==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JUL-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 08-JUN-12 2LU5 . COMPND 2 MOLECULE: SUPEROXIDE DISMUTASE [CU-ZN]; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.J.KNIGHT,A.J.PELL,I.BERTINI,I.C.FELLI,L.GONNELLI,R.PIERATT . 153 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7438.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 90 58.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 1.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 21 13.7 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 . 2 1.3 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-3), SAME NUMBER PER 100 RESIDUES . 1 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 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 . 28 18.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 6 3.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.7 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 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 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 3 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 51 0, 0.0 21,-2.4 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -81.9 8.3 -13.5 0.4 2 2 A T + 0 0 64 19,-0.3 2,-0.3 1,-0.1 19,-0.1 0.675 360.0 11.3 -88.8 -26.9 5.5 -15.6 -0.9 3 3 A K - 0 0 83 19,-0.1 2,-0.3 17,-0.1 -1,-0.1 -0.996 54.8-170.2-152.2 158.5 2.3 -14.3 0.8 4 4 A A - 0 0 1 147,-0.3 2,-0.4 -2,-0.3 147,-0.3 -0.960 9.6-150.6-145.2 153.7 1.1 -11.5 2.8 5 5 A V E -A 150 0A 79 145,-2.9 145,-1.0 -2,-0.3 2,-0.4 -0.999 7.7-159.5-132.2 132.0 -1.9 -10.5 4.7 6 6 A A E -A 149 0A 5 -2,-0.4 2,-0.4 143,-0.2 143,-0.2 -0.921 5.5-172.7-108.7 136.7 -3.2 -7.1 5.3 7 7 A V + 0 0 73 141,-1.2 2,-0.4 -2,-0.4 141,-0.3 -0.932 8.1 178.8-134.3 106.7 -5.5 -6.2 8.1 8 8 A L + 0 0 4 -2,-0.4 2,-0.3 8,-0.4 139,-0.2 -0.898 6.7 175.3-112.4 140.6 -7.0 -2.7 8.2 9 9 A K + 0 0 149 137,-1.8 137,-0.4 45,-0.5 2,-0.2 -0.972 15.9 159.5-144.5 123.5 -9.4 -1.3 10.8 10 10 A G - 0 0 33 2,-0.5 134,-0.1 -2,-0.3 135,-0.1 -0.549 56.2 -86.4-131.9-165.6 -10.6 2.2 10.8 11 11 A D S S+ 0 0 137 132,-0.5 133,-0.1 -2,-0.2 -1,-0.1 0.881 122.6 41.5 -74.8 -42.7 -13.2 4.7 11.9 12 12 A G S S- 0 0 16 132,-0.3 2,-0.6 26,-0.0 -2,-0.5 -0.734 114.7 -92.5 -94.9 154.0 -15.1 3.9 8.8 13 13 A P + 0 0 90 0, 0.0 2,-0.4 0, 0.0 -4,-0.1 -0.608 55.6 163.5 -77.4 121.7 -15.2 