==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 12-MAR-07 2EIC . COMPND 2 MOLECULE: GALACTOSE OXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GIBBERELLA ZEAE; . AUTHOR N.AKYUMANI,S.TAMBER,S.J.FIRBANK,P.F.KNOWLES,S.E.PHILLIPS, . 639 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21672.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 388 60.7 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 . 215 33.6 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 . 0 0.0 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 . 61 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 7.2 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 . 3 0.5 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 4 6 13 7 5 0 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 56 0, 0.0 520,-1.0 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 170.7 33.4 -1.3 17.5 2 2 A S - 0 0 12 518,-0.2 520,-0.1 109,-0.1 518,-0.1 -0.552 360.0-137.1-134.6-159.0 30.4 -3.6 17.4 3 3 A A - 0 0 35 518,-0.4 2,-0.3 -2,-0.2 110,-0.1 -0.988 15.2-109.1-166.8 157.8 29.7 -7.3 17.1 4 4 A P - 0 0 37 0, 0.0 63,-0.1 0, 0.0 111,-0.1 -0.679 24.2-132.0 -90.7 151.9 27.6 -10.1 15.4 5 5 A I S S+ 0 0 53 61,-0.3 2,-0.2 -2,-0.3 62,-0.1 0.639 85.8 37.9 -80.3 -10.5 25.0 -12.0 17.4 6 6 A G S S- 0 0 18 142,-0.1 2,-0.3 143,-0.0 142,-0.2 -0.621 90.5 -85.0-128.5-175.2 26.2 -15.4 16.1 7 7 A S E -A 147 0A 71 140,-2.1 140,-2.3 -2,-0.2 59,-0.1 -0.710 49.7 -94.1 -97.5 148.2 29.3 -17.3 15.2 8 8 A A E -A 146 0A 55 -2,-0.3 2,-0.3 138,-0.2 138,-0.2 -0.206 34.2-129.0 -60.2 142.1 31.1 -17.2 11.8 9 9 A I - 0 0 6 136,-2.1 2,-0.4 1,-0.1 136,-0.3 -0.681 31.6-101.3 -91.4 143.9 30.3 -19.8 9.2 10 10 A S - 0 0 82 -2,-0.3 3,-0.3 1,-0.1 4,-0.2 -0.587 28.2-158.2 -67.7 123.1 33.2 -21.7 7.6 11 11 A R + 0 0 43 -2,-0.4 -1,-0.1 1,-0.2 20,-0.0 0.206 61.6 104.3 -89.8 16.9 33.8 -20.1 4.2 12 12 A N S S+ 0 0 143 1,-0.2 -1,-0.2 47,-0.0 19,-0.0 0.958 84.4 33.7 -64.2 -58.6 35.6 -23.2 2.7 13 13 A N S S+ 0 0 123 -3,-0.3 -1,-0.2 46,-0.1 -2,-0.1 0.693 93.8 127.6 -72.8 -21.3 33.0 -24.7 0.4 14 14 A W - 0 0 20 -4,-0.2 2,-0.4 45,-0.1 45,-0.2 0.160 46.4-152.3 -39.9 150.1 31.4 -21.3 -0.6 15 15 A A E -B 58 0A 34 43,-1.8 43,-3.1 2,-0.0 2,-0.3 -0.998 16.0-161.0-129.6 123.1 30.8 -20.0 -4.1 16 16 A V E -B 57 0A 33 -2,-0.4 2,-0.3 41,-0.2 41,-0.2 -0.861 8.9-171.6-115.1 146.3 30.8 -16.3 -4.7 17 17 A T E -B 56 0A 87 39,-2.3 39,-2.0 -2,-0.3 2,-0.3 -0.953 1.2-173.7-132.3 150.4 29.4 -14.0 -7.5 18 18 A a E -B 55 0A 26 -2,-0.3 37,-0.2 37,-0.2 3,-0.2 -0.942 31.9-129.7-140.0 155.7 29.8 -10.3 -8.2 19 19 A D S S- 0 0 78 35,-0.9 2,-0.3 1,-0.3 -1,-0.1 0.904 98.2 -0.3 -73.7 -36.7 28.2 -8.0 -10.8 20 20 A S + 0 0 7 34,-0.2 -1,-0.3 -3,-0.1 2,-0.3 -0.990 64.2 179.4-151.8 142.7 31.7 -6.7 -11.7 21 21 A A - 0 0 34 -2,-0.3 2,-0.3 20,-0.2 20,-0.2 -0.830 22.0-139.4-151.7 107.9 35.1 -7.6 -10.5 22 22 A Q > - 0 0 24 18,-2.2 3,-2.9 -2,-0.3 18,-0.2 -0.527 41.4 -92.4 -69.8 133.5 38.3 -6.0 -11.9 23 23 A S T 3 S+ 0 0 103 1,-0.3 -1,-0.1 -2,-0.3 0, 0.0 -0.138 117.9 31.5 -45.3 127.7 41.2 -8.5 -12.3 24 24 A G T 3 S+ 0 0 44 -3,-0.1 14,-0.3 13,-0.0 -1,-0.3 0.117 115.0 63.3 104.9 -20.0 43.2 -8.4 -9.1 25 25 A N S < S+ 0 0 20 -3,-2.9 15,-1.9 15,-0.2 -3,-0.2 -0.308 79.7 178.0-128.8 45.0 40.2 -7.6 -7.0 26 26 A E > - 0 0 69 13,-0.2 3,-2.1 -5,-0.1 4,-0.4 0.032 44.4-108.9 -51.6 156.5 38.2 -10.8 -7.7 27 27 A a G > S+ 0 0 16 1,-0.3 3,-1.4 2,-0.2 12,-0.2 0.902 120.5 55.7 -53.2 -41.5 34.9 -11.6 -6.1 28 28 A N G > S+ 0 0 84 1,-0.3 3,-1.2 2,-0.2 -1,-0.3 0.509 82.5 82.9 -73.1 -6.8 36.7 -14.3 -4.0 29 29 A K G X S+ 0 0 54 -3,-2.1 3,-0.9 1,-0.2 5,-0.3 0.793 85.0 64.1 -65.8 -24.2 39.1 -11.8 -2.6 30 30 A A G < S+ 0 0 0 -3,-1.4 113,-2.6 -4,-0.4 -1,-0.2 0.653 109.0 34.9 -73.2 -18.7 36.3 -11.0 -0.1 31 31 A I G < S+ 0 0 26 -3,-1.2 -1,-0.2 111,-0.2 -2,-0.2 0.036 86.7 101.1-124.3 26.7 36.3 -14.5 1.4 32 32 A D S < S- 0 0 70 -3,-0.9 -2,-0.1 109,-0.3 -1,-0.1 0.537 88.9-118.7 -89.4 -5.9 40.0 -15.3 1.3 33 33 A G S S+ 0 0 53 1,-0.2 2,-0.6 -4,-0.2 109,-0.1 0.417 79.9 115.6 84.6 -3.5 40.8 -14.5 4.9 34 34 A N > - 0 0 72 -5,-0.3 3,-1.1 107,-0.2 -2,-0.2 -0.894 51.6-161.8-105.2 120.1 43.3 -11.8 3.9 35 35 A K T 3 S+ 0 0 98 -2,-0.6 39,-0.6 1,-0.2 107,-0.1 0.359 87.7 62.8 -81.7 7.9 42.3 -8.3 4.9 36 36 A D T 3 S+ 0 0 122 37,-0.1 2,-0.4 105,-0.1 -1,-0.2 0.478 94.6 69.3-105.3 -10.1 44.8 -6.8 2.4 37 37 A T < + 0 0 37 -3,-1.1 2,-0.3 -8,-0.2 -5,-0.1 -0.876 65.9 176.6-109.3 143.4 43.0 -8.2 -0.6 38 38 A F - 0 0 20 -2,-0.4 103,-0.3 -14,-0.3 2,-0.2 -0.997 33.8-112.7-149.9 150.6 39.5 -7.0 -1.6 39 39 A W E -K 140 0B 1 101,-2.5 101,-1.0 -2,-0.3 2,-0.3 -0.540 38.8-177.5 -76.1 147.4 36.8 -7.4 -4.2 40 40 A H E -K 139 0B 5 -15,-1.9 -18,-2.2 99,-0.2 99,-0.2 -0.951 22.5-122.6-151.8 