==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/INHIBITOR 04-JUL-12 4FYH . COMPND 2 MOLECULE: DEOXYRIBONUCLEOSIDE 5'-MONOPHOSPHATE N-GLYCOSIDAS . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR G.LABESSE,A.PADILLA,P.A.KAMINSKI . 509 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22257.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 344 67.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 77 15.1 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 . 4 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.8 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 . 22 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 170 33.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.8 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 4 0 0 0 0 4 0 3 4 1 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 0 7 5 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 . 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 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 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 9 A R 0 0 202 0, 0.0 2,-0.1 0, 0.0 30,-0.1 0.000 360.0 360.0 360.0 157.1 20.8 56.2 -15.1 2 10 A R - 0 0 82 28,-0.1 30,-2.6 1,-0.0 2,-0.4 -0.459 360.0-136.1 -70.9 141.4 18.3 56.0 -12.3 3 11 A S E -a 32 0A 18 50,-0.2 52,-1.9 28,-0.2 53,-1.7 -0.857 16.2-167.9-105.8 133.9 19.1 53.7 -9.4 4 12 A V E -ab 33 56A 0 28,-3.0 30,-2.2 -2,-0.4 2,-0.6 -0.980 7.6-156.7-121.9 130.6 16.7 51.3 -7.7 5 13 A Y E - b 0 57A 0 51,-2.4 53,-3.0 -2,-0.4 2,-0.5 -0.929 13.8-158.5-103.3 121.5 17.3 49.5 -4.4 6 14 A F E - b 0 58A 17 -2,-0.6 2,-0.4 51,-0.2 53,-0.2 -0.891 4.4-164.0-106.6 131.7 15.3 46.4 -4.0 7 15 A C E + b 0 59A 1 51,-2.7 53,-2.4 -2,-0.5 2,-0.3 -0.933 19.0 151.7-113.4 134.1 14.5 44.8 -0.6 8 16 A G - 0 0 15 -2,-0.4 53,-0.1 51,-0.2 -2,-0.0 -0.977 48.4 -86.0-156.0 150.8 13.2 41.3 0.1 9 17 A S + 0 0 0 51,-0.4 7,-0.1 -2,-0.3 56,-0.1 -0.253 47.7 154.4 -55.9 136.7 13.5 38.7 2.9 10 18 A I S > S+ 0 0 103 5,-0.0 3,-1.4 4,-0.0 -1,-0.1 0.467 80.3 24.6-120.2 -70.4 16.5 36.4 2.8 11 19 A R T 3 S+ 0 0 149 1,-0.3 209,-0.2 2,-0.1 3,-0.1 0.567 118.1 63.7 -76.8 -9.6 17.3 35.2 6.4 12 20 A G T 3 S- 0 0 16 1,-0.3 -1,-0.3 51,-0.1 2,-0.1 0.476 130.6 -59.6 -85.8 -3.7 13.6 35.7 7.3 13 21 A G < - 0 0 18 -3,-1.4 3,-0.3 50,-0.1 -1,-0.3 -0.142 34.3-131.3 