==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 07-JUL-05 2CYG . COMPND 2 MOLECULE: BETA-1, 3-GLUCANANSE; . SOURCE 2 ORGANISM_SCIENTIFIC: MUSA ACUMINATA; . AUTHOR V.RECEVEUR-BRECHOT,M.CZJZEK,A.BARRE,A.ROUSSEL,W.J.PEUMANS, . 312 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12589.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 221 70.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 13.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 2.6 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 24 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 90 28.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.2 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 1 0 2 0 2 1 0 0 0 3 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 2 3 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 PARALLEL BRIDGES PER LADDER . 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 0 0 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 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 29 A I 0 0 35 0, 0.0 28,-1.3 0, 0.0 27,-1.1 0.000 360.0 360.0 360.0 153.7 14.6 1.7 1.6 2 30 A G E -ab 29 279A 1 276,-2.4 278,-2.6 26,-0.2 2,-0.4 -0.720 360.0-153.1-106.2 162.9 12.2 -0.2 3.9 3 31 A V E -ab 30 280A 0 26,-1.7 28,-1.5 276,-0.3 2,-0.4 -0.997 19.0-122.5-137.4 137.1 8.8 0.8 5.2 4 32 A C E -a 31 0A 0 276,-2.9 279,-2.7 -2,-0.4 2,-1.1 -0.648 19.4-146.7 -76.7 123.8 7.1 -0.4 8.4 5 33 A Y - 0 0 8 26,-2.7 28,-0.5 -2,-0.4 2,-0.3 -0.737 20.7-176.6 -95.6 84.1 3.7 -2.0 7.7 6 34 A G - 0 0 3 -2,-1.1 278,-0.2 278,-0.1 26,-0.0 -0.663 10.2-169.6 -76.4 139.1 1.6 -1.1 10.7 7 35 A M + 0 0 45 -2,-0.3 2,-1.8 1,-0.1 5,-0.2 0.330 47.4 115.1-114.5 3.4 -1.9 -2.6 10.6 8 36 A L + 0 0 101 278,-0.1 280,-2.1 2,-0.1 281,-0.4 -0.334 49.9 99.7 -85.5 56.4 -3.7 -0.8 13.4 9 37 A G - 0 0 16 -2,-1.8 3,-0.4 277,-0.2 277,-0.1 -0.951 67.3-140.0-124.4 156.5 -6.3 1.0 11.4 10 38 A N S S+ 0 0 116 -2,-0.3 -2,-0.1 1,-0.2 276,-0.1 0.408 99.9 41.6 -89.9 3.2 -9.9 -0.1 10.9 11 39 A N S S+ 0 0 75 2,-0.0 -1,-0.2 0, 0.0 -3,-0.1 0.049 78.6 130.7-142.5 23.4 -9.9 0.9 7.2 12 40 A L - 0 0 34 -3,-0.4 291,-0.1 -5,-0.2 -5,-0.0 -0.416 62.4 -95.8 -82.7 159.2 -6.6 -0.2 5.6 13 41 A P - 0 0 14 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.298 49.7 -90.8 -66.0 158.5 -6.3 -2.1 2.3 14 42 A P >> - 0 0 63 0, 0.0 4,-1.7 0, 0.0 3,-1.1 -0.379 43.2-103.5 -66.1 150.8 -5.9 -5.9 2.5 15 43 A P H 3> S+ 0 0 24 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.780 119.7 60.7 -47.2 -35.1 -2.3 -7.1 2.7 16 44 A S H 3> S+ 0 0 73 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.902 107.7 44.1 -62.1 -42.2 -2.3 -8.2 -1.0 17 45 A E H <> S+ 0 0 76 -3,-1.1 4,-1.8 2,-0.2 -1,-0.2 0.838 112.1 54.2 -66.8 -35.9 -3.0 -4.6 -2.1 18 46 A V H X S+ 0 0 0 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.926 107.4 49.1 -65.8 -43.6 -0.4 -3.4 0.4 19 47 A V H X S+ 0 0 9 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.913 110.4 51.8 -61.5 -42.5 2.2 -5.7 -1.1 20 48 A S H X S+ 0 0 75 -4,-1.8 4,-2.6 1,-0.2 -1,-0.2 0.882 108.4 51.7 -58.4 -39.9 1.3 -4.4 -4.6 21 49 A L H X S+ 0 0 19 -4,-1.8 4,-1.1 2,-0.2 -2,-0.2 0.881 108.9 50.1 -67.4 -39.4 1.7 -0.8 -3.4 22 50 A Y H <>S+ 0 0 0 -4,-2.2 5,-2.4 2,-0.2 3,-0.5 0.956 113.7 45.8 -58.5 -50.5 5.2 -1.6 -2.0 23 51 A K H ><5S+ 0 0 101 -4,-2.5 3,-1.2 1,-0.2 -2,-0.2 0.893 110.7 51.2 -63.8 -42.3 6.2 -3.2 -5.4 24 52 A S H 3<5S+ 0 0 82 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.719 112.5 47.4 -70.0 -22.1 4.8 -0.4 -7.5 25 53 A N T 3<5S- 0 0 40 -4,-1.1 287,-0.4 -3,-0.5 -1,-0.3 0.353 112.8-119.8 -96.7 3.0 6.7 2.2 -5.4 26 54 A N T < 5 + 0 0 132 -3,-1.2 2,-0.6 -4,-0.3 -3,-0.2 0.831 52.1 164.6 59.1 36.1 9.9 0.2 -5.6 27 55 A I < - 0 0 5 -5,-2.4 -1,-0.2 -6,-0.2 -25,-0.1 -0.778 20.8-164.7 -83.8 119.3 10.1 -0.2 -1.8 28 56 A A + 0 0 50 -27,-1.1 21,-2.3 -2,-0.6 2,-0.3 0.718 60.2 35.5 -82.4 -26.5 12.6 -3.0 -1.2 29 57 A R E -ac 2 49A 46 -28,-1.3 -26,-1.7 19,-0.2 2,-0.3 -0.928 57.3-163.4-137.4 154.5 12.0 -4.0 2.4 30 58 A M E -ac 3 50A 0 19,-2.5 21,-2.8 -2,-0.3 2,-0.5 -0.998 10.4-147.1-139.4 138.7 9.1 -4.3 4.9 31 59 A R E -ac 4 51A 0 -28,-1.5 -26,-2.7 -2,-0.3 2,-0.4 -0.933 12.9-166.4-104.3 131.6 8.8 -4.6 8.7 32 60 A L E - c 0 52A 2 19,-2.6 21,-2.4 -2,-0.5 -26,-0.1 -0.956 14.5-153.0-111.6 137.2 5.9 -6.6 10.2 33 61 A Y S S+ 0 0 52 -28,-0.5 19,-0.1 -2,-0.4 -1,-0.1 0.509 82.2 8.3 -89.2 -5.0 5.2 -6.3 13.9 34 62 A D S S- 0 0 64 21,-0.1 2,-2.3 20,-0.1 -1,-0.1 -0.952 90.9 -90.4-163.4 159.9 3.7 -9.8 14.1 35 63 A P - 0 0 19 0, 0.0 2,-0.3 0, 0.0 17,-0.0 -0.387 49.5-175.0 -77.3 66.3 3.5 -12.9 11.9 36 