==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 28-AUG-10 3ONF . COMPND 2 MOLECULE: ADENOSYLHOMOCYSTEINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LUPINUS LUTEUS; . AUTHOR K.BRZEZINSKI,M.JASKOLSKI . 973 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36784.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 722 74.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 109 11.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 33 3.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 54 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 111 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 354 36.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 23 2.4 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 6 4 0 2 2 2 4 0 9 2 1 1 1 0 2 2 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 5 8 8 3 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 2 0 0 3 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 ANTIPARALLEL BRIDGES PER LADDER . 2 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 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 M 0 0 104 0, 0.0 2,-0.6 0, 0.0 16,-0.0 0.000 360.0 360.0 360.0 131.0 24.3 47.0 4.8 2 2 A A - 0 0 57 2,-0.1 2,-3.3 1,-0.1 0, 0.0 -0.763 360.0-133.5 -80.4 117.4 23.8 50.7 4.3 3 3 A L + 0 0 59 -2,-0.6 2,-0.4 2,-0.0 -1,-0.1 -0.299 68.5 120.0 -76.3 59.4 20.0 51.2 4.0 4 4 A L - 0 0 117 -2,-3.3 -2,-0.1 10,-0.0 10,-0.0 -0.992 66.3-121.8-127.2 120.7 20.6 53.4 0.9 5 5 A V - 0 0 48 -2,-0.4 2,-0.2 10,-0.1 10,-0.2 -0.276 23.8-152.6 -63.2 144.1 19.1 52.4 -2.4 6 6 A E E -A 14 0A 81 8,-3.1 8,-2.6 6,-0.0 2,-0.4 -0.644 10.2-138.5-104.8 173.9 21.4 51.9 -5.2 7 7 A K E -A 13 0A 125 6,-0.3 6,-0.3 -2,-0.2 93,-0.0 -0.992 8.0-123.4-140.7 141.5 20.5 52.3 -8.9 8 8 A T > - 0 0 24 4,-2.8 3,-1.9 -2,-0.4 93,-0.1 -0.234 46.5 -94.8 -69.0 174.0 21.1 50.6 -12.2 9 9 A T T 3 S+ 0 0 158 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.845 128.8 56.4 -60.1 -31.4 22.7 52.5 -15.0 10 10 A S T 3 S- 0 0 98 2,-0.1 -1,-0.3 1,-0.1 -2,-0.0 0.524 125.3-101.0 -80.7 -8.9 19.2 53.2 -16.3 11 11 A G S < S+ 0 0 41 -3,-1.9 2,-0.4 1,-0.3 -2,-0.1 0.562 72.2 144.4 99.5 11.6 18.1 54.7 -13.0 12 12 A R - 0 0 48 88,-0.1 -4,-2.8 89,-0.1 -1,-0.3 -0.702 44.9-127.1 -89.4 129.6 16.2 51.8 -11.4 13 13 A E E +A 7 0A 46 -2,-0.4 93,-0.4 -6,-0.3 2,-0.3 -0.370 37.1 152.9 -74.1 151.1 16.6 51.4 -7.6 14 14 A Y E -A 6 0A 26 -8,-2.6 -8,-3.1 91,-0.2 2,-0.3 -0.981 29.3-160.0-165.5 158.5 17.6 48.3 -5.8 15 15 A K E +b 107 0B 10 91,-2.9 93,-2.1 -2,-0.3 2,-0.2 -0.823 31.0 147.4-145.2 115.1 19.2 46.9 -2.7 16 16 A V E -b 108 0B 5 -2,-0.3 3,-0.2 91,-0.2 93,-0.2 -0.797 53.8-106.1-135.5 175.2 20.6 43.4 -2.8 17 17 A K S S- 0 0 112 91,-0.5 2,-0.2 -2,-0.2 92,-0.1 0.929 98.4 -7.1 -69.6 -47.9 23.4 41.4 -1.2 18 18 A D > - 0 0 60 75,-0.3 3,-1.8 1,-0.1 -1,-0.2 -0.755 48.4-162.8-162.9 101.3 25.7 41.1 -4.2 19 19 A M G > S+ 0 0 53 1,-0.3 3,-2.1 -2,-0.2 4,-0.2 0.730 87.4 75.8 -58.3 -25.4 25.1 42.1 -7.8 20 20 A S G > S+ 0 0 95 1,-0.3 3,-0.5 2,-0.1 4,-0.3 0.662 83.7 68.4 -66.0 -9.8 28.0 40.0 -9.0 21 21 A Q G <> S+ 0 0 55 -3,-1.8 4,-2.6 1,-0.2 -1,-0.3 0.480 71.9 96.5 -86.9 0.6 25.7 37.0 -8.4 22 22 A A H <> S+ 0 0 2 -3,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.876 77.7 53.4 -58.9 -43.4 23.5 38.1 -11.3 23 23 A D H <> S+ 0 0 114 -3,-0.5 4,-2.1 2,-0.2 -1,-0.2 0.937 112.4 46.1 -58.2 -42.7 25.1 35.8 -14.0 24 24 A F H > S+ 0 0 101 -4,-0.3 4,-1.9 1,-0.2 5,-0.2 0.925 110.3 54.2 -70.0 -39.9 24.5 32.8 -11.7 25 25 A G H X S+ 0 0 0 -4,-2.6 4,-2.1 69,-0.2 -1,-0.2 0.903 108.3 49.2 -54.1 -47.2 21.0 34.0 -11.1 26 26 A R H X S+ 0 0 39 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.881 105.7 56.2 -67.6 -38.5 20.3 34.1 -14.8 27 27 A L H X S+ 0 0 104 -4,-2.1 4,-1.2 1,-0.2 -1,-0.2 0.926 112.9 42.0 -60.0 -43.4 21.7 30.6 -15.4 28 28 A E H X S+ 0 0 73 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.821 111.0 55.1 -73.7 -33.6 19.2 29.2 -12.9 29 29 A I H X S+ 0 0 0 -4,-2.1 4,-2.4 -5,-0.2 -2,-0.2 0.924 104.3 55.8 -63.0 -40.7 16.4 31.3 -14.1 30 30 A E H X S+ 0 0 95 -4,-2.5 4,-0.7 1,-0.2 -2,-0.2 0.877 110.8 44.2 -61.0 -34.7 16.9 29.9 -17.6 31 31 A L H >X S+ 0 0 122 -4,-1.2 4,-0.9 1,-0.2 3,-0.6 0.901 110.2 55.5 -72.9 -42.5 16.5 26.4 -16.1 32 32 A A H >< S+ 0 0 4 -4,-2.3 3,-0.8 1,-0.2 4,-0.5 0.870 97.6 64.0 -59.5 -38.0 13.5 27.4 -14.1 33 33 A E H >< S+ 0 0 48 -4,-2.4 3,-1.4 1,-0.3 7,-0.3 0.886 100.0 51.8 -54.8 -38.5 11.7 28.7 -17.2 34 34 A V H << S+ 0 0 101 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.809 110.0 50.3 -70.7 -29.3 11.6 25.2 -18.7 35 35 A E T << S+ 0 0 74 -4,-0.9 -1,-0.3 -3,-0.8 375,-0.2 0.421 104.4 62.0 -86.5 -2.7 10.1 23.9 -15.5 36 36 A M X> + 0 0 0 -3,-1.4 4,-2.0 -4,-0.5 3,-0.8 -0.470 53.9 157.2-124.9 62.7 7.4 26.6 -15.4 37 37 A P H 3> S+ 0 0 28 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.789 71.3 62.0 -65.0 -25.1 5.3 26.1 -18.5 38 38 A G H 3> S+ 0 0 0 2,-0.2 4,-1.3 1,-0.2 5,-0.1 0.906 108.8 41.6 -65.4 -39.8 2.3 27.9 -17.0 39 39 A L H <> S+ 0 0 0 -3,-0.8 4,-1.4 2,-0.2 -1,-0.2 0.896 115.7 48.5 -76.5 -38.4 4.2 31.1 -16.7 40 40 A M H X S+ 0 0 55 -4,-2.0 4,-2.0 -7,-0.3 -2,-0.2 0.850 110.0 52.8 -70.9 -34.6 5.9 30.8 -20.1 41 41 A A H X S+ 0 0 31 -4,-2.6 4,-2.7 -5,-0.2 -1,-0.2 0.866 105.6 55.4 -66.1 -32.7 2.6 30.0 -21.8 42 42 A S H X S+ 0 0 7 -4,-1.3 4,-2.5 -5,-0.2 5,-0.3 0.872 106.4 50.8 -67.1 -36.6 1.2 33.2 -20.2 43 43 A R H X S+ 0 0 42 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.929 112.2 46.4 -66.3 -43.2 4.0 35.2 -21.8 44 44 A S H < S+ 0 0 91 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.911 116.7 43.6 -68.0 -41.8 3.3 33.7 -25.2 45 45 A E H < S+ 0 0 108 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.942 129.1 24.4 -67.3 -45.3 -0.5 34.2 -24.9 46 46 A F H >X S+ 0 0 51 -4,-2.5 4,-1.2 -5,-0.2 3,-0.8 0.578 96.5 91.7-103.1 -10.2 -0.4 37.8 -23.5 47 47 A G G >< S+ 0 0 16 -4,-2.2 3,-1.3 -5,-0.3 -1,-0.1 0.923 86.1 50.3 -49.2 -58.7 3.0 39.1 -24.7 48 48 A P G 34 S+ 0 0 116 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.718 112.4 47.0 -53.8 -31.8 1.7 40.6 -27.9 49 49 A S G <4 S- 0 0 77 -3,-0.8 -2,-0.2 -4,-0.2 4,-0.2 0.556 89.9-149.4 -95.6 -12.2 -1.1 42.5 -26.2 50 50 A Q X< + 0 0 60 -3,-1.3 3,-2.2 -4,-1.2 -3,-0.1 0.878 20.5 179.7 49.8 54.2 1.0 43.9 -23.4 51 51 A P T 3 S+ 0 0 19 0, 0.0 27,-0.2 0, 0.0 -1,-0.1 0.724 76.4 52.2 -64.5 -22.0 -1.9 44.0 -20.9 52 52 A F T > S+ 0 0 0 25,-2.4 3,-3.2 22,-0.2 28,-0.3 0.294 75.5 139.5 -95.2 6.8 0.2 45.4 -18.1 53 53 A K T < S+ 0 0 145 -3,-2.2 26,-0.2 24,-0.5 3,-0.1 -0.338 78.8 10.5 -53.4 124.8 1.5 48.2 -20.2 54 54 A G T 3 S+ 0 0 64 24,-0.7 -1,-0.3 1,-0.3 2,-0.3 0.421 99.3 130.8 83.4 -1.2 1.5 51.2 -17.9 55 55 A A < - 0 0 1 -3,-3.2 25,-2.5 23,-0.2 2,-0.5 -0.626 46.3-151.0 -85.2 146.1 0.9 49.2 -14.7 56 56 A K E -c 80 0B 57 -2,-0.3 78,-2.8 23,-0.2 79,-2.1 -0.975 19.1-171.7-115.5 116.1 3.0 49.6 -11.5 57 57 A I E -cd 81 135B 0 23,-2.7 25,-2.6 -2,-0.5 2,-0.5 -0.955 12.0-164.4-117.6 127.2 3.1 46.4 -9.5 58 58 A T E -cd 82 136B 0 77,-2.7 