==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER UNKNOWN FUNCTION 07-FEB-13 2M4M . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CANDIDA GLABRATA; . AUTHOR R.HARRIS,B.HILLERICH,M.AHMED,J.B.BONANNO,S.CHAMALA,B.EVANS,J . 124 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8872.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 68 54.8 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 . 16 12.9 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 . 3 2.4 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 . 18 14.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 21 16.9 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 2 0 1 0 0 0 0 0 0 0 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 . 1 1 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 0 186 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 162.5 -25.2 12.6 -9.0 2 2 A S + 0 0 131 2,-0.1 2,-0.2 0, 0.0 0, 0.0 0.898 360.0 58.5 -63.7 -42.0 -22.4 14.9 -8.0 3 3 A L S S- 0 0 124 1,-0.1 2,-0.2 4,-0.0 5,-0.0 -0.480 74.6-150.5 -88.8 158.9 -19.8 12.1 -8.2 4 4 A G + 0 0 54 -2,-0.2 3,-0.4 2,-0.0 -1,-0.1 -0.536 51.4 32.3-117.4-173.3 -19.1 10.0 -11.3 5 5 A S S S- 0 0 129 -2,-0.2 2,-0.2 1,-0.2 -2,-0.0 -0.125 95.8 -71.8 61.4-161.5 -17.9 6.5 -12.1 6 6 A E S S+ 0 0 196 2,-0.0 2,-0.2 0, 0.0 -1,-0.2 -0.665 91.1 93.1-132.5 76.6 -18.8 3.5 -9.9 7 7 A S - 0 0 103 -3,-0.4 2,-0.2 -2,-0.2 -4,-0.0 -0.745 62.1-110.1-143.9-164.8 -16.8 3.8 -6.7 8 8 A E - 0 0 67 -2,-0.2 99,-0.1 99,-0.1 -2,-0.0 -0.429 43.8 -83.5-121.0-168.2 -17.1 5.2 -3.3 9 9 A T - 0 0 57 3,-0.2 4,-0.1 -2,-0.2 98,-0.0 0.906 48.3-156.7 -68.2 -45.4 -15.5 8.0 -1.3 10 10 A G S S+ 0 0 28 2,-0.4 -1,-0.1 96,-0.1 75,-0.1 -0.080 83.4 52.2 93.9 -35.3 -12.5 5.8 -0.5 11 11 A N S S+ 0 0 56 74,-0.1 68,-2.0 73,-0.0 69,-1.1 0.084 99.8 71.6-120.5 21.1 -11.6 7.8 2.7 12 12 A A E -A 78 0A 0 66,-0.2 94,-1.1 67,-0.1 -2,-0.4 -0.999 59.2-165.2-139.1 140.1 -14.9 7.7 4.4 13 13 A V E -AB 77 105A 0 64,-2.6 64,-2.5 -2,-0.4 2,-0.6 -0.836 20.2-127.2-123.4 159.7 -16.8 4.8 6.1 14 14 A V E -AB 76 104A 0 90,-3.2 90,-2.5 -2,-0.3 2,-0.5 -0.938 25.6-164.9-107.8 116.3 -20.3 4.2 7.3 15 15 A V E +AB 75 103A 8 60,-2.9 60,-2.3 -2,-0.6 2,-0.3 -0.897 16.5 161.9-107.1 126.6 -20.5 3.1 10.9 16 16 A F E +AB 74 102A 68 86,-2.6 86,-2.9 -2,-0.5 58,-0.2 -0.946 39.7 65.0-139.4 159.1 -23.6 1.5 12.2 17 17 A G S S+ 0 0 43 56,-1.6 2,-0.3 1,-0.4 -1,-0.1 0.788 73.8 113.7 97.9 34.6 -24.7 -0.6 15.1 18 18 A Y - 0 0 18 55,-0.7 -1,-0.4 -3,-0.1 2,-0.3 -0.893 50.2-142.6-132.4 162.8 -24.0 1.8 18.0 19 19 A R > - 0 0 172 -2,-0.3 3,-1.9 -3,-0.1 4,-0.1 -0.920 27.5-115.6-127.5 153.7 -26.1 3.6 20.6 20 20 A E T 3 S+ 0 0 116 -2,-0.3 3,-0.2 1,-0.3 4,-0.2 0.396 109.2 72.2 -68.8 4.7 -25.8 7.1 22.1 21 21 A A T 3 S+ 0 0 76 1,-0.1 -1,-0.3 2,-0.1 4,-0.1 0.396 96.0 48.5 -98.4 0.7 -25.2 5.4 25.5 22 22 A I S <> S+ 0 0 20 -3,-1.9 4,-3.2 2,-0.1 5,-0.5 0.277 76.0 108.7-120.3 9.0 -21.7 4.3 24.5 23 23 A T H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 5,-0.4 0.897 78.0 49.4 -58.3 -46.8 -20.3 7.5 23.2 24 24 A K H > S+ 0 0 98 -4,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.884 121.0 37.6 -61.2 -37.7 -17.9 8.3 26.0 25 25 A Q H > S+ 0 0 119 -3,-0.2 4,-0.9 2,-0.2 3,-0.2 0.969 121.7 37.8 -78.9 -59.2 -16.5 4.8 25.8 26 26 A I H X S+ 0 0 2 -4,-3.2 4,-1.7 1,-0.2 3,-0.4 0.858 113.2 57.2 -66.5 -36.3 -16.5 3.9 22.0 27 27 A L H X S+ 0 0 4 -4,-2.0 4,-1.8 -5,-0.5 -1,-0.2 0.874 96.6 64.2 -63.5 -37.3 -15.4 7.4 21.0 28 28 A A H < S+ 0 0 58 -4,-0.7 4,-0.3 -5,-0.4 -1,-0.2 0.891 105.3 44.7 -54.1 -44.7 -12.3 7.3 23.2 29 29 A Y H >< S+ 0 0 94 -4,-0.9 3,-0.9 -3,-0.4 -1,-0.2 0.952 120.8 37.4 -64.3 -50.4 -10.9 4.4 21.0 30 30 A F H >X S+ 0 0 10 -4,-1.7 4,-2.8 1,-0.2 3,-2.4 0.560 91.9 92.3 -81.4 -7.7 -11.7 5.9 17.6 31 31 A A T 3< S+ 0 0 0 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.1 0.727 71.2 72.9 -58.5 -23.6 -10.9 9.4 18.9 32 32 A Q T <4 S+ 0 0 80 -3,-0.9 20,-0.3 -4,-0.3 -1,-0.3 0.805 113.9 24.2 -58.8 -30.3 -7.4 8.7 17.6 33 33 A F T <4 S- 0 0 33 -3,-2.4 19,-0.9 1,-0.4 2,-0.3 0.817 132.0 -60.5-102.9 -45.8 -8.9 9.2 14.2 34 34 A G < - 0 0 10 -4,-2.8 -1,-0.4 -7,-0.2 2,-0.3 -0.926 59.0 -63.6-176.1-163.1 -11.9 11.3 14.9 35 35 A E - 0 0 23 -2,-0.3 3,-0.1 1,-0.1 -7,-0.0 -0.770 28.5-173.6-110.3 156.4 -15.3 11.7 16.7 36 36 A I + 0 0 5 -2,-0.3 2,-0.2 1,-0.2 -1,-0.1 0.796 62.7 28.1-114.8 -57.2 -18.4 