==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-JUL-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 12-JUN-12 3VTZ . COMPND 2 MOLECULE: GLUCOSE 1-DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOPLASMA VOLCANIUM; . AUTHOR Y.YASUTAKE,T.NISHIOKA,T.TAMURA . 1010 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34238.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 777 76.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 144 14.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 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 . 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 . 73 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 107 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 387 38.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 19 1.9 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 9 9 0 2 4 0 4 0 0 0 4 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 9 0 4 14 2 4 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 4 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 2 A E > 0 0 149 0, 0.0 3,-1.4 0, 0.0 27,-0.1 0.000 360.0 360.0 360.0 -66.7 -12.4 46.5 -13.7 2 3 A E T 3 + 0 0 62 1,-0.3 27,-0.2 3,-0.0 225,-0.1 0.830 360.0 42.6 -63.4 -30.7 -15.6 44.5 -13.1 3 4 A F T > S+ 0 0 4 25,-2.7 3,-3.1 22,-0.1 28,-0.3 0.326 77.5 146.3 -98.2 8.3 -15.5 44.7 -9.3 4 5 A T T < S+ 0 0 77 -3,-1.4 26,-0.2 24,-0.4 3,-0.1 -0.164 78.5 8.2 -47.2 125.4 -14.5 48.4 -9.0 5 6 A D T 3 S+ 0 0 131 24,-0.6 -1,-0.3 1,-0.3 2,-0.3 0.503 104.8 122.5 75.7 2.2 -16.2 49.8 -5.9 6 7 A K < - 0 0 42 -3,-3.1 25,-3.0 23,-0.2 2,-0.4 -0.674 51.9-143.9 -93.1 154.1 -17.4 46.4 -4.8 7 8 A V E -a 31 0A 4 -2,-0.3 66,-2.0 23,-0.2 67,-1.9 -0.962 14.5-172.3-120.9 134.1 -16.5 44.8 -1.5 8 9 A A E -ab 32 74A 0 23,-2.4 25,-3.4 -2,-0.4 2,-0.5 -0.965 13.1-152.8-124.0 140.5 -15.8 41.1 -0.9 9 10 A I E -ab 33 75A 2 65,-2.4 67,-3.5 -2,-0.4 2,-0.5 -0.961 16.1-173.4-104.3 128.4 -15.3 39.1 2.3 10 11 A V E -ab 34 76A 0 23,-2.6 25,-2.6 -2,-0.5 3,-0.4 -0.988 7.6-154.7-125.1 123.7 -13.2 35.9 2.0 11 12 A T S S+ 0 0 0 65,-2.3 25,-0.2 -2,-0.5 4,-0.1 -0.482 79.3 33.5 -90.4 169.9 -12.7 33.4 4.8 12 13 A G S > S+ 0 0 12 23,-0.2 3,-1.6 -2,-0.2 6,-0.5 0.908 79.9 169.4 45.5 49.5 -9.8 31.1 5.2 13 14 A G T 3 + 0 0 2 22,-2.6 23,-0.2 -3,-0.4 9,-0.1 0.569 63.7 51.6 -74.2 -15.6 -8.0 34.0 3.6 14 15 A S T 3 S+ 0 0 52 21,-0.2 -1,-0.3 4,-0.1 2,-0.2 0.201 88.4 103.5-103.0 13.1 -4.4 32.8 4.3 15 16 A S S <> S- 0 0 55 -3,-1.6 4,-3.9 -4,-0.1 5,-0.3 -0.609 89.2-105.3 -77.4 154.8 -5.0 29.3 2.7 16 17 A G H > S+ 0 0 17 -2,-0.2 4,-2.1 2,-0.2 5,-0.2 0.928 122.9 39.4 -40.0 -60.8 -3.8 28.6 -0.8 17 18 A I H > S+ 0 0 22 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.958 118.0 47.5 -60.7 -48.8 -7.3 28.9 -2.2 18 19 A G H > S+ 0 0 0 -6,-0.5 4,-2.7 1,-0.2 -2,-0.2 0.915 111.0 52.9 -58.7 -45.4 -8.3 31.8 -0.1 19 20 A L H X S+ 0 0 61 -4,-3.9 4,-2.2 -7,-0.3 -1,-0.2 0.919 111.9 44.8 -59.4 -42.0 -5.1 33.6 -0.9 20 21 A A H X S+ 0 0 16 -4,-2.1 4,-2.6 -5,-0.3 -1,-0.2 0.853 110.5 53.5 -77.0 -31.5 -5.7 33.1 -4.6 21 22 A V H X S+ 0 0 0 -4,-2.8 4,-3.2 2,-0.2 5,-0.3 0.937 110.0 49.3 -60.4 -45.3 -9.4 34.2 -4.4 22 23 A V H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.963 113.2 45.7 -59.8 -51.4 -8.2 37.4 -2.7 23 24 A D H X S+ 0 0 60 -4,-2.2 4,-2.8 1,-0.2 5,-0.2 0.942 114.1 49.1 -58.5 -50.1 -5.6 38.1 -5.3 24 25 A A H X S+ 0 0 2 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.915 111.9 47.4 -56.3 -48.2 -8.1 37.4 -8.2 25 26 A L H <>S+ 0 0 0 -4,-3.2 5,-2.6 2,-0.2 -1,-0.2 0.841 112.8 49.7 -67.1 -29.4 -10.8 39.6 -6.7 26 27 A V H ><5S+ 0 0 41 -4,-2.3 3,-2.5 -5,-0.3 -2,-0.2 0.963 107.4 54.3 -69.9 -46.5 -8.3 42.4 -6.2 27 28 A R H 3<5S+ 0 0 143 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.856 107.8 51.6 -50.2 -41.7 -7.0 42.0 -9.9 28 29 A Y T 3<5S- 0 0 9 -4,-2.0 -25,-2.7 -5,-0.2 -24,-0.4 0.329 129.9 -95.4 -83.2 8.6 -10.6 42.4 -11.0 29 30 A G T < 5S+ 0 0 26 -3,-2.5 -24,-0.6 1,-0.2 -3,-0.2 0.307 74.4 138.4 108.2 -10.6 -11.0 45.6 -9.0 30 31 A A < - 0 0 8 -5,-2.6 2,-0.5 -26,-0.2 -1,-0.2 -0.263 53.8-127.3 -69.5 155.2 -12.6 44.7 -5.6 31 32 A K E -a 7 0A 110 -25,-3.0 -23,-2.4 -28,-0.3 2,-0.4 -0.882 38.8-154.5 -86.1 132.9 -11.8 45.9 -2.2 32 33 A V E -a 8 0A 0 -2,-0.5 13,-2.3 11,-0.3 14,-1.2 -0.937 16.3-159.8-119.8 132.5 -11.3 42.6 -0.3 33 34 A V E -ac 9 46A 0 -25,-3.4 -23,-2.6 -2,-0.4 2,-0.4 -0.955 16.7-148.7-107.9 124.0 -11.6 41.9 3.4 34 35 A S E -ac 10 47A 4 12,-2.7 14,-3.7 -2,-0.5 2,-0.4 -0.738 11.0-170.1 -92.5 138.7 -9.8 38.7 4.7 35 36 A V E + c 0 48A 2 -25,-2.6 -22,-2.6 -2,-0.4 