132.3 36.4 -4.2 -6.3 41 41 A T - 0 0 0 97,-1.3 -20,-0.2 -2,-0.3 96,-0.1 -0.169 52.8 -63.7 -68.8 165.5 34.0 -3.5 -9.1 42 42 A F + 0 0 69 4,-0.1 2,-0.3 -21,-0.1 -1,-0.2 -0.070 64.8 164.7 -47.3 151.8 35.1 -2.5 -12.6 43 43 A Y > - 0 0 89 5,-0.1 3,-0.8 -3,-0.1 2,-0.8 -0.915 44.2 -3.1-172.7 146.1 37.0 0.8 -12.9 44 44 A G G > S+ 0 0 51 -2,-0.3 3,-1.0 1,-0.3 4,-0.1 -0.618 131.3 20.6 75.4-107.4 39.2 2.8 -15.2 45 45 A A G 3 S+ 0 0 105 -2,-0.8 -1,-0.3 1,-0.3 3,-0.1 0.718 129.5 47.4 -67.8 -28.6 39.7 0.7 -18.3 46 46 A N G < S- 0 0 88 -3,-0.8 -1,-0.3 1,-0.4 -2,-0.2 0.378 122.8-110.1 -91.9 3.8 36.7 -1.6 -17.8 47 47 A G < - 0 0 29 -3,-1.0 -1,-0.4 1,-0.1 -2,-0.1 -0.167 27.1 -86.7 89.0 171.5 34.7 1.6 -17.2 48 48 A D - 0 0 73 -5,-0.2 2,-0.2 -3,-0.1 -5,-0.1 -0.649 41.9-163.7-116.3 72.5 33.3 2.8 -13.9 49 49 A P - 0 0 46 0, 0.0 -8,-0.1 0, 0.0 -29,-0.0 -0.404 22.1-130.7 -59.5 118.9 29.9 1.1 -13.6 50 50 A K - 0 0 163 -2,-0.2 87,-0.1 1,-0.1 80,-0.1 -0.169 40.1 -54.3 -66.2 164.3 28.1 3.0 -10.9 51 51 A P S S+ 0 0 35 0, 0.0 2,-0.2 0, 0.0 78,-0.1 -0.316 83.8 91.9 -71.4 166.1 26.3 1.3 -8.0 52 52 A P + 0 0 77 0, 0.0 2,-0.4 0, 0.0 77,-0.2 0.372 59.4 178.7 -62.5 153.4 24.2 -0.7 -7.1 53 53 A H E - C 0 128A 1 75,-1.3 75,-3.2 -2,-0.2 2,-0.4 -0.984 13.8-144.8-131.7 141.9 26.8 -3.5 -6.9 54 54 A T E - C 0 127A 36 -2,-0.4 -35,-0.9 73,-0.2 2,-0.6 -0.928 15.2-171.9-121.2 135.2 25.9 -7.1 -5.7 55 55 A Y E -BC 18 126A 1 71,-1.9 71,-2.5 -2,-0.4 2,-0.3 -0.935 16.8-175.7-121.9 106.4 27.8 -9.7 -3.7 56 56 A T E -BC 17 125A 17 -39,-2.0 -39,-2.3 -2,-0.6 2,-0.4 -0.816 6.1-162.6-107.0 143.2 26.1 -13.1 -3.7 57 57 A I E -BC 16 124A 1 67,-2.0 67,-1.8 -2,-0.3 2,-0.8 -0.985 12.2-162.3-129.7 127.8 27.2 -16.1 -1.7 58 58 A D E -BC 15 123A 32 -43,-3.1 -43,-1.8 -2,-0.4 65,-0.2 -0.900 5.0-170.5-105.6 100.8 26.2 -19.8 -2.1 59 59 A M E - 0 0 2 63,-2.6 2,-2.9 -2,-0.8 -45,-0.1 0.352 30.9-135.5 -73.6 7.9 27.2 -21.4 1.2 60 60 A K E S+ 0 0 86 62,-0.1 2,-0.2 -45,-0.1 -1,-0.2 -0.193 79.2 50.7 68.8 -48.5 26.4 -24.8 -0.6 61 61 A T E S- 0 0 80 -2,-2.9 2,-0.4 61,-0.2 -2,-0.2 -0.700 96.8 -89.5-116.7 167.4 24.5 -26.0 2.5 62 62 A T E + 0 0 86 -2,-0.2 2,-0.3 58,-0.1 60,-0.2 -0.638 45.2 178.0 -80.5 127.5 21.7 -24.7 4.7 63 63 A Q E - C 0 121A 36 58,-2.7 58,-2.4 -2,-0.4 2,-2.0 -0.965 38.8-115.8-130.4 145.9 22.8 -22.6 7.7 64 64 A N E - C 0 120A 47 -2,-0.3 84,-2.4 56,-0.2 86,-0.1 -0.530 