0.2 8.0 14 14 A V + 0 0 4 -2,-0.6 2,-0.4 23,-0.1 23,-0.2 -0.998 5.2 162.5-133.3 125.0 -12.4 -0.6 5.7 15 15 A Q E +C 36 0B 121 21,-2.2 21,-2.7 -2,-0.4 2,-0.3 -0.992 2.9 141.5-150.0 142.7 -11.4 -4.1 5.3 16 16 A G E -C 35 0B 8 -2,-0.4 2,-0.4 19,-0.2 -8,-0.4 -0.973 37.7-129.3-170.4 166.7 -9.4 -6.0 2.7 17 17 A I E -C 34 0B 114 17,-1.2 17,-0.7 -2,-0.3 2,-0.5 -0.927 22.5-177.4-134.3 103.2 -6.9 -8.7 2.2 18 18 A I E -C 33 0B 6 -2,-0.4 2,-0.5 15,-0.2 15,-0.3 -0.909 3.4-174.6-103.1 126.8 -3.9 -7.9 0.1 19 19 A N E -C 32 0B 61 13,-2.5 13,-1.8 -2,-0.5 2,-0.4 -0.989 2.9-176.1-125.4 122.6 -1.5 -10.7 -0.5 20 20 A F E -C 31 0B 0 -2,-0.5 2,-0.7 11,-0.2 11,-0.2 -0.979 14.1-161.2-128.2 128.2 1.8 -10.2 -2.3 21 21 A E E +C 30 0B 61 9,-1.7 9,-0.9 -2,-0.4 2,-0.3 -0.910 28.1 154.0-106.8 109.2 4.5 -12.6 -3.4 22 22 A Q - 0 0 13 -21,-2.4 2,-0.3 -2,-0.7 82,-0.1 -0.846 19.1-171.6-126.2 162.1 7.8 -11.0 -4.1 23 23 A K > - 0 0 144 80,-0.4 3,-1.8 -2,-0.3 4,-0.2 -0.969 36.2-119.1-154.2 149.4 11.4 -12.2 -4.0 24 24 A E T 3 S+ 0 0 176 -2,-0.3 80,-0.0 1,-0.3 81,-0.0 0.572 104.5 82.3 -66.4 -9.1 14.7 -10.4 -4.3 25 25 A S T 3 S- 0 0 82 1,-0.0 -1,-0.3 2,-0.0 79,-0.1 0.517 109.2-112.6 -70.4 -8.7 15.4 -12.6 -7.4 26 26 A N < + 0 0 107 -3,-1.8 78,-0.2 1,-0.2 -2,-0.1 0.796 59.0 138.1 75.6 115.2 13.2 -10.0 -9.3 27 27 A G - 0 0 24 76,-1.9 -4,-0.3 -4,-0.2 -1,-0.2 -0.887 58.8 -78.4-177.6 150.5 9.9 -10.9 -10.7 28 28 A P - 0 0 72 0, 0.0 2,-0.5 0, 0.0 73,-0.2 -0.352 52.7-121.3 -57.3 131.6 6.3 -9.4 -11.0 29 29 A V - 0 0 2 71,-0.4 2,-0.8 -9,-0.0 -7,-0.2 -0.650 13.4-139.0 -83.5 128.5 4.6 -9.8 -7.7 30 30 A K E +C 21 0B 119 -9,-0.9 -9,-1.7 -2,-0.5 2,-0.4 -0.818 39.1 166.8 -85.5 112.8 1.5 -11.8 -7.9 31 31 A V E -C 20 0B 5 -2,-0.8 2,-0.4 -11,-0.2 -11,-0.2 -0.983 21.4-174.1-137.4 138.3 -0.7 -9.9 -5.6 32 32 A W E +C 19 0B 127 -13,-1.8 -13,-2.5 -2,-0.4 2,-0.3 -0.999 11.5 163.4-136.2 132.3 -4.4 -9.9 -5.0 33 33 A G E -C 18 0B 1 -2,-0.4 2,-0.4 -15,-0.3 -15,-0.2 -0.956 16.5-167.9-151.6 138.9 -6.4 -7.6 -2.8 34 34 A S E -C 17 0B 53 -17,-0.7 -17,-1.2 -2,-0.3 2,-0.4 -0.935 13.3-161.4-116.6 142.7 -10.0 -6.7 -2.4 35 35 A I E -CD 16 95B 6 60,-1.2 60,-2.1 -2,-0.4 2,-0.4 -0.986 8.0-163.6-128.7 139.2 -11.1 -3.7 -0.3 36 36 A K E +CD 15 94B 113 -21,-2.7 -21,-2.2 -2,-0.4 2,-0.3 -0.968 31.4 142.8-117.9 138.7 -14.4 -2.9 1.1 37 37 A G - 0 0 12 56,-0.6 -23,-0.1 -2,-0.4 3,-0.1 -0.852 50.3 -63.3-161.4 176.6 -14.9 0.7 2.2 38 38 A L S S- 0 0 86 -2,-0.3 2,-0.8 1,-0.1 55,-0.2 -0.237 79.6 -64.2 -69.1 170.9 -17.3 3.6 2.5 39 39 A T S S+ 0 0 97 53,-0.2 2,-0.3 52,-0.1 52,-0.3 -0.505 93.4 94.8 -69.3 108.3 -18.7 5.2 -0.8 40 40 A E - 0 0 80 50,-1.1 53,-0.3 -2,-0.8 82,-0.2 -0.941 67.5-106.1-172.9 171.7 -15.8 6.6 -2.8 41 41 A G - 0 0 32 -2,-0.3 2,-0.2 80,-0.2 49,-0.1 0.277 29.9-148.4 -82.5-146.2 -13.5 5.8 -5.5 42 42 A L - 0 0 9 79,-0.3 81,-0.4 46,-0.1 2,-0.3 -0.752 11.3-173.4 172.4 140.1 -9.8 5.0 -4.9 43 43 A H B -f 123 0C 87 79,-2.1 81,-2.2 1,-0.4 45,-0.1 -0.881 53.1 -0.5-152.7 122.2 -6.7 5.6 -7.0 44 44 A G - 0 0 1 -2,-0.3 80,-0.7 79,-0.2 2,-0.6 0.470 60.1-122.3 77.0 139.0 -3.2 4.5 -6.4 45 45 A F + 0 0 6 40,-1.1 2,-0.5 27,-0.1 40,-0.3 -0.946 36.6 168.1-114.5 106.5 -1.9 2.4 -3.5 46 46 A H + 0 0 3 -2,-0.6 2,-0.3 72,-0.5 38,-0.1 -0.808 2.7 167.5-130.1 89.2 0.9 4.4 -1.8 47 47 A V + 0 0 1 -2,-0.5 2,-0.2 36,-0.5 70,-0.1 -0.662 6.7 176.0 -92.6 152.0 2.0 2.9 1.4 48 48 A H + 0 0 1 68,-0.5 2,-0.3 -2,-0.3 15,-0.2 -0.636 23.3 134.8-162.1 94.3 5.1 4.1 3.1 49 49 A E - 0 0 0 32,-0.7 60,-0.7 -2,-0.2 61,-0.6 -0.916 49.0-163.9-146.0 170.3 6.0 2.7 6.5 50 50 A F S S- 0 0 73 -2,-0.3 65,-0.1 64,-0.1 62,-0.1 -0.045 78.3 -75.5-140.0 25.9 8.3 1.3 9.0 51 51 A G + 0 0 21 65,-0.1 64,-0.3 60,-0.1 62,-0.1 0.521 61.3 156.7 84.5 129.0 5.6 0.1 11.3 52 52 A D - 0 0 69 62,-1.0 2,-0.3 6,-0.1 5,-0.1 0.328 58.8 -30.2-140.8 -77.8 3.4 2.0 13.7 53 53 A N > - 0 0 84 94,-0.0 3,-2.1 61,-0.0 -2,-0.1 -0.944 41.0-132.6-157.7 133.1 0.0 0.8 14.9 54 54 A T T 3 S+ 0 0 56 -2,-0.3 -45,-0.5 1,-0.3 92,-0.1 0.402 107.5 56.5 -73.3 4.6 -2.5 -1.4 13.2 55 55 A A T 3 S- 0 0 63 1,-0.4 -1,-0.3 92,-0.1 2,-0.2 0.400 130.3 -19.1-109.7 -2.4 -5.3 1.1 14.2 56 56 A G < - 0 0 10 -3,-2.1 2,-0.7 89,-0.1 -1,-0.4 -0.507 64.2-125.4 157.6 124.7 -3.6 4.0 12.6 57 57 A a + 0 0 1 85,-2.5 4,-0.1 60,-0.2 88,-0.1 -0.822 20.6 178.5 -97.7 112.8 -0.2 4.8 11.4 58 58 A T S > S+ 0 0 104 -2,-0.7 3,-1.1 1,-0.2 -1,-0.2 0.870 87.0 49.9 -75.6 -37.4 1.3 7.9 12.8 59 59 A S T 3 S+ 0 0 28 1,-0.3 -1,-0.2 2,-0.1 4,-0.1 0.789 101.4 66.0 -72.6 -26.7 4.7 7.3 11.0 60 60 A A T 3 S+ 0 0 0 82,-0.1 -1,-0.3 2,-0.1 3,-0.2 0.479 85.4 78.9 -76.5 -8.8 2.8 6.7 7.7 61 61 A G S < S+ 0 0 10 -3,-1.1 2,-0.9 1,-0.2 -2,-0.1 0.918 109.8 2.3 -64.7 -93.3 1.6 10.2 7.5 62 62 A P S S+ 0 0 100 0, 0.0 2,-0.5 0, 0.0 -1,-0.2 -0.268 98.3 114.2 -95.9 53.3 4.3 12.6 