==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 29-JUL-08 2VZ3 . COMPND 2 MOLECULE: GALACTOSE OXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GIBBERELLA ZEAE; . AUTHOR M.S.ROGERS,R.HURTADO-GUERRERO,S.J.FIRBANK,M.A.HALCROW, . 639 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21771.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 395 61.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 1.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 219 34.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 9 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.6 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-2), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 59 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 8 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.6 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 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 . 1 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 0 PARALLEL BRIDGES PER LADDER . 8 3 8 10 10 3 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 1 6 0 2 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 54 0, 0.0 520,-0.6 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0-176.0 33.7 -1.5 17.6 2 2 A S - 0 0 13 518,-0.1 520,-0.1 515,-0.1 518,-0.1 -0.727 360.0-137.5-144.9-162.0 30.7 -3.8 17.2 3 3 A A - 0 0 31 518,-0.4 2,-0.1 -2,-0.2 110,-0.1 -0.982 16.8-108.5-162.3 153.2 30.1 -7.5 17.0 4 4 A P - 0 0 44 0, 0.0 63,-0.1 0, 0.0 111,-0.1 -0.496 20.3-141.2 -75.3 156.4 28.1 -10.3 15.2 5 5 A I S S+ 0 0 51 61,-0.3 2,-0.2 -2,-0.1 62,-0.1 0.578 82.9 46.2 -90.4 -12.1 25.4 -12.0 17.2 6 6 A G S S- 0 0 16 142,-0.1 2,-0.4 60,-0.1 142,-0.2 -0.458 91.8 -89.6-116.1-168.8 26.3 -15.3 15.6 7 7 A S E -A 147 0A 80 140,-2.5 140,-2.2 -2,-0.2 59,-0.1 -0.870 48.9 -97.3-108.3 138.2 29.3 -17.5 14.8 8 8 A A E -A 146 0A 58 -2,-0.4 2,-0.3 138,-0.2 138,-0.2 -0.235 36.8-128.8 -57.3 131.1 31.2 -17.2 11.5 9 9 A I - 0 0 6 136,-3.0 136,-0.3 1,-0.1 2,-0.2 -0.613 28.5-104.5 -80.8 138.7 30.2 -19.8 9.0 10 10 A S - 0 0 77 -2,-0.3 3,-0.3 1,-0.1 -1,-0.1 -0.481 28.5-163.0 -64.4 130.2 33.0 -21.8 7.4 11 11 A R > + 0 0 43 -2,-0.2 3,-1.4 1,-0.2 -1,-0.1 0.241 53.6 115.0-101.5 12.2 33.6 -20.5 3.9 12 12 A N T 3 S+ 0 0 138 1,-0.3 -1,-0.2 0, 0.0 19,-0.0 0.882 87.3 27.1 -50.0 -49.8 35.5 -23.5 2.6 13 13 A N T 3 S+ 0 0 122 -3,-0.3 -1,-0.3 46,-0.1 -2,-0.1 0.169 90.6 135.7-105.4 17.2 33.0 -24.7 -0.0 14 14 A W < - 0 0 24 -3,-1.4 