==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL PROTEIN 12-JUL-00 1FA3 . COMPND 2 MOLECULE: MNEI SWEET PROTEIN RELATED TO MONELLIN; . SOURCE 2 ORGANISM_SCIENTIFIC: DIOSCOREOPHYLLUM CUMMINSII; . AUTHOR P.A.TEMUSSI,R.SPADACCINI . 96 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6822.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 74 77.1 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 . 39 40.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 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 . 1 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 . 1 1.0 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 . 12 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 3 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 16 16.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 2.1 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 1 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 1 0 0 0 0 1 0 0 1 0 1 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 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 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 42 0, 0.0 44,-2.4 0, 0.0 2,-0.7 0.000 360.0 360.0 360.0 -47.4 9.0 -11.1 -1.4 2 2 A E - 0 0 165 42,-0.2 42,-0.2 1,-0.2 41,-0.0 -0.936 360.0 -43.3-103.4 103.0 7.7 -12.3 -4.7 3 3 A W S S+ 0 0 144 -2,-0.7 2,-0.3 1,-0.1 41,-0.2 0.861 95.8 152.7 32.3 72.8 4.0 -11.3 -4.7 4 4 A E E -A 43 0A 124 39,-2.3 39,-3.1 -3,-0.0 2,-0.3 -0.866 46.7-108.9-125.4 155.9 3.3 -12.5 -1.0 5 5 A I E -A 42 0A 88 -2,-0.3 2,-0.3 37,-0.2 37,-0.2 -0.627 31.2-142.3 -84.3 143.3 0.8 -11.3 1.6 6 6 A I - 0 0 20 35,-2.7 2,-0.5 -2,-0.3 35,-0.1 -0.738 26.7 -94.4-105.0 154.8 2.0 -9.4 4.6 7 7 A D - 0 0 149 -2,-0.3 5,-0.5 1,-0.1 2,-0.3 -0.561 36.4-131.0 -69.5 118.6 0.9 -9.6 8.3 8 8 A I + 0 0 88 -2,-0.5 -1,-0.1 4,-0.1 31,-0.0 -0.558 62.6 101.9 -69.4 129.1 -1.8 -7.0 9.0 9 9 A G S > S- 0 0 18 -2,-0.3 4,-3.1 1,-0.0 5,-0.2 -0.922 89.2 -36.7 174.0-167.1 -0.7 -5.3 12.3 10 10 A P H > S+ 0 0 110 0, 0.0 4,-3.0 0, 0.0 5,-0.1 0.828 132.6 53.5 -51.0 -41.7 0.9 -2.0 13.4 11 11 A F H > S+ 0 0 105 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.970 