126.7 135.1 12.6 33.1 4.8 14 22 A R > + 0 0 110 1,-0.2 3,-2.5 -3,-0.1 4,-0.2 0.250 64.8 124.1 -97.9 13.3 13.1 32.6 1.0 15 23 A E T 3 S+ 0 0 129 1,-0.3 3,-0.3 2,-0.1 -1,-0.2 0.744 78.0 43.1 -40.7 -36.1 9.4 31.7 0.4 16 24 A D T 3> S+ 0 0 17 -3,-0.3 4,-1.6 1,-0.2 3,-0.4 0.101 72.0 124.0-108.6 19.5 9.1 34.5 -2.2 17 25 A Q H <> S+ 0 0 104 -3,-2.5 4,-2.0 1,-0.2 3,-0.3 0.866 76.7 49.4 -41.1 -53.4 12.4 34.2 -4.1 18 26 A A H > S+ 0 0 77 -3,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.873 108.2 53.0 -59.7 -43.7 10.6 33.8 -7.5 19 27 A L H > S+ 0 0 18 -3,-0.4 4,-1.7 2,-0.2 -1,-0.2 0.789 107.7 52.1 -64.8 -31.3 8.4 36.9 -6.9 20 28 A Y H X S+ 0 0 9 -4,-1.6 4,-3.6 -3,-0.3 -2,-0.2 0.935 107.8 50.6 -69.2 -47.5 11.5 39.0 -6.2 21 29 A A H X S+ 0 0 59 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.881 110.0 51.6 -56.4 -41.6 13.2 37.9 -9.4 22 30 A R H X S+ 0 0 80 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.903 113.2 44.7 -58.3 -45.5 10.0 38.9 -11.2 23 31 A I H X S+ 0 0 0 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.937 112.2 50.7 -66.5 -49.0 10.1 42.3 -9.5 24 32 A V H X S+ 0 0 19 -4,-3.6 4,-1.9 1,-0.2 -2,-0.2 0.927 108.4 53.6 -54.7 -48.2 13.9 42.8 -10.2 25 33 A S H X S+ 0 0 84 -4,-2.5 4,-0.5 1,-0.2 3,-0.2 0.916 112.2 43.4 -51.1 -51.0 13.4 42.0 -13.9 26 34 A R H >< S+ 0 0 53 -4,-1.7 3,-0.8 1,-0.2 4,-0.5 0.829 110.2 56.7 -67.3 -33.9 10.7 44.6 -14.2 27 35 A L H >X S+ 0 0 0 -4,-2.4 3,-1.4 1,-0.2 4,-0.7 0.826 93.4 68.0 -66.7 -32.6 12.7 47.1 -12.2 28 36 A R H 3< S+ 0 0 110 -4,-1.9 3,-0.3 1,-0.3 -1,-0.2 0.765 94.5 59.3 -58.4 -26.9 15.6 46.8 -14.6 29 37 A R T << S+ 0 0 142 -3,-0.8 -1,-0.3 -4,-0.5 -2,-0.2 0.780 109.3 41.9 -68.9 -30.8 13.3 48.5 -17.2 30 38 A Y T <4 S- 0 0 40 -3,-1.4 2,-0.3 -4,-0.5 -2,-0.2 0.402 130.0 -41.8-102.6 1.0 13.0 51.6 -15.0 31 39 A G S < S- 0 0 1 -4,-0.7 2,-0.4 -3,-0.3 -1,-0.3 -0.898 78.7 -48.7 159.0 175.6 16.6 51.9 -13.8 32 40 A K E -a 3 0A 124 -30,-2.6 -28,-3.0 -2,-0.3 2,-0.7 -0.610 47.9-140.0 -75.1 127.1 19.7 50.1 -12.6 33 41 A V E -a 4 0A 6 -2,-0.4 -28,-0.2 -30,-0.2 -30,-0.1 -0.807 13.4-168.7 -91.1 114.9 19.0 47.6 -9.8 34 42 A L S S+ 0 0 12 -30,-2.2 2,-0.7 -2,-0.7 -29,-0.2 0.783 70.5 69.1 -76.4 -26.8 21.9 47.8 -7.3 35 43 A T 0 0 19 -31,-0.5 -1,-0.1 15,-0.1 -29,-0.0 -0.834 360.0 360.0 -99.5 110.4 20.9 44.7 -5.3 36 44 A E 0 0 191 -2,-0.7 -2,-0.1 -12,-0.0 -12,-0.0 -0.541 360.0 360.0 -74.6 360.0 21.4 41.5 -7.3 37 ! 