==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PLANT PROTEIN 15-MAR-02 1IV7 . COMPND 2 MOLECULE: MONELLIN; . SOURCE 2 ORGANISM_SCIENTIFIC: DIOSCOREOPHYLLUM CUMMINSII; . AUTHOR T.TAMADA,Y.KATO,R.KUROKI . 192 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11473.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 139 72.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 78 40.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 1.0 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 . 2 1.0 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 . 21 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 32 16.7 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+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 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 0 0 0 0 2 2 0 0 0 4 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 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 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 G 0 0 58 0, 0.0 2,-0.3 0, 0.0 45,-0.1 0.000 360.0 360.0 360.0 50.4 9.8 28.8 -6.8 2 2 A E E -A 45 0A 110 43,-0.7 43,-3.1 2,-0.0 2,-0.3 -0.967 360.0-160.8-156.0 137.3 7.4 25.7 -6.4 3 3 A W E +A 44 0A 39 -2,-0.3 2,-0.3 41,-0.2 41,-0.2 -0.867 12.4 167.5-126.9 141.0 8.0 22.1 -5.3 4 4 A E E -A 43 0A 83 39,-1.6 39,-3.3 -2,-0.3 2,-0.4 -0.976 32.5-123.5-149.4 154.4 6.2 18.8 -5.6 5 5 A I E -A 42 0A 56 -2,-0.3 2,-0.4 37,-0.2 37,-0.2 -0.828 27.3-158.7 -94.7 136.2 7.0 15.2 -5.1 6 6 A I E -A 41 0A 27 35,-2.5 35,-0.6 -2,-0.4 -2,-0.0 -0.925 20.5-115.7-115.8 145.2 6.4 13.1 -8.2 7 7 A D - 0 0 121 -2,-0.4 2,-0.3 1,-0.1 5,-0.2 -0.358 34.8-106.2 -76.0 158.3 5.9 9.4 -8.0 8 8 A I + 0 0 52 3,-0.1 -1,-0.1 4,-0.1 31,-0.1 -0.662 60.7 126.2 -87.2 151.9 8.5 7.2 -9.6 9 9 A G S > S- 0 0 32 -2,-0.3 4,-2.3 28,-0.0 3,-0.5 -0.891 79.3 -49.4-177.6-172.5 7.6 5.4 -12.8 10 10 A P H > S+ 0 0 105 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.774 131.2 61.3 -53.0 -28.1 9.0 5.2 -16.4 11 11 A F H > S+ 0 0 99 2,-0.2 4,-1.3 1,-0.2 5,-0.1 0.954 109.0 38.1 -67.1 -50.1 9.3 9.0 -16.4 12 12 A T H > S+ 0 0 3 -3,-0.5 4,-2.4 -5,-0.2 -1,-0.2 0.832 112.5 60.0 -67.8 -33.1 11.7 9.2 -13.5 13 13 A Q H X S+ 0 0 113 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.914 104.3 50.2 -57.7 -44.4 13.5 6.0 -14.7 14 14 A N H X S+ 0 0 45 -4,-1.9 4,-1.8 -5,-0.2 -1,-0.2 0.841 109.4 50.8 -65.4 -32.2 14.3 7.8 -17.9 15 15 A L H X S+ 0 0 0 -4,-1.3 4,-2.5 2,-0.2 -2,-0.2 0.903 109.0 50.9 -69.0 -43.3 15.7 10.7 -16.0 16 16 A G H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.908 109.4 50.2 -63.2 -35.4 17.9 8.5 -13.9 17 17 A K H X S+ 0 0 100 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.901 109.6 51.9 -69.3 -37.5 19.2 6.8 -17.1 18 18 A F H X S+ 0 0 39 -4,-1.8 4,-2.8 2,-0.2 5,-0.2 0.942 108.3 51.7 -59.0 -47.7 20.0 