45.5-162.3 -80.3 75.6 20.8 -20.8 10.5 65 65 A V E +DC 147 119A 0 -2,-2.0 54,-2.5 54,-0.8 82,-0.3 -0.338 29.9 159.4 -65.1 135.7 21.9 -17.3 9.5 66 66 A N E - 0 0 6 80,-2.3 50,-1.9 1,-0.3 -61,-0.3 0.228 62.3 -9.0-139.6 11.9 21.6 -14.4 11.9 67 67 A G E -DC 146 115A 0 79,-0.9 79,-3.9 48,-0.2 -1,-0.3 -0.943 48.7-143.4 169.0 166.9 24.1 -11.9 10.7 68 68 A L E -DC 145 114A 0 46,-2.0 46,-1.9 77,-0.3 2,-0.4 -0.977 11.0-145.4-147.3 159.3 27.0 -10.8 8.4 69 69 A S E -DC 144 113A 12 75,-2.3 75,-2.2 -2,-0.3 2,-0.4 -0.968 5.5-161.5-129.6 145.3 30.1 -8.6 8.7 70 70 A M E -DC 143 112A 3 42,-2.5 42,-3.1 -2,-0.4 73,-0.2 -0.995 3.5-160.9-130.3 124.3 31.7 -6.4 6.1 71 71 A L E -D 142 0A 17 71,-2.7 70,-2.2 -2,-0.4 71,-1.4 -0.939 16.2-140.5-108.5 117.8 35.3 -5.2 6.4 72 72 A P - 0 0 1 0, 0.0 68,-0.1 0, 0.0 2,-0.1 -0.040 41.7 -69.6 -65.0 172.1 36.3 -2.2 4.2 73 73 A R - 0 0 22 66,-0.4 3,-0.3 6,-0.2 -37,-0.1 -0.432 40.4-159.4 -66.9 137.0 39.6 -1.9 2.4 74 74 A Q + 0 0 69 -39,-0.6 -1,-0.1 1,-0.2 -38,-0.1 0.220 65.8 97.8-104.8 15.2 42.4 -1.3 5.0 75 75 A D S S- 0 0 97 2,-0.2 -1,-0.2 1,-0.1 3,-0.1 0.408 103.2 -98.7 -84.7 2.3 45.0 0.2 2.6 76 76 A G S S+ 0 0 79 1,-0.4 2,-0.3 -3,-0.3 -2,-0.1 0.374 88.9 113.7 98.1 -5.8 44.2 3.9 3.5 77 77 A N - 0 0 56 2,-0.1 -1,-0.4 1,-0.1 -2,-0.2 -0.745 55.2-152.0-100.1 148.9 41.9 4.6 0.5 78 78 A Q > + 0 0 98 -2,-0.3 3,-1.7 -3,-0.1 2,-0.1 0.583 54.1 122.8 -94.2 -14.6 38.2 5.3 0.8 79 79 A N T 3 S+ 0 0 52 1,-0.2 -6,-0.2 59,-0.1 59,-0.1 -0.294 75.0 21.0 -55.5 120.9 37.1 4.1 -2.6 80 80 A G T 3 S+ 0 0 0 1,-0.3 59,-2.0 57,-0.3 2,-0.3 0.459 76.5 150.3 103.0 -0.6 34.5 1.4 -2.3 81 81 A W < - 0 0 28 -3,-1.7 51,-2.5 57,-0.2 -1,-0.3 -0.548 46.2-124.4 -67.9 128.2 33.1 2.1 1.2 82 82 A I B +L 131 0C 5 -2,-0.3 49,-0.3 49,-0.3 3,-0.1 -0.534 35.7 168.1 -81.0 133.3 29.5 1.0 1.3 83 83 A G + 0 0 6 47,-2.5 22,-2.2 1,-0.5 -1,-0.1 0.641 64.7 23.7-102.8 -97.2 26.8 3.5 2.3 84 84 A R E S+E 104 0A 70 20,-0.2 46,-1.5 44,-0.1 45,-1.1 -0.454 80.3 156.7 -70.2 147.5 23.2 2.4 1.6 85 85 A H E -EF 103 128A 2 18,-1.8 18,-1.6 43,-0.2 2,-0.3 -0.983 31.0-147.3-164.2 170.8 22.7 -1.4 1.4 86 86 A E E -EF 102 127A 46 41,-1.5 41,-2.6 -2,-0.3 2,-0.4 -0.971 10.0-146.8-146.1 151.2 20.4 -4.3 1.7 87 87 A V E -EF 101 126A 0 14,-2.5 13,-2.4 -2,-0.3 14,-1.0 -0.985 17.3-171.1-127.0 120.1 20.8 -8.0 2.8 88 88 A Y E - 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