6.2 63 63 A H - 0 0 67 -2,-0.9 2,-0.3 -3,-0.2 -4,-0.0 -0.947 50.5-152.5-125.7 117.1 7.1 10.1 5.6 64 64 A F - 0 0 92 -2,-0.5 73,-0.1 1,-0.0 74,-0.1 -0.640 0.6-157.0 -87.1 138.5 8.4 9.5 2.1 65 65 A N > - 0 0 4 72,-0.4 3,-1.2 -2,-0.3 4,-0.3 -0.877 9.2-176.1-115.5 95.8 9.9 6.2 1.3 66 66 A P T 3> S+ 0 0 56 0, 0.0 4,-0.8 0, 0.0 6,-0.2 0.568 72.9 74.3 -68.9 -10.8 12.2 6.7 -1.8 67 67 A L T 34 S+ 0 0 44 2,-0.1 12,-0.5 1,-0.1 4,-0.1 0.773 82.6 78.6 -77.1 -18.4 13.1 3.1 -2.2 68 68 A S T <4 S- 0 0 2 -3,-1.2 11,-2.9 1,-0.2 10,-0.9 0.964 130.9 -37.2 -54.6 -84.3 9.7 2.4 -3.5 69 69 A R T 4 S- 0 0 100 -4,-0.3 2,-1.2 9,-0.2 4,-0.3 -0.150 93.3 -90.9-134.9 30.1 9.6 3.5 -7.1 70 70 A K S < S+ 0 0 123 -4,-0.8 -2,-0.2 1,-0.2 -3,-0.1 -0.267 129.2 19.8 75.2 -41.2 11.8 6.4 -6.1 71 71 A H S S- 0 0 79 -2,-1.2 -1,-0.2 -4,-0.1 -6,-0.2 0.509 122.5 -99.5-121.7 -17.0 8.6 8.2 -5.6 72 72 A G - 0 0 0 -6,-0.2 -27,-0.1 1,-0.1 -2,-0.1 0.702 45.4-171.5 108.9 16.8 6.3 5.2 -5.2 73 73 A G > - 0 0 10 -4,-0.3 3,-1.3 53,-0.1 4,-0.1 -0.040 31.3-117.8 -38.3 147.0 4.6 4.8 -8.7 74 74 A P T 3 S+ 0 0 38 0, 0.0 26,-0.2 0, 0.0 -1,-0.1 0.712 111.4 52.4 -73.9 -22.4 1.7 2.1 -8.6 75 75 A K T 3 S- 0 0 111 1,-0.1 -2,-0.1 9,-0.1 9,-0.1 0.601 108.0-132.7 -86.9 -12.8 3.2 -0.3 -11.1 76 76 A D < - 0 0 3 -3,-1.3 -7,-0.1 26,-0.1 -1,-0.1 0.195 26.9-165.9 70.4 159.9 6.5 -0.3 -9.1 77 77 A E S S- 0 0 114 -9,-0.6 -8,-0.2 -4,-0.1 -1,-0.1 0.329 80.0 -2.7-148.5 -25.0 10.0 0.1 -10.5 78 78 A E S S- 0 0 51 -10,-0.9 26,-0.8 25,-0.0 -9,-0.2 0.499 128.1 -29.7-138.7 -64.0 12.2 -1.0 -7.8 79 79 A R - 0 0 96 -11,-2.9 2,-0.8 -12,-0.5 -10,-0.1 -0.485 54.7-152.7-173.7 62.6 10.7 -2.0 -4.5 80 80 A H - 0 0 0 1,-0.1 2,-2.3 -11,-0.1 28,-0.1 -0.497 15.9-148.9 -42.2 96.4 7.6 -0.1 -3.9 81 81 A V S S+ 0 0 1 -2,-0.8 -32,-0.7 -16,-0.3 28,-0.3 -0.411 74.2 47.6 -82.6 58.8 7.9 -0.2 -0.2 82 82 A G S S- 0 0 0 -2,-2.3 26,-0.2 26,-0.2 2,-0.1 -0.894 112.3 -55.7-175.2 174.3 4.3 -0.3 0.2 83 83 A D - 0 0 1 -2,-0.3 2,-0.6 24,-0.1 -36,-0.5 -0.440 55.2-147.9 -69.7 139.7 1.4 -2.2 -1.4 84 84 A L + 0 0 4 21,-0.2 16,-0.3 -2,-0.1 2,-0.3 -0.949 46.2 81.9-117.9 119.7 1.5 -1.8 -5.1 85 85 A G - 0 0 1 -2,-0.6 -40,-1.1 -40,-0.3 2,-0.4 -0.948 66.7-104.4 176.2-178.6 -1.6 -1.8 -7.1 86 86 A N B +G 98 0D 51 12,-0.7 12,-1.7 -2,-0.3 2,-0.4 -0.997 37.1 177.0-128.2 129.7 -4.3 0.4 -8.2 87 87 A V - 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