2,-0.4 17,-0.1 45,-0.2 -0.322 40.3-154.4 -66.3 143.3 31.3 -21.3 -0.7 15 15 A A E -B 58 0A 42 43,-2.5 43,-3.6 2,-0.0 2,-0.3 -0.993 17.7-169.5-113.5 131.7 30.6 -20.2 -4.3 16 16 A V E -B 57 0A 28 -2,-0.4 2,-0.4 41,-0.2 41,-0.2 -0.905 10.5-168.3-123.4 148.7 30.3 -16.4 -4.8 17 17 A T E -B 56 0A 94 39,-3.0 39,-3.4 -2,-0.3 2,-0.3 -0.997 2.7-168.7-135.5 140.3 29.2 -14.1 -7.6 18 18 A a E -B 55 0A 25 -2,-0.4 37,-0.2 37,-0.2 3,-0.1 -0.838 31.7-125.1-121.0 161.3 29.6 -10.4 -8.1 19 19 A D S S- 0 0 74 35,-1.2 2,-0.3 1,-0.3 36,-0.1 0.808 96.9 -6.2 -74.9 -26.1 27.9 -8.0 -10.6 20 20 A S - 0 0 9 34,-0.3 2,-0.3 2,-0.0 -1,-0.3 -0.965 64.1-171.4-164.4 147.2 31.4 -6.9 -11.7 21 21 A A - 0 0 32 -2,-0.3 20,-0.2 20,-0.2 5,-0.1 -0.915 19.7-134.4-151.2 120.7 35.0 -7.5 -10.6 22 22 A Q > - 0 0 23 18,-2.6 3,-1.5 3,-0.4 18,-0.2 -0.378 42.2 -96.1 -63.0 147.1 38.2 -6.0 -11.6 23 23 A S T 3 S+ 0 0 108 1,-0.3 -1,-0.1 2,-0.1 0, 0.0 -0.489 116.4 26.5 -65.8 136.4 41.1 -8.4 -12.3 24 24 A G T 3 S+ 0 0 46 -2,-0.2 -1,-0.3 -3,-0.1 14,-0.2 0.016 117.9 66.6 93.7 -25.7 43.3 -8.7 -9.2 25 25 A N S < S+ 0 0 25 -3,-1.5 15,-1.8 15,-0.2 -3,-0.4 -0.383 78.0 172.4-120.7 52.1 40.2 -7.8 -7.2 26 26 A E > - 0 0 61 13,-0.2 3,-2.3 -5,-0.1 4,-0.3 -0.141 47.1-107.3 -64.9 155.8 38.1 -10.9 -7.9 27 27 A a G > S+ 0 0 17 1,-0.3 3,-1.3 2,-0.2 12,-0.2 0.833 118.2 57.5 -49.2 -38.7 34.8 -11.7 -6.2 28 28 A N G > S+ 0 0 85 1,-0.3 3,-1.2 2,-0.2 -1,-0.3 0.510 82.4 83.3 -79.7 -1.1 36.5 -14.4 -4.2 29 29 A K G < S+ 0 0 54 -3,-2.3 3,-0.5 1,-0.2 5,-0.3 0.625 83.2 64.1 -71.5 -12.6 39.0 -12.0 -2.7 30 30 A A G < S+ 0 0 0 -3,-1.3 113,-3.1 -4,-0.3 -1,-0.2 0.541 107.8 39.2 -87.4 -7.7 36.3 -11.2 -0.2 31 31 A I S < S+ 0 0 27 -3,-1.2 -1,-0.2 111,-0.2 -2,-0.2 0.051 84.5 97.8-128.2 27.4 36.3 -14.7 1.3 32 32 A D S S- 0 0 72 -3,-0.5 -2,-0.1 109,-0.3 3,-0.1 0.407 90.8-118.2 -96.3 2.5 40.0 -15.6 1.3 33 33 A G S S+ 0 0 53 1,-0.2 2,-0.5 108,-0.1 109,-0.1 0.676 77.5 121.2 71.9 15.9 40.5 -14.8 5.0 34 34 A N > - 0 0 68 -5,-0.3 3,-1.4 107,-0.3 -2,-0.2 -0.947 50.1-161.6-116.1 116.3 43.0 -12.0 4.1 35 35 A K T 3 S+ 0 0 129 -2,-0.5 39,-0.5 1,-0.3 -1,-0.1 0.564 90.3 60.6 -70.8 -8.5 42.2 -8.5 5.2 36 36 A D T 3 S+ 0 0 109 37,-0.1 2,-0.4 105,-0.1 -1,-0.3 0.526 94.8 70.3 -99.0 -6.7 44.6 -7.1 2.7 37 37 A T < + 0 0 34 -3,-1.4 2,-0.3 104,-0.2 -5,-0.1 -0.925 64.2 175.9-110.0 140.2 42.8 -8.5 -0.4 38 38 A F - 0 0 18 -2,-0.4 103,-0.3 -14,-0.2 2,-0.3 -0.981 32.8-116.6-142.2 149.0 39.5 -7.1 -1.5 39 39 A W E -K 140 0B 