2,-0.3 -0.999 26.9 129.6-123.5 129.9 -11.0 36.6 7.5 36 37 A S E - c 0 49A 9 12,-2.0 14,-1.3 -2,-0.4 43,-0.0 -0.954 64.8-109.2-160.1 172.3 -8.7 33.9 9.0 37 38 A L S S+ 0 0 112 -2,-0.3 12,-0.1 12,-0.2 14,-0.1 0.656 95.9 82.9 -73.9 -20.7 -7.3 32.5 12.3 38 39 A D 0 0 93 1,-0.1 -2,-0.2 10,-0.1 -25,-0.1 -0.105 360.0 360.0 -82.7 179.9 -3.9 33.9 11.2 39 40 A E 0 0 179 10,-0.1 -1,-0.1 -25,-0.0 -2,-0.1 -0.663 360.0 360.0 -88.1 360.0 -2.2 37.2 11.3 40 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 41 43 A D > 0 0 90 0, 0.0 3,-1.3 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 90.2 -1.1 39.4 2.4 42 44 A V T 3 + 0 0 146 1,-0.3 3,-0.0 3,-0.1 5,-0.0 -0.448 360.0 91.7 -99.2 58.5 -1.5 43.2 1.8 43 45 A N T 3 S+ 0 0 72 -2,-0.7 -11,-0.3 3,-0.0 -1,-0.3 0.436 76.4 88.4 -81.7 -30.8 -3.5 42.8 -1.3 44 46 A V S < S- 0 0 13 -3,-1.3 -11,-0.2 1,-0.1 3,-0.1 -0.325 71.4-152.6 -71.5 143.3 -6.2 42.9 1.3 45 47 A S S S+ 0 0 45 -13,-2.3 2,-0.3 1,-0.3 -12,-0.2 0.638 82.8 10.0 -88.7 -11.3 -7.6 46.2 2.3 46 48 A D E -c 33 0A 41 -14,-1.2 -12,-2.7 2,-0.0 2,-0.4 -0.964 64.7-157.8-160.1 148.0 -8.6 44.8 5.7 47 49 A H E -c 34 0A 61 -2,-0.3 2,-0.6 -14,-0.2 -12,-0.2 -0.983 1.6-161.5-132.4 132.1 -8.0 41.7 7.7 48 50 A F E -c 35 0A 34 -14,-3.7 -12,-2.0 -2,-0.4 2,-1.3 -0.943 7.6-157.0-114.0 115.4 -10.0 40.1 10.6 49 51 A K E +c 36 0A 116 -2,-0.6 2,-0.3 -14,-0.2 -12,-0.2 -0.765 50.1 128.3 -88.6 89.5 -8.2 37.5 12.7 50 52 A I - 0 0 19 -2,-1.3 2,-0.6 -14,-1.3 -12,-0.1 -0.855 63.6-110.7-139.7 168.1 -11.3 35.8 14.0 51 53 A D > - 0 0 33 -2,-0.3 3,-1.9 3,-0.1 7,-0.3 -0.948 19.7-146.5-105.9 123.9 -12.9 32.4 14.3 52 54 A V T 3 S+ 0 0 10 -2,-0.6 56,-0.2 1,-0.3 57,-0.1 0.633 97.8 61.6 -65.2 -15.7 -15.9 31.9 12.0 53 55 A T T 3 S+ 0 0 12 55,-0.1 2,-0.9 1,-0.1 -1,-0.3 0.545 84.3 87.1 -84.9 -6.3 -17.5 29.7 14.6 54 56 A N <> - 0 0 60 -3,-1.9 4,-2.3 1,-0.2 3,-0.5 -0.818 65.4-161.2 -98.3 101.1 -17.7 32.6 17.1 55 57 A E H > S+ 0 0 46 -2,-0.9 4,-2.9 1,-0.2 5,-0.2 0.856 87.1 53.2 -49.3 -45.4 -20.9 34.4 16.4 56 58 A E H > S+ 0 0 148 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.861 110.6 47.4 -65.6 -35.8 -19.9 37.6 18.2 57 59 A E H > S+ 0 0 61 -3,-0.5 4,-2.5 2,-0.2 -1,-0.2 0.934 112.7 48.9 -65.8 -47.8 -16.6 37.9 16.2 58 60 A V H X S+ 0 0 0 -4,-2.3 4,-2.8 -7,-0.3 5,-0.3 0.967 