10.3 -18.6 19 19 A A H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.891 113.0 43.9 -55.3 -45.5 21.9 11.2 -15.4 20 20 A V H X S+ 0 0 2 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.860 112.0 52.9 -73.4 -40.0 24.0 8.1 -15.5 21 21 A D H X S+ 0 0 89 -4,-2.5 4,-1.0 -5,-0.2 -2,-0.2 0.926 113.9 44.2 -56.7 -45.5 24.6 8.5 -19.3 22 22 A E H >X S+ 0 0 52 -4,-2.8 4,-1.5 1,-0.2 3,-0.6 0.940 112.4 49.4 -66.1 -42.0 25.8 12.0 -18.8 23 23 A E H 3X S+ 0 0 6 -4,-2.4 4,-2.9 1,-0.3 5,-0.4 0.820 105.9 58.3 -70.4 -30.7 28.0 11.3 -15.7 24 24 A N H 3< S+ 0 0 28 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.785 103.7 53.8 -68.2 -28.4 29.7 8.4 -17.6 25 25 A K H << S+ 0 0 161 -4,-1.0 -1,-0.2 -3,-0.6 -2,-0.2 0.892 112.1 43.8 -72.6 -36.6 30.7 10.9 -20.2 26 26 A I H < S- 0 0 87 -4,-1.5 -2,-0.2 1,-0.1 -1,-0.2 0.919 92.2-156.7 -74.5 -41.9 32.2 13.0 -17.5 27 27 A G >< + 0 0 32 -4,-2.9 3,-2.1 3,-0.2 -3,-0.1 0.374 46.1 133.1 85.0 2.7 33.9 10.0 -15.8 28 28 A Q T 3 S+ 0 0 160 -5,-0.4 -4,-0.1 1,-0.3 3,-0.1 0.556 82.8 34.1 -71.1 -3.5 34.3 11.5 -12.3 29 29 A Y T 3 S- 0 0 82 1,-0.5 -1,-0.3 -6,-0.3 2,-0.1 0.084 113.8-117.2-129.8 12.0 32.9 8.3 -10.7 30 30 A G < - 0 0 35 -3,-2.1 -1,-0.5 -7,-0.2 2,-0.4 -0.393 66.5 -18.0 85.1-163.5 34.3 5.9 -13.1 31 31 A R S S- 0 0 165 -3,-0.1 2,-0.4 -2,-0.1 -7,-0.0 -0.729 71.2-165.4 -87.5 133.0 32.1 3.7 -15.2 32 32 A L - 0 0 11 -2,-0.4 2,-0.5 -12,-0.2 -8,-0.1 -0.935 13.6-152.4-120.4 141.6 28.6 3.5 -13.8 33 33 A T - 0 0 91 -2,-0.4 34,-2.4 -9,-0.0 35,-0.3 -0.955 25.9-121.8-110.6 133.2 25.8 1.1 -14.6 34 34 A F E + B 0 66A 50 -2,-0.5 32,-0.2 32,-0.2 3,-0.1 -0.443 37.4 163.3 -76.4 124.6 22.2 2.3 -14.1 35 35 A N E - 0 0 60 30,-2.2 2,-0.3 1,-0.3 31,-0.2 0.792 54.0 -53.2-104.6 -63.8 20.1 0.3 -11.7 36 36 A K E - B 0 65A 110 29,-1.1 29,-3.1 -20,-0.1 2,-0.5 -0.987 36.7-112.0-168.4 165.3 17.0 2.4 -10.7 37 37 A V E - B 0 64A 11 -2,-0.3 27,-0.2 27,-0.2 2,-0.2 -0.916 37.1-161.9-105.5 130.2 15.7 5.7 -9.3 38 38 A I E - B 0 63A 32 25,-1.9 25,-0.6 -2,-0.5 -2,-0.0 -0.611 26.7 -48.9-109.7 172.5 14.0 5.5 -5.8 39 39 A R E S+ 0 0 136 -2,-0.2 -1,-0.1 1,-0.1 -32,-0.1 -0.427 98.2 52.3 -78.4 153.9 11.7 7.7 -3.8 40 40 A P E + 0 0 5 0, 0.0 2,-0.5 0, 0.0 23,-0.2 0.526 58.5 173.4 -90.9 155.7 11.5 10.5 -3.1 41 41 A C E -A 6 0A 0 -35,-0.6 -35,-2.5 21,-0.1 2,-0.4 -0.960 15.4-157.8-120.5 119.0 11.8 12.4 -6.4 42 42 A M E -AB 5 61A 10 19,-1.6 19,-2.8 -2,-0.5 2,-0.5 -0.859 3.3-161.9 -98.1 137.6 11.4 16.2 -6.1 43 43 A K E -AB 4 60A 41 -39,-3.3 -39,-1.6 -2,-0.4 2,-0.5 -0.964 3.8-161.5-121.4 127.3 10.4 18.4 -9.0 44 44 A K E -AB 3 59A 31 15,-3.0 15,-2.2 -2,-0.5 2,-0.5 -0.901 9.0-144.7-107.5 134.5 10.9 22.1 -8.9 45 45 A T E -AB 2 58A 9 -43,-3.1 -43,-0.7 -2,-0.5 2,-0.7 -0.807 11.0-156.9 -93.0 127.5 9.1 24.5 -11.2 46 46 A I E - B 0 57A 42 11,-3.0 10,-2.4 -2,-0.5 11,-1.9 -0.912 8.1-158.0-110.3 116.2 11.1 27.5 -12.3 47 47 A Y E - B 0 55A 61 -2,-0.7 8,-0.2 8,-0.3 3,-0.2 -0.715 23.6-126.7 -87.6 145.0 9.1 30.5 -13.4 48 48 A E S S+ 0 0 69 6,-2.2 2,-0.4 -2,-0.3 -1,-0.1 0.914 101.2 12.7 -49.7 -51.1 10.4 33.3 -15.7 49 49 A N S > S- 0 0 103 5,-0.4 3,-2.1 3,-0.1 -1,-0.2 -0.997 94.5-104.0-130.7 133.6 9.4 35.9 -13.1 50 50 A E T 3 S+ 0 0 173 -2,-0.4 3,-0.1 1,-0.3 -4,-0.0 -0.197 107.4 18.6 -55.5 134.0 8.3 35.1 -9.5 51 51 A G T 3 S+ 0 0 82 1,-0.3 2,-0.3 -50,-0.1 -1,-0.3 0.356 106.4 100.6 83.9 -1.7 4.5 35.4 -9.1 52 52 A F S < S- 0 0 148 -3,-2.1 -1,-0.3 2,-0.1 -3,-0.1 -0.787 73.3-125.1-117.0 163.1 3.8 35.1 -12.9 53 53 A R + 0 0 236 -2,-0.3 2,-0.2 -3,-0.1 -1,-0.1 0.637 68.7 110.0 -80.1 -26.4 2.6 32.1 -14.9 54 54 A E - 0 0 118 -5,-0.1 -6,-2.2 1,-0.1 2,-0.6 -0.409 60.2-141.4 -64.2 127.9 5.2 31.6 -17.6 55 55 A I E -B 47 0A 38 -8,-0.2 -8,-0.3 -2,-0.2 3,-0.1 -0.750 20.3-177.9 -96.6 121.7 7.3 28.5 -17.0 56 56 A K E - 0 0 103 -10,-2.4 23,-2.4 -2,-0.6 24,-0.4 0.857 59.5 -61.6 -83.3 -42.3 11.0 28.7 -17.8 57 57 A G E -BC 46 78A 6 -11,-1.9 -11,-3.0 21,-0.3 2,-0.3 -0.975 47.7-102.6-179.6-164.7 11.9 25.1 -17.0 58 58 A Y E -BC 45 77A 36 19,-2.6 19,-2.6 -2,-0.3 2,-0.4 -0.928 12.6-149.3-139.1 162.3 12.1 22.5 -14.3 59 59 A E E -BC 44 76A 43 -15,-2.2 -15,-3.0 -2,-0.3 2,-0.4 -0.991 11.6-158.3-132.4 137.5 14.7 20.9 -12.1 60 60 A Y E -BC 43 75A 5 15,-2.8 15,-2.3 -2,-0.4 2,-0.6 -0.976 3.9-155.6-116.9 133.9 14.4 17.3 -10.8 61 61 A Q E -BC 42 74A 28 -19,-2.8 -19,-1.6 -2,-0.4 2,-0.4 -0.952 25.1-177.7-104.3 112.7 16.2 16.1 -7.7 62 62 A L E - 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0 0 23 -6,-0.1 -5,-2.5 1,-0.0 2,-0.4 -0.326 26.7-156.5 -61.7 141.9 16.7 20.2 -23.6 84 84 A R E -D 77 0A 71 -7,-0.2 2,-0.4 -3,-0.1 -7,-0.2 -0.946 10.7-171.4-121.9 150.7 18.1 18.5 -20.5 85 85 A K E -D 76 0A 128 -9,-1.5 -9,-2.6 -2,-0.4 2,-0.7 -0.997 27.6-125.6-137.9 137.3 21.4 19.1 -18.6 86 86 A L E -D 75 0A 31 -2,-0.4 -11,-0.2 -11,-0.2 3,-0.1 -0.731 30.5-179.9 -76.8 119.4 23.0 17.1 -15.7 87 87 A L E - 0 0 66 -13,-2.8 2,-0.3 -2,-0.7 -12,-0.2 0.899 61.4 -3.2 -87.5 -41.1 23.6 19.9 -13.1 88 88 A R E -D 74 0A 96 -14,-1.4 -14,-2.0 2,-0.0 2,-0.4 -1.000 48.6-175.0-154.2 146.4 25.1 17.8 -10.3 89 89 A F E +D 73 0A 11 -2,-0.3 2,-0.3 -16,-0.2 -16,-0.2 -0.919 24.1 161.0-148.8 112.3 26.0 14.2 -9.5 90 90 A N E -D 72 0A 87 -18,-1.9 -18,-2.3 -2,-0.4 3,-0.2 -0.919 21.8 -26.1-136.0 158.2 27.4 13.5 -5.9 91 91 A G - 0 0 24 1,-0.3 2,-0.2 -2,-0.3 -20,-0.2 -0.909 53.7 -84.1 147.3 178.2 27.8 10.4 -3.7 92 92 A P + 0 0 88 0, 0.0 -1,-0.3 0, 0.0 -21,-0.2 0.554 66.0 175.5 -62.5 148.3 27.6 8.0 -2.3 93 93 A V - 0 0 37 -23,-2.4 -23,-0.3 -3,-0.2 -30,-0.0 -0.831 33.9 -98.5-116.4 162.5 25.0 9.5 -0.1 94 94 A P - 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