115.0 37.5 -53.9 -60.8 3.3 -2.0 10.4 12 12 A T H > S+ 0 0 0 -5,-0.5 4,-3.0 1,-0.2 5,-0.3 0.914 115.6 54.9 -63.1 -43.6 0.5 -2.3 7.8 13 13 A Q H X S+ 0 0 57 -4,-3.1 4,-3.2 1,-0.2 -1,-0.2 0.948 107.4 50.9 -51.0 -53.5 -1.8 -0.0 9.9 14 14 A N H X S+ 0 0 98 -4,-3.0 4,-3.0 -5,-0.2 -2,-0.2 0.904 112.1 45.7 -53.1 -49.7 1.0 2.6 9.8 15 15 A L H X S+ 0 0 2 -4,-2.2 4,-2.8 2,-0.2 -1,-0.2 0.932 114.8 46.7 -64.0 -45.1 1.4 2.4 6.0 16 16 A G H X S+ 0 0 0 -4,-3.0 4,-2.8 2,-0.2 -2,-0.2 0.922 113.3 50.6 -58.6 -43.5 -2.4 2.5 5.4 17 17 A K H X S+ 0 0 90 -4,-3.2 4,-3.0 -5,-0.3 -2,-0.2 0.952 110.3 48.9 -57.2 -53.4 -2.6 5.4 7.9 18 18 A F H X S+ 0 0 62 -4,-3.0 4,-3.0 2,-0.2 5,-0.2 0.895 109.9 52.7 -53.6 -45.0 0.2 7.2 6.0 19 19 A A H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 -2,-0.2 0.953 113.3 42.5 -56.9 -51.9 -1.7 6.6 2.7 20 20 A V H X S+ 0 0 0 -4,-2.8 4,-3.2 2,-0.2 12,-0.3 0.883 113.5 53.6 -62.1 -39.5 -4.9 8.1 4.2 21 21 A D H X S+ 0 0 77 -4,-3.0 4,-2.7 2,-0.2 -2,-0.2 0.932 111.8 44.2 -62.0 -47.6 -2.8 10.9 5.7 22 22 A E H X S+ 0 0 61 -4,-3.0 4,-2.6 2,-0.2 5,-0.2 0.957 115.6 47.8 -58.7 -54.0 -1.2 11.8 2.4 23 23 A E H X>S+ 0 0 2 -4,-2.8 4,-2.8 1,-0.2 5,-1.1 0.922 114.6 46.7 -54.1 -48.2 -4.6 11.5 0.6 24 24 A N H <5S+ 0 0 32 -4,-3.2 -1,-0.2 2,-0.2 -2,-0.2 0.877 109.1 54.4 -61.0 -44.2 -6.2 13.7 3.3 25 25 A K H <5S+ 0 0 169 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.899 113.4 42.1 -60.8 -42.0 -3.3 16.2 3.1 26 26 A I H <5S- 0 0 109 -4,-2.6 -2,-0.2 -5,-0.1 -1,-0.2 0.899 101.2-145.7 -65.3 -43.5 -4.0 16.5 -0.7 27 27 A G T ><5 + 0 0 35 -4,-2.8 3,-2.4 3,-0.3 -3,-0.2 0.612 47.3 146.7 86.6 17.8 -7.7 16.5 0.1 28 28 A Q T 3 + 0 0 152 -2,-2.1 3,-2.0 4,-0.2 2,-1.7 0.162 68.7 35.2 67.1 165.8 17.1 -3.2 -16.9 51 51 A G T 3 S+ 0 0 59 1,-0.3 -1,-0.2 3,-0.0 -2,-0.0 -0.346 135.5 26.5 62.4 -83.1 19.2 -5.7 -18.9 52 52 A F T 3 S- 0 0 199 -2,-1.7 -1,-0.3 -3,-0.2 -2,-0.1 0.826 110.3-151.4 -67.4 -36.3 21.6 -6.6 -16.1 53 53 A R < - 0 0 187 -3,-2.0 2,-0.3 1,-0.1 -4,-0.2 0.323 16.1-161.5 73.3 154.1 18.7 -5.7 -13.6 54 54 A E E -B 48 0A 124 -6,-1.5 -6,-2.8 -3,-0.0 2,-0.3 -0.933 27.1-103.0-159.6 