2 101,-2.5 101,-1.9 -2,-0.3 2,-0.3 -0.621 35.8-176.5 -75.3 144.1 36.9 -7.5 -4.2 40 40 A H E -K 139 0B 5 -15,-1.8 -18,-2.6 -2,-0.3 99,-0.2 -0.982 21.6-123.0-147.3 133.0 36.4 -4.2 -6.2 41 41 A T - 0 0 0 97,-2.1 -20,-0.2 -2,-0.3 96,-0.1 -0.149 54.0 -59.2 -69.9 171.1 33.9 -3.5 -9.0 42 42 A F + 0 0 57 4,-0.1 2,-0.3 -21,-0.1 -1,-0.2 -0.186 61.3 167.7 -52.7 135.8 35.0 -2.4 -12.5 43 43 A Y - 0 0 94 5,-0.1 2,-2.1 -3,-0.1 3,-0.2 -0.977 62.4 -19.5-152.0 146.0 37.0 0.9 -12.7 44 44 A G S > S+ 0 0 54 -2,-0.3 3,-2.0 1,-0.2 4,-0.1 -0.433 129.5 63.0 58.8 -84.4 39.0 2.6 -15.5 45 45 A A T 3 S+ 0 0 81 -2,-2.1 -1,-0.2 1,-0.3 3,-0.1 0.840 123.3 11.0 -18.6 -97.8 39.1 -0.8 -17.3 46 46 A N T 3 S- 0 0 109 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 -0.038 121.6-104.7 -85.5 32.5 35.5 -1.7 -18.1 47 47 A G < - 0 0 30 -3,-2.0 -1,-0.3 1,-0.2 -2,-0.0 -0.318 48.5 -61.3 75.2-161.8 34.6 1.9 -17.1 48 48 A D - 0 0 68 -5,-0.2 -1,-0.2 -3,-0.1 -5,-0.1 -0.591 49.3-164.1-125.2 69.8 33.0 2.8 -13.8 49 49 A P - 0 0 45 0, 0.0 -8,-0.0 0, 0.0 -2,-0.0 -0.316 22.5-130.0 -55.1 129.0 29.6 1.2 -13.6 50 50 A K - 0 0 161 1,-0.1 87,-0.1 87,-0.1 80,-0.1 -0.316 39.5 -59.4 -78.0 163.5 27.6 2.9 -10.8 51 51 A P S S+ 0 0 32 0, 0.0 2,-0.2 0, 0.0 78,-0.1 -0.336 84.0 95.7 -72.0 168.8 25.9 1.1 -8.0 52 52 A P + 0 0 79 0, 0.0 2,-0.3 0, 0.0 77,-0.2 0.246 60.9 176.9 -67.3 143.5 23.9 -0.9 -7.1 53 53 A H E - C 0 128A 1 75,-2.2 75,-3.6 -2,-0.2 2,-0.4 -0.934 15.0-142.9-119.2 149.8 26.6 -3.5 -7.0 54 54 A T E - C 0 127A 31 -2,-0.3 -35,-1.2 73,-0.2 2,-0.6 -0.937 17.9-169.7-128.7 129.0 25.9 -7.0 -5.8 55 55 A Y E -BC 18 126A 1 71,-2.9 71,-2.9 -2,-0.4 2,-0.5 -0.943 17.7-174.6-111.9 111.7 27.6 -9.7 -3.8 56 56 A T E -BC 17 125A 19 -39,-3.4 -39,-3.0 -2,-0.6 2,-0.4 -0.905 4.0-166.4-113.5 131.1 25.9 -13.1 -3.9 57 57 A I E -BC 16 124A 0 67,-3.4 67,-2.2 -2,-0.5 2,-0.6 -0.948 10.8-162.3-118.9 129.5 27.0 -16.1 -1.8 58 58 A D E -BC 15 123A 28 -43,-3.6 -43,-2.5 -2,-0.4 65,-0.2 -0.952 3.7-170.5-107.1 112.5 25.9 -19.7 -2.3 59 59 A M E - 0 0 5 63,-3.1 2,-1.6 -2,-0.6 -46,-0.1 0.379 30.6-133.3 -87.9 4.8 26.8 -21.5 1.0 60 60 A K E S+ 0 0 91 62,-0.2 2,-0.3 -45,-0.1 -1,-0.1 -0.079 80.8 47.1 73.9 -38.0 26.0 -24.9 -0.6 61 61 A T E S- 0 0 83 -2,-1.6 2,-0.3 61,-0.2 -2,-0.1 -0.887 98.3 -84.7-131.5 163.1 23.9 -26.0 2.4 62 62 A T E - 0 0 93 -2,-0.3 2,-0.3 58,-0.1 60,-0.2 -0.503 46.2-174.7 -70.5 126.1 21.2 -24.5 4.6 63 63 A Q E - C 0 121A 35 58,-3.0 58,-2.3 -2,-0.3 2,-1.6 -0.900 34.5-121.9-118.7 