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 38 60 A G > 0 0 101 0, 0.0 4,-0.8 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 -41.4 34.3 40.1 5.1 39 61 A G H > - 0 0 49 1,-0.2 4,-1.6 2,-0.2 3,-0.4 -0.195 360.0 -30.3 73.2-160.0 31.2 38.6 6.8 40 62 A D H > S+ 0 0 52 1,-0.2 4,-2.5 2,-0.2 187,-0.3 0.827 132.4 61.8 -65.1 -35.5 28.0 40.4 7.8 41 63 A Q H > S+ 0 0 124 -3,-0.4 4,-1.9 1,-0.2 -1,-0.2 0.863 104.8 48.1 -59.9 -40.9 29.9 43.7 8.4 42 64 A F H X S+ 0 0 113 -4,-0.8 4,-3.0 -3,-0.4 5,-0.3 0.925 110.5 51.8 -63.1 -46.7 30.9 43.9 4.8 43 65 A I H X S+ 0 0 66 -4,-1.6 4,-2.3 1,-0.2 -2,-0.2 0.913 111.6 46.2 -57.0 -46.5 27.3 43.1 3.6 44 66 A H H X S+ 0 0 13 -4,-2.5 4,-2.5 179,-0.3 -1,-0.2 0.899 114.4 47.6 -63.1 -43.6 25.9 45.9 5.8 45 67 A E H X S+ 0 0 117 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.910 113.0 47.3 -67.8 -43.5 28.5 48.4 4.6 46 68 A Q H X S+ 0 0 77 -4,-3.0 4,-1.9 1,-0.2 -2,-0.2 0.908 114.5 48.4 -61.4 -43.1 28.1 47.5 0.9 47 69 A N H X S+ 0 0 24 -4,-2.3 4,-2.4 -5,-0.3 -2,-0.2 0.886 108.4 51.6 -67.6 -40.8 24.2 47.8 1.3 48 70 A L H X S+ 0 0 8 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.910 109.0 53.0 -61.7 -40.2 24.3 51.1 3.1 49 71 A N H X S+ 0 0 75 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.921 110.6 45.5 -58.2 -48.1 26.4 52.5 0.3 50 72 A W H X S+ 0 0 65 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.860 110.2 55.2 -61.9 -38.8 24.0 51.3 -2.4 51 73 A L H < S+ 0 0 0 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.883 107.1 49.9 -63.7 -40.9 21.1 52.7 -0.3 52 74 A Q H < S+ 0 0 102 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.902 113.5 45.6 -62.3 -43.9 22.7 56.2 -0.2 53 75 A Q H < S+ 0 0 108 -4,-1.8 -50,-0.2 -5,-0.2 -2,-0.2 0.817 92.5 108.9 -65.2 -33.4 23.2 56.1 -4.1 54 76 A A < - 0 0 0 -4,-1.9 -50,-0.2 -5,-0.1 3,-0.1 -0.101 51.9-163.9 -57.3 139.3 19.7 54.8 -4.7 55 77 A D S S+ 0 0 73 -52,-1.9 2,-0.3 1,-0.3 -51,-0.2 0.801 80.0 14.3 -87.1 -35.9 17.1 57.2 -6.2 56 78 A V E -b 4 0A 0 -53,-1.7 -51,-2.4 24,-0.1 2,-0.5 -0.995 67.9-143.7-141.9 145.6 14.1 55.0 -5.2 57 79 A V E -bc 5 82A 0 24,-2.9 26,-2.0 -2,-0.3 2,-0.4 -0.943 14.4-172.7-112.4 127.7 13.6 52.1 -2.8 58 80 A V E -bc 6 83A 0 -53,-3.0 -51,-2.7 -2,-0.5 2,-0.4 -0.984 6.9-177.4-119.7 126.8 11.3 49.2 -3.6 59 81 A A E -bc 7 84A 0 24,-3.1 26,-2.8 -2,-0.4 2,-0.7 -0.985 25.8-148.4-128.2 135.1 10.5 46.5 -1.0 60 82 A E E + c 0 85A 0 -53,-2.4 -51,-0.4 -2,-0.4 3,-0.2 -0.910 24.6 178.7 -92.9 114.5 8.4 43.3 -1.1 61 83 A V + 0 0 0 24,-2.2 34,-0.2 -2,-0.7 25,-0.2 0.094 46.7 102.2-110.6 18.3 7.2 43.2 2.5 62 84 A T S S+ 0 0 3 23,-0.4 -1,-0.2 1,-0.1 24,-0.1 0.879 75.3 61.2 -72.1 -39.8 5.0 40.1 2.6 63 85 A Q S S- 0 0 14 -3,-0.2 -54,-0.2 -50,-0.1 -51,-0.1 -0.807 96.5-116.4 -91.8 121.4 7.6 37.9 4.3 64 86 A P + 0 0 19 0, 0.0 2,-0.3 0, 0.0 128,-0.1 -0.319 46.3 165.0 -61.3 136.5 8.6 39.2 7.8 65 87 A S > - 0 0 6 1,-0.1 4,-2.0 -4,-0.1 5,-0.2 -0.922 41.8-149.4-161.8 125.8 12.3 40.2 7.9 66 88 A L H > S+ 0 0 8 -2,-0.3 4,-2.5 2,-0.2 5,-0.1 0.919 102.6 51.7 -57.6 -48.5 14.6 42.2 10.1 67 89 A G H > S+ 0 0 5 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.903 109.2 47.8 -60.4 -48.0 16.8 43.3 7.2 68 90 A V H > S+ 0 0 1 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.930 113.9 47.9 -58.7 -49.1 14.0 44.6 5.0 69 91 A G H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.919 112.2 49.9 -56.5 -45.5 12.6 46.5 7.9 70 92 A Y H X S+ 0 0 1 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.918 110.2 49.6 -61.2 -47.6 16.0 47.9 8.8 71 93 A E H X S+ 0 0 15 -4,-2.7 4,-2.8 1,-0.2 -1,-0.2 0.879 111.2 49.7 -58.3 -42.3 16.6 49.0 5.1 72 94 A L H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.850 111.1 50.5 -66.2 -35.6 13.2 50.7 5.1 73 95 A G H X S+ 0 0 0 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.942 113.4 43.4 -67.9 -49.4 14.1 52.5 8.4 74 96 A R H X S+ 0 0 39 -4,-2.8 4,-1.3 1,-0.2 -2,-0.2 0.914 113.2 54.2 -58.2 -44.9 17.4 53.7 7.0 75 97 A A H X>S+ 0 0 0 -4,-2.8 5,-2.3 1,-0.2 4,-0.5 0.881 105.3 51.6 -59.5 -45.0 15.7 54.7 3.7 76 98 A V H ><5S+ 0 0 38 -4,-2.1 3,-1.3 1,-0.2 -1,-0.2 0.926 109.9 50.5 -55.7 -45.7 13.1 56.8 5.4 77 99 A A H 3<5S+ 0 0 51 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.739 107.7 52.2 -70.2 -23.9 15.8 58.7 7.3 78 100 A L H 3<5S- 0 0 73 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.510 116.1-117.7 -85.4 -7.1 17.8 59.4 4.1 79 101 A G T <<5 + 0 0 34 -3,-1.3 -3,-0.2 -4,-0.5 -2,-0.1 0.754 56.5 161.2 76.5 27.1 14.6 60.8 2.6 80 102 A K < - 0 0 40 -5,-2.3 2,-0.3 1,-0.1 -1,-0.2 -0.521 46.8-109.5 -76.6 143.0 14.3 58.2 -0.2 81 103 A P - 0 0 12 0, 0.0 -24,-2.9 0, 0.0 2,-0.4 -0.591 43.7-159.3 -66.4 134.0 11.1 57.6 -2.0 82 104 A I E -cd 57 107A 1 24,-2.6 26,-2.0 -2,-0.3 2,-0.4 -0.924 21.2-171.3-122.8 144.1 9.8 54.2 -1.0 83 105 A L E -cd 58 108A 0 -26,-2.0 -24,-3.1 -2,-0.4 2,-0.5 -0.953 7.9-170.5-130.7 115.9 7.3 51.6 -2.4 84 106 A C E -cd 59 109A 0 24,-3.2 26,-2.8 -2,-0.4 2,-0.5 -0.902 5.9-160.1-102.0 131.9 6.3 48.7 -0.3 85 107 A L E -cd 60 110A 0 -26,-2.8 -24,-2.2 -2,-0.5 -23,-0.4 -0.965 10.1-174.9-112.9 127.0 4.3 45.9 -1.9 86 108 A F E - d 0 111A 6 24,-2.4 26,-2.2 -2,-0.5 -26,-0.0 -0.964 17.8-144.3-124.7 140.7 2.3 43.5 0.2 87 109 A R > - 0 0 34 -2,-0.4 3,-1.6 24,-0.2 5,-0.4 -0.869 8.3-171.0-108.9 101.3 0.3 40.4 -0.8 88 110 A P G > S+ 0 0 63 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 0.684 82.2 73.7 -64.3 -17.8 -2.9 39.9 1.3 89 111 A Q G 3 S+ 0 0 116 23,-0.4 24,-0.1 1,-0.3 -2,-0.0 0.749 79.1 74.5 -66.9 -24.6 -3.3 36.4 -0.3 90 112 A S G < S- 0 0 43 -3,-1.6 -1,-0.3 1,-0.1 3,-0.1 0.697 105.9-126.4 -57.3 -23.4 -0.4 35.2 1.9 91 113 A G < + 0 0 66 -3,-1.4 -1,-0.1 1,-0.3 -2,-0.1 0.228 68.6 127.1 91.5 -11.3 -3.0 35.3 4.8 92 114 A R - 0 0 109 -5,-0.4 2,-0.6 -30,-0.1 -1,-0.3 -0.334 60.1-131.9 -76.7 154.8 -0.6 37.5 6.8 93 115 A V - 0 0 81 47,-0.2 3,-0.1 -3,-0.1 2,-0.1 -0.967 33.6-119.5-103.3 121.4 -1.4 40.9 8.4 94 116 A L - 0 0 7 -2,-0.6 -32,-0.1 1,-0.1 47,-0.0 -0.359 37.6 -88.1 -62.8 134.6 1.3 43.4 7.5 95 117 A S >> - 0 0 15 -34,-0.2 4,-2.3 1,-0.1 3,-0.7 -0.062 29.1-132.6 -36.3 132.0 3.3 44.9 10.4 96 118 A A H 3> S+ 0 0 20 1,-0.2 4,-2.6 2,-0.2 75,-0.3 0.825 104.7 61.6 -62.2 -30.4 1.6 48.1 11.8 97 119 A M H 34 S+ 0 0 9 2,-0.2 -1,-0.2 1,-0.2 4,-0.1 0.778 111.2 36.2 -71.3 -28.3 5.0 49.8 11.6 98 120 A I H X4 S+ 0 0 0 -3,-0.7 3,-0.8 2,-0.2 4,-0.3 0.898 120.6 45.3 -85.6 -51.0 5.3 49.5 7.8 99 121 A R H >< S+ 0 0 68 -4,-2.3 3,-0.8 1,-0.2 -2,-0.2 0.871 116.7 48.0 -57.7 -39.5 1.6 49.9 7.0 100 122 A G T 3< S+ 0 0 1 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.589 96.6 72.0 -78.8 -12.8 1.5 52.9 9.4 101 123 A A T < S+ 0 0 10 -3,-0.8 -1,-0.2 -4,-0.1 -2,-0.2 0.511 74.5 117.0 -78.7 -5.6 4.7 54.5 7.9 102 124 A A < + 0 0 36 -3,-0.8 6,-0.2 -4,-0.3 -3,-0.0 -0.393 30.4 166.2 -70.8 136.2 2.8 55.4 4.8 103 125 A D - 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