112.4 48.3 -53.6 -56.7 -18.5 37.2 12.9 59 61 A K H X S+ 0 0 85 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.900 112.7 48.8 -48.6 -51.3 -21.1 39.9 13.8 60 62 A E H X S+ 0 0 104 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.887 112.0 47.8 -63.3 -37.1 -18.4 42.4 14.8 61 63 A A H X S+ 0 0 6 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.908 113.3 46.5 -73.1 -43.1 -16.4 41.9 11.6 62 64 A V H X S+ 0 0 7 -4,-2.8 4,-2.5 -5,-0.2 -2,-0.2 0.944 114.6 49.3 -61.3 -43.8 -19.4 42.1 9.3 63 65 A E H X S+ 0 0 83 -4,-2.6 4,-2.0 -5,-0.3 -2,-0.2 0.864 112.3 46.3 -65.2 -41.7 -20.5 45.3 11.2 64 66 A K H X S+ 0 0 123 -4,-2.5 4,-1.1 -5,-0.2 -1,-0.2 0.860 111.9 52.6 -68.4 -35.6 -17.0 46.9 11.0 65 67 A T H >X S+ 0 0 2 -4,-2.2 4,-2.8 2,-0.2 3,-0.5 0.957 110.5 46.1 -63.9 -49.9 -16.8 46.0 7.3 66 68 A T H 3X S+ 0 0 33 -4,-2.5 4,-4.0 1,-0.3 -2,-0.2 0.925 111.7 51.2 -64.2 -46.1 -20.2 47.6 6.4 67 69 A K H 3< S+ 0 0 178 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.731 114.9 44.8 -57.3 -27.5 -19.5 50.8 8.4 68 70 A K H << S+ 0 0 125 -4,-1.1 -2,-0.2 -3,-0.5 -1,-0.2 0.889 133.1 15.6 -82.2 -44.6 -16.2 51.2 6.6 69 71 A Y H < S- 0 0 46 -4,-2.8 -3,-0.2 -5,-0.1 -2,-0.2 0.656 86.9-131.7-109.3 -20.4 -17.4 50.4 3.1 70 72 A G S < S+ 0 0 60 -4,-4.0 2,-0.3 -5,-0.4 -4,-0.2 0.488 80.7 46.7 84.6 6.0 -21.2 50.8 3.2 71 73 A R - 0 0 60 -6,-0.3 2,-0.3 -5,-0.1 -2,-0.1 -0.980 54.7-155.1-173.9 148.0 -21.6 47.5 1.4 72 74 A I + 0 0 0 -2,-0.3 -64,-0.2 41,-0.1 48,-0.1 -0.904 20.7 168.8-134.1 109.9 -20.7 43.8 1.0 73 75 A D + 0 0 0 -66,-2.0 51,-1.9 -2,-0.3 2,-0.4 0.784 64.7 33.7 -87.4 -26.6 -21.2 42.6 -2.6 74 76 A I E -bd 8 124A 3 -67,-1.9 -65,-2.4 49,-0.2 2,-0.4 -0.996 55.6-172.5-142.4 128.9 -19.5 39.3 -2.4 75 77 A L E -bd 9 125A 0 49,-1.8 51,-3.0 -2,-0.4 2,-0.6 -0.991 4.9-168.3-120.3 128.7 -19.0 36.6 0.3 76 78 A V E -bd 10 126A 0 -67,-3.5 -65,-2.3 -2,-0.4 2,-0.8 -0.947 9.3-156.3-116.6 110.7 -16.6 33.6 -0.3 77 79 A N E + d 0 127A 2 49,-2.7 51,-3.4 -2,-0.6 29,-0.1 -0.819 37.7 142.5 -86.6 112.1 -17.0 30.9 2.4 78 80 A N + 0 0 18 -2,-0.8 2,-0.3 49,-0.2 -60,-0.2 0.247 22.0 120.4-137.2 6.2 -13.7 29.1 2.3 79 81 A A + 0 0 17 22,-0.1 2,-0.3 -3,-0.1 27,-0.1 -0.658 36.1 149.1 -77.9 134.1 -12.9 28.3 5.9 80 82 A G - 0 0 41 -2,-0.3 2,-0.3 25,-0.1 18,-0.1 -0.973 