64 A N > - 0 0 48 -2,-2.3 4,-2.2 1,-0.2 5,-0.2 -0.478 18.2-148.1 -65.0 122.6 0.2 -11.9 10.3 37 65 A Q H > S+ 0 0 77 -2,-0.3 4,-2.1 1,-0.2 5,-0.2 0.848 94.3 53.9 -70.5 -34.6 -0.7 -14.9 8.1 38 66 A A H > S+ 0 0 55 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.880 111.4 47.1 -63.8 -38.1 -2.5 -12.8 5.5 39 67 A A H > S+ 0 0 1 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.919 111.2 49.7 -69.5 -44.5 0.5 -10.6 5.1 40 68 A L H X S+ 0 0 0 -4,-2.2 4,-0.6 1,-0.2 -2,-0.2 0.887 111.1 50.3 -64.3 -37.9 3.0 -13.5 4.9 41 69 A Q H >< S+ 0 0 101 -4,-2.1 3,-1.0 1,-0.2 -1,-0.2 0.922 110.9 49.0 -62.3 -45.0 0.8 -15.2 2.2 42 70 A A H 3< S+ 0 0 25 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.778 105.4 59.3 -65.8 -27.9 0.7 -11.9 0.2 43 71 A L H >< S+ 0 0 0 -4,-1.7 3,-2.1 -5,-0.1 4,-0.4 0.655 75.9 119.5 -77.4 -16.4 4.5 -11.6 0.5 44 72 A R T << S- 0 0 79 -3,-1.0 40,-0.2 -4,-0.6 39,-0.1 -0.291 89.9 -2.1 -54.4 128.1 5.0 -14.9 -1.3 45 73 A N T 3 S+ 0 0 125 38,-2.3 -1,-0.3 1,-0.1 39,-0.1 0.580 100.0 114.7 65.4 16.6 7.1 -14.4 -4.5 46 74 A S S < S- 0 0 8 -3,-2.1 -2,-0.1 37,-0.4 3,-0.1 0.674 71.4-138.4 -86.0 -21.0 7.1 -10.6 -4.0 47 75 A N + 0 0 124 36,-0.5 2,-0.4 -4,-0.4 -3,-0.1 0.515 54.1 142.4 65.8 10.6 10.9 -10.3 -3.5 48 76 A I - 0 0 5 -5,-0.3 37,-0.6 -19,-0.1 2,-0.3 -0.680 53.0-127.0 -79.3 127.9 10.3 -7.9 -0.6 49 77 A Q E -cd 29 85A 64 -21,-2.3 -19,-2.5 -2,-0.4 2,-0.5 -0.605 27.8-140.8 -80.7 137.6 12.8 -8.5 2.1 50 78 A V E -cd 30 86A 0 35,-2.0 37,-2.8 -2,-0.3 38,-1.9 -0.876 22.5-166.6-117.8 125.2 11.2 -8.9 5.5 51 79 A L E -cd 31 88A 0 -21,-2.8 -19,-2.6 -2,-0.5 2,-0.5 -0.943 27.3-166.8 -97.3 109.9 12.0 -7.8 9.1 52 80 A L E -cd 32 89A 0 36,-2.7 38,-2.2 -2,-0.7 2,-0.3 -0.907 7.3-145.6-110.2 124.4 9.6 -9.9 11.2 53 81 A D E - d 0 90A 4 -21,-2.4 38,-0.2 -2,-0.5 40,-0.1 -0.611 11.6-133.8 -84.6 141.0 9.0 -9.2 14.9 54 82 A V E - d 0 91A 2 36,-2.7 38,-0.9 -2,-0.3 5,-0.1 -0.863 40.0-118.2 -78.7 121.3 8.3 -11.7 17.5 55 83 A P >> - 0 0 24 0, 0.0 3,-2.0 0, 0.0 4,-0.8 -0.251 16.6-114.4 -61.4 153.6 5.3 -10.2 19.4 56 84 A R H >> S+ 0 0 155 1,-0.3 3,-0.6 2,-0.2 4,-0.5 0.824 115.5 61.6 -59.7 -31.5 5.7 -9.3 23.0 57 85 A S H 34 S+ 0 0 100 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.529 107.0 45.3 -73.1 -7.2 3.1 -12.0 24.0 58 86 A D H <> S+ 0 