56.9 -69.5 -19.1 27.9 30.9 24.8 67 67 A L T 3 S- 0 0 69 -3,-0.1 43,-0.0 43,-0.0 -3,-0.0 0.292 107.4-122.7 -98.3 7.7 29.6 33.1 27.5 68 68 A S < + 0 0 105 -3,-1.4 2,-0.2 1,-0.1 12,-0.1 0.902 59.4 144.4 57.9 46.9 29.1 30.6 30.3 69 69 A R - 0 0 69 10,-0.1 2,-0.2 1,-0.1 -1,-0.1 -0.480 50.0-100.2-103.9 176.4 27.1 32.8 32.7 70 70 A K - 0 0 151 -2,-0.2 -1,-0.1 9,-0.1 2,-0.1 -0.646 48.5 -83.1 -94.5 161.4 24.3 32.1 35.1 71 71 A H + 0 0 18 -2,-0.2 2,-0.3 8,-0.2 -1,-0.1 -0.347 63.5 140.7 -65.0 139.6 20.6 32.7 34.4 72 72 A G - 0 0 1 8,-0.1 13,-0.3 58,-0.1 55,-0.3 -0.853 50.7 -75.6-153.5-170.2 19.3 36.3 35.0 73 73 A G > - 0 0 3 53,-0.7 3,-1.8 -2,-0.3 10,-0.1 -0.531 52.0 -98.3 -92.0 169.8 17.0 38.9 33.6 74 74 A P T 3 S+ 0 0 36 0, 0.0 28,-0.2 0, 0.0 5,-0.1 0.745 122.3 48.1 -65.4 -27.1 17.8 41.0 30.5 75 75 A K T 3 S+ 0 0 164 26,-0.1 2,-0.3 3,-0.1 3,-0.1 0.289 91.7 98.6 -99.3 10.9 19.0 44.0 32.5 76 76 A D < - 0 0 79 -3,-1.8 -4,-0.1 1,-0.1 3,-0.0 -0.691 69.4-143.8 -85.7 149.9 21.2 41.9 34.8 77 77 A E S S+ 0 0 144 -2,-0.3 2,-1.2 1,-0.2 -1,-0.1 0.833 95.6 66.4 -78.9 -37.1 24.9 41.7 34.0 78 78 A E S S+ 0 0 73 -9,-0.1 2,-0.3 -7,-0.1 -5,-0.2 -0.722 82.5 113.2 -82.4 97.8 24.9 38.1 35.2 79 79 A R - 0 0 9 -2,-1.2 -8,-0.2 -7,-0.1 2,-0.2 -0.980 67.7-102.0-157.2 160.1 22.7 36.6 32.5 80 80 A H > - 0 0 0 -2,-0.3 3,-1.9 -8,-0.2 -15,-0.2 -0.532 37.4-115.3 -76.2 153.1 22.7 34.1 29.6 81 81 A V T 3 S+ 0 0 2 -17,-0.3 -16,-0.2 1,-0.3 23,-0.2 0.928 118.4 54.1 -56.2 -38.2 22.8 35.6 26.1 82 82 A G T 3 S+ 0 0 0 -18,-2.6 -35,-2.1 -35,-0.1 2,-1.4 0.390 77.3 112.5 -77.5 6.2 19.3 34.1 25.6 83 83 A D E < +F 46 0B 0 -3,-1.9 -37,-0.2 -19,-0.2 -1,-0.1 -0.607 26.8 156.5 -87.9 88.9 17.8 35.7 28.7 84 84 A L E - 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