30.4-157.9-164.0 143.3 -12.5 24.5 6.3 81 83 A I - 0 0 66 -2,-0.3 2,-0.3 17,-0.2 21,-0.1 -0.940 12.4-150.9-124.3 154.8 -10.6 22.0 8.4 82 84 A E - 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0 0 6 -68,-0.3 -66,-3.1 -81,-0.1 2,-0.6 -0.654 51.5-144.3 -99.2 156.1 -18.8 19.3 -15.9 999 238 D C E -f 932 0L 20 -2,-0.2 2,-0.7 -68,-0.2 -66,-0.2 -0.982 16.4-161.9-113.1 107.9 -22.5 20.2 -16.4 1000 239 D L E -f 933 0L 2 -68,-3.9 -66,-3.1 -2,-0.6 2,-0.3 -0.874 8.6-146.8 -95.6 116.4 -23.1 23.9 -15.6 1001 240 D T E -f 934 0L 18 -2,-0.7 2,-0.2 -68,-0.2 -766,-0.1 -0.637 15.5-175.3 -80.0 138.4 -26.7 24.7 -15.0 1002 241 D V E +f 935 0L 0 -68,-1.9 -66,-2.3 -2,-0.3 -770,-0.2 -0.738 44.4 122.8-127.9 72.6 -27.8 28.2 -16.2 1003 242 D D S > S- 0 0 2 -68,-0.3 3,-2.5 -2,-0.2 -66,-0.2 0.127 81.3-111.6-132.8 18.7 -31.3 27.9 -14.8 1004 243 D G T 3 S- 0 0 0 -773,-2.8 -33,-2.0 1,-0.3 -32,-0.2 0.737 83.2 -58.0 55.7 21.0 -31.9 30.7 -12.3 1005 244 D G T > S+ 0 0 0 -774,-0.3 3,-1.2 -772,-0.3 4,-0.4 0.465 97.2 138.1 94.3 3.9 -32.0 28.0 -9.7 1006 245 D L G X S+ 0 0 4 -3,-2.5 3,-1.2 1,-0.3 -2,-0.1 0.857 70.5 49.7 -54.3 -48.8 -34.8 25.8 -11.1 1007 246 D L G 3 S+ 0 0 44 1,-0.2 -1,-0.3 -251,-0.1 -773,-0.1 0.629 109.1 52.0 -61.4 -25.2 -33.1 22.4 -10.5 1008 247 D S G < S+ 0 0 10 -3,-1.2 -363,-3.2 -775,-0.2 2,-0.6 0.336 92.9 98.2 -94.6 5.3 -32.2 23.2 -6.8 1009 248 D K B < -x 645 0I 51 -3,-1.2 -363,-0.2 -4,-0.4 -853,-0.0 -0.825 61.4-155.0 -96.5 118.3 -35.9 24.2 -6.2 1010 249 D L - 0 0 8 -365,-4.2 2,-1.9 -2,-0.6 -363,-0.3 -0.817 16.6-142.7 -88.2 114.8 -38.3 21.7 -4.6 1011 250 D P + 0 0 28 0, 0.0 2,-0.4 0, 0.0 -365,-0.1 -0.283 64.6 108.3 -78.4 53.6 -41.8 22.8 -5.7 1012 251 D I S S- 0 0 20 -2,-1.9 -365,-0.4 -298,-0.0 -2,-0.1 -0.998 70.2-120.5-130.9 122.9 -43.6 22.0 -2.5 1013 252 D S - 0 0 40 -2,-0.4 -317,-0.1 -367,-0.1 -367,-0.0 -0.207 25.7-160.6 -69.4 165.5 -44.8 25.0 -0.4 1014 253 D T - 0 0 14 -318,-0.1 2,-0.1 -319,-0.1 -366,-0.1 -0.887 30.6 -92.2-146.8 145.6 -43.6 25.6 3.1 1015 254 D P - 0 0 2 0, 0.0 2,-1.2 0, 0.0 -319,-0.1 -0.508 30.6-138.8 -61.0 139.9 -45.0 27.7 6.1 1016 255 D N 0 0 139 -321,-0.2 -368,-0.1 1,-0.2 -422,-0.0 -0.624 360.0 360.0 -97.3 74.4 -43.3 31.1 5.9 1017 256 D A 0 0 84 -2,-1.2 -424,-0.3 -369,-0.2 -1,-0.2 -0.229 360.0 360.0-170.7 360.0 -43.0 31.0 9.7