79,-2.5 -2,-0.5 2,-0.4 -0.923 13.7-169.9-104.2 130.8 4.5 45.9 -6.0 59 59 A G E -cd 83 137B 0 23,-2.4 25,-2.3 -2,-0.5 2,-0.4 -0.963 19.5-173.2-124.9 143.1 5.2 42.4 -4.9 60 60 A S E +cd 84 138B 0 77,-2.5 79,-1.5 -2,-0.4 2,-0.3 -0.847 41.3 123.2-133.8 96.7 6.1 40.9 -1.6 61 61 A L S S- 0 0 4 23,-1.7 23,-0.1 -2,-0.4 -2,-0.1 -0.962 75.2 -70.3-165.0 129.1 6.9 37.3 -2.1 62 62 A H - 0 0 14 -2,-0.3 2,-1.9 23,-0.2 5,-0.2 0.038 49.0-125.7 -33.8 125.5 10.0 35.3 -1.3 63 63 A M + 0 0 0 24,-0.2 29,-3.0 4,-0.1 33,-0.4 -0.520 58.7 140.8 -86.4 72.3 12.7 36.5 -3.7 64 64 A T S > S- 0 0 6 -2,-1.9 4,-1.9 27,-0.2 5,-0.1 -0.499 71.4 -95.2-103.4 173.3 13.6 33.1 -5.1 65 65 A I H > S+ 0 0 4 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.874 127.1 54.6 -58.6 -34.4 14.5 31.9 -8.7 66 66 A Q H > S+ 0 0 16 1,-0.2 4,-1.7 2,-0.2 3,-0.3 0.930 106.6 48.2 -69.3 -44.1 10.8 30.9 -9.0 67 67 A T H > S+ 0 0 1 -5,-0.2 4,-3.3 1,-0.2 -1,-0.2 0.846 104.8 62.2 -61.0 -32.4 9.6 34.4 -8.1 68 68 A A H X S+ 0 0 0 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.916 102.1 49.4 -61.4 -40.5 12.1 35.7 -10.6 69 69 A V H X S+ 0 0 0 -4,-1.4 4,-0.9 -3,-0.3 -1,-0.2 0.880 112.5 49.3 -69.5 -32.4 10.2 33.9 -13.4 70 70 A L H >X S+ 0 0 1 -4,-1.7 4,-2.4 2,-0.2 3,-0.7 0.959 110.5 48.6 -68.5 -47.7 7.0 35.4 -12.1 71 71 A I H 3X S+ 0 0 0 -4,-3.3 4,-2.5 1,-0.3 -2,-0.2 0.923 111.6 50.3 -56.2 -42.8 8.5 38.9 -12.0 72 72 A E H 3X S+ 0 0 15 -4,-2.5 4,-1.2 1,-0.2 -1,-0.3 0.673 106.3 56.2 -78.7 -13.4 9.8 38.4 -15.5 73 73 A T H S+ 0 0 1 -4,-2.4 5,-2.4 1,-0.2 3,-0.3 0.944 114.3 46.4 -61.3 -44.1 4.8 40.5 -15.4 75 75 A T H ><5S+ 0 0 34 -4,-2.5 3,-1.4 1,-0.2 -1,-0.2 0.865 107.8 56.4 -70.4 -30.6 7.5 42.6 -17.1 76 76 A A H 3<5S+ 0 0 37 -4,-1.2 -1,-0.2 1,-0.3 -2,-0.2 0.840 105.4 52.8 -68.3 -28.2 7.1 40.6 -20.3 77 77 A L T 3<5S- 0 0 0 -4,-1.5 -25,-2.4 -3,-0.3 -24,-0.5 0.404 133.2 -96.8 -89.9 2.4 3.5 41.5 -20.2 78 78 A G T < 5S+ 0 0 21 -3,-1.4 -24,-0.7 1,-0.3 -3,-0.2 0.360 74.2 143.5 109.1 -0.6 4.6 45.1 -19.9 79 79 A A < - 0 0 6 -5,-2.4 2,-0.4 -6,-0.2 -1,-0.3 -0.287 45.8-136.0 -70.2 149.4 4.5 45.8 -16.1 80 80 A E E -c 56 0B 92 -25,-2.5 -23,-2.7 -28,-0.3 2,-0.4 -0.898 35.2-157.3 -97.6 141.4 6.9 48.0 -14.2 81 81 A V E -c 57 0B 1 -2,-0.4 24,-2.0 22,-0.3 2,-0.4 -0.962 28.1-177.3-135.1 135.3 7.8 46.2 -11.0 82 82 A R E -ce 58 105B 21 -25,-2.6 -23,-2.4 -2,-0.4 2,-0.3 -0.992 23.6-176.9-122.9 143.8 9.1 46.7 -7.5 83 83 A W E +ce 59 106B 0 22,-2.0 24,-2.4 -2,-0.4 2,-0.3 -0.967 20.0 174.1-144.6 149.6 9.7 43.8 -5.2 84 84 A C E -ce 60 107B 0 -25,-2.3 -23,-1.7 -2,-0.3 2,-0.2 -0.937 37.6-104.4-142.5 163.7 10.7 42.7 -1.7 85 85 A S - 0 0 1 22,-0.7 -23,-0.2 -2,-0.3 3,-0.1 -0.577 15.3-141.6 -85.5 157.5 10.8 39.4 0.0 86 86 A C S S+ 0 0 15 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 0.225 85.4 50.5-102.4 13.6 8.1 38.4 2.6 87 87 A N S >> S- 0 0 13 1,-0.0 3,-0.8 307,-0.0 4,-0.5 -0.982 76.6-132.5-149.5 142.1 10.6 36.6 4.8 88 88 A I T 34 S+ 0 0 8 -2,-0.3 24,-2.1 1,-0.2 23,-2.0 0.667 107.5 30.6 -66.3 -18.8 14.0 37.6 6.2 89 89 A F T 34 S+ 0 0 8 21,-0.2 -1,-0.2 22,-0.2 21,-0.1 0.357 97.8 82.9-119.5 1.3 15.7 34.3 5.2 90 90 A S T <4 + 0 0 2 -3,-0.8 20,-0.1 19,-0.1 -2,-0.1 0.659 61.8 108.8 -92.2 -17.5 13.8 33.3 2.1 91 91 A T < - 0 0 1 -4,-0.5 2,-0.6 18,-0.3 -27,-0.2 -0.281 58.4-147.4 -61.5 137.5 15.7 35.4 -0.6 92 92 A Q > - 0 0 26 -29,-3.0 4,-2.3 1,-0.1 3,-0.4 -0.973 13.3-149.2-102.1 116.1 18.0 33.6 -2.9 93 93 A D H > S+ 0 0 25 -2,-0.6 4,-2.2 1,-0.3 -75,-0.3 0.791 92.9 53.1 -67.2 -30.5 20.6 36.3 -3.5 94 94 A H H > S+ 0 0 12 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.874 109.6 49.3 -71.1 -37.2 21.5 35.3 -7.1 95 95 A A H > S+ 0 0 0 -3,-0.4 4,-2.1 2,-0.2 -2,-0.2 0.933 112.0 48.9 -60.4 -51.8 17.8 35.5 -8.0 96 96 A A H X S+ 0 0 0 -4,-2.3 4,-2.8 -33,-0.4 5,-0.2 0.923 112.0 49.5 -50.3 -48.3 17.6 39.0 -6.4 97 97 A A H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 -75,-0.2 0.908 109.6 48.8 -63.4 -47.7 20.7 40.1 -8.2 98 98 A A H X S+ 0 0 0 -4,-2.1 4,-2.4 -77,-0.2 5,-0.3 0.883 114.6 46.5 -61.5 -38.6 19.6 38.9 -11.7 99 99 A I H X>S+ 0 0 0 -4,-2.1 4,-3.1 2,-0.2 5,-2.5 0.945 111.7 50.2 -72.0 -45.0 16.2 40.6 -11.3 100 100 A A H <5S+ 0 0 0 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.841 117.3 42.2 -57.2 -36.7 17.8 43.9 -10.0 101 101 A R H <5S+ 0 0 89 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.909 130.1 19.7 -76.6 -46.2 20.1 43.9 -12.9 102 102 A D H <5S+ 0 0 65 -4,-2.4 -3,-0.2 -5,-0.2 -2,-0.2 0.668 130.2 6.0-104.1 -23.6 17.8 42.9 -15.7 103 103 A S T <5S+ 0 0 21 -4,-3.1 -22,-0.3 1,-0.3 2,-0.3 0.734 103.2 9.2-140.6 -31.9 14.1 43.5 -14.9 104 104 A A < - 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