150.7 22.5 -22.3 7.4 64 64 A N E - C 0 120A 46 -2,-0.3 84,-2.3 84,-0.3 2,-0.2 -0.649 44.7-162.0 -87.1 79.5 20.6 -20.7 10.3 65 65 A V E +DC 147 119A 0 -2,-1.6 54,-2.1 54,-1.2 82,-0.3 -0.429 29.9 162.2 -73.5 131.7 21.9 -17.2 9.2 66 66 A N E - 0 0 7 80,-2.5 50,-2.1 1,-0.3 -61,-0.3 0.194 62.0 -17.1-132.2 15.4 21.7 -14.4 11.8 67 67 A G E -DC 146 115A 0 79,-0.9 79,-2.6 48,-0.2 2,-0.3 -0.954 46.2-135.7 174.0 172.8 24.1 -11.9 10.3 68 68 A L E -DC 145 114A 1 46,-2.5 46,-2.7 -2,-0.3 2,-0.3 -0.969 13.6-149.4-140.4 161.1 26.9 -10.8 8.1 69 69 A S E -DC 144 113A 9 75,-2.1 75,-1.9 -2,-0.3 2,-0.4 -0.944 3.4-158.6-123.7 155.8 29.9 -8.7 8.5 70 70 A M E -DC 143 112A 2 42,-3.1 42,-3.0 -2,-0.3 73,-0.2 -0.955 1.5-162.9-136.2 110.7 31.7 -6.5 5.9 71 71 A L E -D 142 0A 30 71,-3.0 70,-2.3 -2,-0.4 71,-1.6 -0.879 20.9-140.1 -94.4 117.3 35.3 -5.5 6.4 72 72 A P - 0 0 2 0, 0.0 68,-0.2 0, 0.0 9,-0.1 -0.242 40.5 -69.7 -69.2 162.7 36.1 -2.6 4.1 73 73 A R - 0 0 21 6,-0.2 3,-0.2 66,-0.1 -37,-0.1 -0.223 42.3-155.1 -52.1 146.3 39.4 -2.4 2.3 74 74 A Q + 0 0 68 -39,-0.5 -1,-0.1 1,-0.1 4,-0.1 0.082 66.1 99.2-116.3 19.7 42.2 -1.7 4.8 75 75 A D S S- 0 0 87 2,-0.3 -1,-0.1 -39,-0.0 3,-0.1 0.239 101.4-100.3 -96.3 12.8 44.7 -0.1 2.5 76 76 A G S S+ 0 0 83 1,-0.3 2,-0.4 -3,-0.2 -2,-0.1 0.411 89.0 118.1 86.3 -2.9 43.9 3.5 3.4 77 77 A N - 0 0 63 1,-0.1 -1,-0.3 2,-0.1 -2,-0.3 -0.832 51.5-158.6-100.0 135.8 41.8 4.1 0.3 78 78 A Q > + 0 0 74 -2,-0.4 3,-2.0 -3,-0.1 54,-0.2 0.553 48.2 127.4 -88.7 -9.3 38.1 4.9 0.8 79 79 A N T 3 S+ 0 0 41 1,-0.3 -6,-0.2 59,-0.1 3,-0.1 -0.279 75.8 14.4 -59.8 121.3 36.9 3.8 -2.7 80 80 A G T 3 S+ 0 0 0 1,-0.3 59,-2.1 57,-0.3 -1,-0.3 0.456 74.9 158.1 96.7 0.9 34.0 1.4 -2.5 81 81 A W < - 0 0 39 -3,-2.0 51,-3.4 57,-0.2 2,-0.3 -0.443 47.2-120.4 -53.4 125.6 33.0 1.8 1.1 82 82 A I B +L 131 0C 4 57,-0.3 49,-0.2 49,-0.3 23,-0.2 -0.603 40.4 169.1 -79.7 129.3 29.4 0.6 1.1 83 83 A G + 0 0 5 47,-3.0 22,-1.8 1,-0.4 48,-0.1 0.672 62.7 24.5-100.2 -98.3 26.9 3.2 2.2 84 84 A R E S+E 104 0A 87 20,-0.2 46,-1.7 47,-0.1 45,-1.5 -0.458 81.9 158.9 -68.1 142.4 23.3 2.4 1.6 85 85 A H E -EF 103 128A 2 18,-2.3 18,-1.9 43,-0.3 2,-0.3 -0.984 31.7-149.1-160.9 164.6 22.7 -1.4 1.4 86 86 A E E -EF 102 127A 49 41,-1.9 41,-3.0 -2,-0.3 2,-0.5 -0.988 10.3-148.7-139.5 145.4 20.3 -4.3 1.6 87 87 A V E -EF 101 126A 0 14,-3.0 13,-2.7 -2,-0.3 14,-1.1 -0.979 17.5-173.2-115.8 126.8 20.8 -7.9 2.7 88 88 A Y E - 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