9.6 16.2 37 37 A L S S- 0 0 11 -14,-0.1 -1,-0.2 2,-0.1 38,-0.0 -0.506 71.8-118.5-106.5 178.0 -21.4 10.8 18.2 38 38 A E S S+ 0 0 65 -2,-0.2 2,-1.2 1,-0.1 -1,-0.1 0.679 87.0 87.2 -92.5 -19.9 -22.4 14.3 19.4 39 39 A D + 0 0 44 2,-0.0 2,-0.4 -19,-0.0 -2,-0.1 -0.673 53.9 142.5 -88.7 98.8 -22.5 13.8 23.2 40 40 A L + 0 0 35 -2,-1.2 2,-0.5 -17,-0.0 3,-0.2 -0.958 23.3 179.3-144.3 116.4 -18.9 14.5 24.3 41 41 A E S S- 0 0 117 -2,-0.4 -2,-0.0 1,-0.3 0, 0.0 -0.986 70.9 -7.6-118.8 127.3 -17.8 16.2 27.5 42 42 A S S S- 0 0 117 -2,-0.5 2,-0.6 1,-0.2 -1,-0.3 0.963 75.3-165.5 49.6 94.4 -14.1 16.6 28.2 43 43 A E - 0 0 56 1,-0.3 -1,-0.2 -3,-0.2 -3,-0.0 -0.930 58.6 -17.0-120.6 112.1 -12.3 14.7 25.5 44 44 A L - 0 0 48 -2,-0.6 -1,-0.3 1,-0.1 -2,-0.1 0.991 62.1-159.7 58.9 85.3 -8.7 13.8 25.9 45 45 A G S S+ 0 0 78 -3,-0.2 2,-0.3 2,-0.1 -2,-0.1 0.880 74.5 24.9 -60.0 -40.9 -7.4 16.2 28.5 46 46 A D S S+ 0 0 141 1,-0.0 2,-2.3 3,-0.0 3,-0.3 -0.879 125.6 8.4-125.2 157.3 -3.8 15.8 27.4 47 47 A T S > S- 0 0 122 -2,-0.3 3,-1.3 1,-0.2 -2,-0.1 -0.212 71.6-142.0 75.2 -48.2 -2.1 14.9 24.2 48 48 A E G > - 0 0 66 -2,-2.3 3,-2.1 1,-0.3 -1,-0.2 0.605 44.7-102.2 59.3 11.1 -5.4 15.0 22.3 49 49 A T G 3 - 0 0 37 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.641 50.5 -90.2 49.2 24.4 -3.8 11.9 20.6 50 50 A M G < S+ 0 0 154 -3,-1.3 -1,-0.3 1,-0.1 5,-0.2 0.801 75.9 175.1 42.3 38.8 -2.9 14.3 17.6 51 51 A R < + 0 0 2 -3,-2.1 3,-0.2 4,-0.1 -18,-0.2 -0.164 31.0 41.0 -70.6 162.8 -6.2 13.2 16.2 52 52 A T S > S- 0 0 41 -19,-0.9 3,-2.0 -20,-0.3 -18,-0.1 0.571 85.8-100.9 72.0 136.3 -7.9 14.6 13.0 53 53 A P T 3 S+ 0 0 83 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.268 124.3 55.3 -70.4 14.9 -6.0 15.4 9.7 54 54 A G T 3 S- 0 0 43 -3,-0.2 2,-1.9 2,-0.1 -2,-0.1 0.153 109.6-120.7-131.0 14.6 -6.1 19.0 10.8 55 55 A Y S < S+ 0 0 180 -3,-2.0 2,-0.3 -5,-0.2 -4,-0.1 -0.123 93.6 50.9 72.8 -40.9 -4.4 18.6 14.2 56 56 A F S S- 0 0 135 -2,-1.9 2,-0.5 -6,-0.1 -2,-0.1 -0.890 89.6-110.6-127.1 155.7 -7.6 20.0 15.8 57 57 A F - 0 0 63 -2,-0.3 2,-0.8 -5,-0.1 -5,-0.0 -0.756 25.1-150.6 -90.9 123.6 -11.2 19.2 15.5 58 58 A Q + 0 0 172 -2,-0.5 2,-0.3 2,-0.0 9,-0.2 -0.828 43.1 123.0-100.0 104.1 -13.3 21.9 13.8 59 59 A Q - 0 0 51 -2,-0.8 6,-0.1 7,-0.1 7,-0.1 -0.966 49.7-128.4-158.7 144.1 -16.9 21.9 15.0 60 60 A A > - 0 0 47 4,-0.4 3,-1.6 -2,-0.3 -2,-0.0 -0.825 6.3-145.6-104.9 135.4 -19.1 24.5 16.6 61 61 A P T 3 S+ 0 0 94 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.628 101.9 63.7 -67.5 -14.0 -21.1 24.2 19.9 62 62 A N T 3 S+ 0 0 154 2,-0.1 2,-0.2 3,-0.0 3,-0.1 0.451 112.3 32.6 -89.7 -2.0 -23.8 26.4 18.3 63 63 A R S < S- 0 0 201 -3,-1.6 2,-0.1 1,-0.1 4,-0.1 -0.626 113.2 -42.5-133.7-168.0 -24.4 23.8 15.6 64 64 A R - 0 0 97 -2,-0.2 -4,-0.4 1,-0.1 -1,-0.1 -0.383 48.3-134.5 -63.0 139.7 -24.3 20.0 15.2 65 65 A R S S+ 0 0 100 1,-0.1 2,-0.5 -6,-0.1 -1,-0.1 0.907 95.3 52.2 -65.7 -40.3 -21.3 18.5 16.9 66 66 A I - 0 0 15 1,-0.1 4,-0.2 2,-0.1 -1,-0.1 -0.857 67.7-161.9-101.0 124.7 -20.7 16.3 13.9 67 67 A S S S+ 0 0 52 -2,-0.5 2,-0.2 -9,-0.2 -1,-0.1 0.595 72.4 84.1 -79.2 -12.8 -20.5 18.1 10.6 68 68 A R S S- 0 0 128 1,-0.1 2,-0.4 8,-0.0 -2,-0.1 -0.629 95.9 -97.1 -87.7 150.9 -21.0 14.8 8.8 69 69 A E - 0 0 80 -2,-0.2 7,-1.3 6,-0.1 2,-0.3 -0.541 45.7-174.5 -74.7 127.4 -24.5 13.5 8.3 70 70 A H B -C 75 0A 49 -2,-0.4 5,-0.2 5,-0.2 2,-0.1 -0.906 6.6-161.0-122.5 150.0 -25.6 11.0 10.9 71 71 A G - 0 0 12 3,-3.6 48,-0.1 -2,-0.3 44,-0.1 -0.175 45.2 -71.7-109.6-156.5 -28.7 8.9 11.2 72 72 A R S S- 0 0 148 46,-0.4 43,-0.1 42,-0.2 47,-0.1 0.913 126.2 -1.5 -69.1 -44.6 -30.4 7.0 14.0 73 73 A T S S+ 0 0 61 41,-0.1 -56,-1.6 -54,-0.1 -55,-0.7 0.210 125.4 66.3-133.3 13.5 -27.9 4.2 14.3 74 74 A W E -A 16 0A 8 -58,-0.2 -3,-3.6 -57,-0.1 2,-0.3 -0.970 50.6-173.7-139.3 150.4 -25.3 5.1 11.6 75 75 A T E -AC 15 70A 0 -60,-2.3 -60,-2.9 -2,-0.3 2,-0.8 -0.997 25.4-127.3-143.5 146.6 -22.8 7.8 10.9 76 76 A K E -A 14 0A 51 -7,-1.3 2,-0.7 -2,-0.3 -62,-0.2 -0.834 27.3-164.7 -93.3 108.6 -20.5 8.7 7.9 77 77 A L E -A 13 0A 9 -64,-2.5 -64,-2.6 -2,-0.8 2,-0.5 -0.842 4.6-171.3-100.3 117.2 -17.0 9.1 9.3 78 78 A T E +A 12 0A 58 -2,-0.7 -66,-0.2 -66,-0.2 -10,-0.0 -0.936 16.7 167.1-110.7 120.9 -14.6 10.8 6.9 79 79 A Y - 0 0 6 -68,-2.0 2,-0.3 -2,-0.5 -67,-0.1 0.496 35.9-141.0-109.0 -9.1 -10.9 10.8 7.9 80 80 A A S S+ 0 0 55 -69,-1.1 2,-0.4 1,-0.1 -68,-0.1 0.140 77.2 