149.6 19.1 -4.4 -10.0 55 55 A I E +B 47 0A 90 -2,-0.3 -8,-0.3 -8,-0.3 3,-0.1 -0.592 40.7 165.8 -69.5 134.8 16.8 -4.2 -6.9 56 56 A K E - 0 0 71 -10,-2.7 23,-2.5 1,-0.3 24,-0.6 0.624 55.0 -55.1-117.9 -33.7 15.5 -0.7 -6.4 57 57 A G E -BC 46 78A 1 -11,-2.6 -11,-2.8 21,-0.3 -1,-0.3 -0.847 53.3 -89.4-175.9-154.0 12.7 -1.0 -3.9 58 58 A Y E -BC 45 77A 54 19,-2.3 19,-2.6 -13,-0.3 2,-0.3 -0.952 19.8-143.0-144.7 161.2 9.3 -2.7 -3.2 59 59 A E E -BC 44 76A 48 -15,-2.9 -15,-2.4 -2,-0.3 2,-0.4 -0.942 8.3-161.0-125.0 151.1 5.6 -2.1 -3.8 60 60 A Y E -BC 43 75A 12 15,-2.7 15,-2.9 -2,-0.3 2,-0.6 -0.987 2.0-166.9-134.8 118.3 2.7 -2.9 -1.5 61 61 A Q E +BC 42 74A 38 -19,-3.0 -19,-2.7 -2,-0.4 2,-0.3 -0.945 27.0 160.4-107.6 111.6 -0.9 -3.2 -2.7 62 62 A L E -BC 41 73A 1 11,-2.8 11,-3.0 -2,-0.6 2,-0.7 -0.920 42.8-121.7-138.5 154.3 -3.3 -3.1 0.2 63 63 A Y E -BC 38 72A 52 -23,-1.3 -25,-2.8 -25,-1.0 2,-0.4 -0.879 32.7-165.7-103.1 104.5 -7.0 -2.5 1.0 64 64 A V E -BC 37 71A 0 7,-2.3 7,-3.0 -2,-0.7 2,-0.5 -0.765 10.7-144.7 -96.6 133.6 -7.3 0.4 3.6 65 65 A Y E +BC 36 70A 69 -29,-3.0 -30,-3.0 -2,-0.4 -29,-1.3 -0.884 25.8 166.9 -97.8 123.3 -10.5 1.2 5.5 66 66 A A E > S-BC 34 69A 0 3,-2.9 3,-2.1 -2,-0.5 -32,-0.3 -0.996 71.8 -7.0-139.5 130.6 -11.2 4.9 6.1 67 67 A S T 3 S- 0 0 52 -34,-3.0 -33,-0.1 -2,-0.3 3,-0.1 0.860 127.4 -63.1 50.4 40.3 -14.6 6.3 7.3 68 68 A D T 3 S+ 0 0 108 -35,-0.3 2,-0.4 1,-0.2 -1,-0.3 0.757 115.0 119.5 50.1 32.7 -15.9 2.7 6.8 69 69 A K E < -C 66 0A 113 -3,-2.1 -3,-2.9 25,-0.0 2,-0.5 -0.990 60.3-138.2-119.1 129.8 -15.1 3.1 3.1 70 70 A L E +C 65 0A 9 -2,-0.4 23,-2.9 -5,-0.2 2,-0.3 -0.815 26.1 176.1 -94.7 125.6 -12.6 0.6 1.7 71 71 A F E -C 64 0A 6 -7,-3.0 -7,-2.3 -2,-0.5 2,-0.6 -0.935 29.6-124.1-124.6 149.5 -10.0 1.9 -0.8 72 72 A R E -CD 63 90A 48 18,-2.4 18,-2.9 -2,-0.3 2,-0.4 -0.865 28.2-168.1 -92.1 123.6 -7.1 0.2 -2.5 73 73 A A E -CD 62 89A 0 -11,-3.0 -11,-2.8 -2,-0.6 2,-0.5 -0.950 9.5-158.9-111.7 133.1 -3.8 1.9 -1.8 74 74 A D E -CD 61 88A 4 14,-2.7 13,-2.4 -2,-0.4 14,-2.0 -0.976 17.0-172.7-107.4 122.0 -0.6 1.1 -3.7 75 75 A I E -CD 60 86A 0 -15,-2.9 -15,-2.7 -2,-0.5 2,-0.3 -0.865 