90.5 69.7 -23.8 -9.5 12.0 4.5 81 81 A N S > S- 0 0 76 -2,-0.3 4,-1.7 -70,-0.2 -2,-0.2 -0.878 71.2-146.4-107.2 137.4 -6.6 9.5 5.1 82 82 A H H > S+ 0 0 131 -2,-0.4 4,-2.7 2,-0.2 5,-0.2 0.817 98.5 61.3 -68.0 -32.3 -6.7 6.0 3.8 83 83 A S H > S+ 0 0 64 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.940 108.8 41.0 -61.1 -47.8 -4.7 4.8 6.8 84 84 A S H > S+ 0 0 25 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.866 112.9 57.6 -67.0 -36.7 -7.4 5.9 9.3 85 85 A Y H X S+ 0 0 27 -4,-1.7 4,-0.8 1,-0.2 -2,-0.2 0.935 110.8 40.4 -58.6 -51.1 -10.1 4.6 6.9 86 86 A L H X S+ 0 0 112 -4,-2.7 4,-0.9 2,-0.2 -1,-0.2 0.888 115.8 50.1 -69.0 -41.7 -8.7 1.1 7.0 87 87 A R H < S+ 0 0 158 -4,-2.1 3,-0.4 -5,-0.2 -2,-0.2 0.886 114.4 44.0 -65.7 -39.5 -7.9 1.0 10.7 88 88 A A H < S+ 0 0 1 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.625 98.8 76.4 -79.2 -13.8 -11.3 2.3 11.6 89 89 A L H < + 0 0 36 -4,-0.8 14,-0.4 -5,-0.2 -1,-0.2 0.902 62.7 150.5 -62.5 -43.3 -12.8 -0.2 9.1 90 90 A R < + 0 0 95 -4,-0.9 -1,-0.2 -3,-0.4 -2,-0.1 -0.256 7.5 148.8 49.3-113.1 -12.3 -3.1 11.5 91 91 A E + 0 0 98 10,-0.2 -1,-0.2 -3,-0.2 -2,-0.0 0.744 37.9 117.6 56.5 26.4 -15.0 -5.6 10.7 92 92 A H S S- 0 0 170 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.288 105.6 -51.5-115.3 46.3 -12.6 -8.4 11.7 93 93 A G S S+ 0 0 69 1,-0.2 2,-0.9 8,-0.1 -3,-0.0 0.820 83.3 166.2 89.3 35.8 -14.5 -9.8 14.6 94 94 A T + 0 0 24 7,-0.2 7,-1.3 2,-0.0 2,-0.5 -0.761 9.0 179.5 -91.3 105.2 -15.0 -6.6 16.4 95 95 A I E -D 100 0B 118 -2,-0.9 2,-0.5 5,-0.2 5,-0.3 -0.927 3.0-174.6-109.5 123.0 -17.6 -7.0 19.1 96 96 A Y E > -D 99 0B 53 3,-3.3 3,-1.9 -2,-0.5 -2,-0.0 -0.972 69.0 -12.1-122.8 125.5 -18.6 -4.1 21.2 97 97 A C T 3 S- 0 0 91 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.712 132.2 -50.3 61.2 22.9 -20.9 -4.2 24.2 98 98 A G T 3 S+ 0 0 70 1,-0.2 2,-0.4 0, 0.0 -1,-0.3 0.316 126.0 84.1 100.5 -8.0 -22.0 -7.7 23.1 99 99 A A E < S-D 96 0B 57 -3,-1.9 -3,-3.3 -82,-0.1 2,-0.4 -0.967 78.6-115.6-130.8 144.6 -22.7 -6.8 19.5 100 100 A A E -D 95 0B 62 -2,-0.4 -5,-0.2 -5,-0.3 2,-0.2 -0.632 31.1-136.5 -77.6 130.3 -20.6 -6.6 16.4 101 101 A I - 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