9.5-152.9-113.3 146.2 2.5 2.2 -1.8 76 76 A S E -CD 59 85A 13 9,-3.1 9,-2.4 -2,-0.3 2,-0.4 -0.867 2.1-161.0-112.2 154.5 6.2 2.2 -3.0 77 77 A E E -CD 58 84A 37 -19,-2.6 -19,-2.3 -2,-0.3 2,-0.5 -0.969 10.9-150.4-130.9 115.5 9.3 1.8 -0.8 78 78 A D E >> -CD 57 83A 40 5,-2.3 4,-2.1 -2,-0.4 5,-0.8 -0.802 6.8-149.5 -86.9 124.4 12.6 3.0 -2.4 79 79 A Y T 45S+ 0 0 150 -23,-2.5 -22,-0.2 -2,-0.5 -1,-0.2 0.900 92.1 45.8 -58.3 -49.3 15.5 0.9 -1.0 80 80 A K T 45S+ 0 0 190 -24,-0.6 -1,-0.2 1,-0.2 -23,-0.1 0.941 120.9 36.2 -68.9 -51.7 18.2 3.6 -1.3 81 81 A T T 45S- 0 0 115 2,-0.1 -1,-0.2 1,-0.0 -2,-0.2 0.821 97.0-147.5 -62.9 -34.0 16.1 6.6 0.1 82 82 A R T <5 + 0 0 194 -4,-2.1 2,-0.3 1,-0.3 -3,-0.2 0.813 56.0 124.3 64.0 34.7 14.6 4.0 2.5 83 83 A G E < -D 78 0A 24 -5,-0.8 -5,-2.3 2,-0.0 -1,-0.3 -0.931 53.5-139.2-125.3 143.7 11.4 6.0 2.3 84 84 A R E +D 77 0A 120 -2,-0.3 2,-0.3 -7,-0.2 -7,-0.3 -0.593 20.1 178.9 -93.1 165.3 7.9 5.0 1.4 85 85 A K E -D 76 0A 102 -9,-2.4 -9,-3.1 -2,-0.2 2,-0.5 -0.966 35.4 -99.4-161.1 152.9 5.3 6.9 -0.7 86 86 A L E -D 75 0A 34 -2,-0.3 -11,-0.3 -11,-0.2 3,-0.1 -0.643 28.0-177.8 -71.7 118.6 1.8 6.5 -2.1 87 87 A L E S- 0 0 68 -13,-2.4 2,-0.3 -2,-0.5 -12,-0.2 0.911 70.2 -20.1 -75.6 -50.9 1.8 5.4 -5.7 88 88 A R E -D 74 0A 116 -14,-2.0 -14,-2.7 2,-0.0 2,-0.4 -0.988 46.0-150.4-156.7 160.7 -2.0 5.5 -6.0 89 89 A F E +D 73 0A 18 -2,-0.3 2,-0.3 -16,-0.2 -16,-0.2 -0.927 27.0 178.3-135.7 101.2 -5.3 5.5 -3.9 90 90 A N E -D 72 0A 78 -18,-2.9 -18,-2.4 -2,-0.4 3,-0.2 -0.799 26.8 -8.7-105.8 152.3 -8.2 4.0 -5.8 91 91 A G - 0 0 19 -2,-0.3 2,-0.2 1,-0.3 -20,-0.2 -0.830 42.4-120.1 134.6-168.0 -11.8 3.4 -4.6 92 92 A P + 0 0 66 0, 0.0 -1,-0.3 0, 0.0 -21,-0.2 0.479 64.2 164.3 -66.6 149.3 -14.1 3.3 -2.8 93 93 A V - 0 0 52 -23,-2.9 -23,-0.1 -3,-0.2 -3,-0.0 -0.994 32.5-127.4-139.0 131.9 -14.3 -0.4 -3.8 94 94 A P - 0 0 108 0, 0.0 -25,-0.0 0, 0.0 0, 0.0 -0.366 32.8 -99.9 -73.0 159.5 -16.2 -3.2 -1.9 95 95 A P 0 0 73 0, 0.0 -25,-0.0 0, 0.0 0, 0.0 -0.398 360.0 360.0 -68.0 157.1 -14.6 -6.4 -0.8 96 96 A P 0 0 191 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.827 360.0 360.0 -66.5 360.0 -15.2 -9.5 -3.0