0 49 -3,-2.0 4,-2.0 2,-0.1 -1,-0.2 0.577 88.5 84.4-107.5 -16.0 5.4 -14.7 22.5 59 87 A V H S+ 0 0 52 1,-0.2 4,-2.5 2,-0.2 7,-0.3 0.903 108.0 53.5 -64.7 -42.4 7.4 -18.8 25.7 62 90 A L H < S+ 0 0 4 -4,-2.0 7,-0.3 1,-0.2 -1,-0.2 0.815 115.5 42.6 -64.2 -28.6 10.2 -18.8 23.1 63 91 A A H < S+ 0 0 16 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.895 125.9 28.7 -76.7 -43.6 12.7 -18.4 26.0 64 92 A S H < S+ 0 0 76 -4,-2.4 -3,-0.2 -5,-0.1 -2,-0.2 0.712 105.3 67.8-102.3 -29.7 11.2 -20.9 28.5 65 93 A N >X - 0 0 73 -4,-2.5 3,-1.3 -5,-0.2 4,-0.6 -0.888 68.7-150.5 -98.0 114.6 9.4 -23.7 26.6 66 94 A P T 34 S+ 0 0 124 0, 0.0 4,-0.3 0, 0.0 -1,-0.1 0.712 94.7 47.2 -62.7 -22.9 12.0 -25.8 24.7 67 95 A S T 3> S+ 0 0 58 1,-0.1 4,-2.1 2,-0.1 5,-0.2 0.647 94.6 79.5 -85.0 -18.8 9.6 -26.7 21.9 68 96 A A H <> S+ 0 0 10 -3,-1.3 4,-2.4 -7,-0.3 -6,-0.2 0.859 88.0 49.5 -66.4 -42.2 8.3 -23.1 21.3 69 97 A A H X S+ 0 0 3 -4,-0.6 4,-2.4 -7,-0.3 -1,-0.2 0.909 113.6 47.3 -66.3 -41.6 11.0 -21.6 19.2 70 98 A G H > S+ 0 0 10 -4,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.906 113.4 48.3 -62.7 -44.0 11.1 -24.5 16.8 71 99 A D H X S+ 0 0 67 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.878 112.2 49.5 -63.2 -40.4 7.3 -24.5 16.5 72 100 A W H X S+ 0 0 7 -4,-2.4 4,-2.5 2,-0.2 5,-0.3 0.924 113.2 45.3 -67.3 -45.5 7.3 -20.7 15.9 73 101 A I H X>S+ 0 0 3 -4,-2.4 5,-2.7 1,-0.2 4,-1.8 0.876 113.1 50.7 -67.2 -36.7 9.9 -20.8 13.2 74 102 A R H <>S+ 0 0 138 -4,-2.2 5,-1.3 3,-0.2 -2,-0.2 0.911 117.2 39.6 -69.8 -37.8 8.3 -23.8 11.5 75 103 A R H <5S+ 0 0 135 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.889 128.6 27.8 -74.8 -42.9 4.9 -22.1 11.4 76 104 A N H <5S+ 0 0 6 -4,-2.5 -3,-0.2 -5,-0.2 -2,-0.2 0.603 135.5 16.6-103.4 -14.8 5.9 -18.5 10.6 77 105 A V T >X5S+ 0 0 0 -4,-1.8 3,-1.5 -5,-0.3 4,-0.6 0.694 122.0 45.7-123.6 -62.0 9.2 -18.9 8.6 78 106 A V G >4 S+ 0 0 10 -3,-1.5 4,-2.4 -6,-0.1 -1,-0.2 0.341 95.4 144.2-113.0 3.0 6.8 -19.5 3.9 81 109 A W T << + 0 0 76 -3,-0.9 4,-0.1 -4,-0.6 -4,-0.0 -0.783 64.4 3.8-102.1 139.9 10.4 -20.1 2.9 82 110 A P T 4 S+ 0 0 98 0, 0.0 -1,-0.3 0, 0.0 -37,-0.1 -0.972 122.7 63.9 -94.3 11.1 11.9 -19.5 0.3 83 111 A S T 4 S+ 0 0 22 -39,-0.1 -38,-2.3 2,-0.1 2,-0.5 0.800 101.5 58.7 -63.1 -28.6 8.9 -17.7 -1.3 84 112 A V S < S- 0 0 1 -4,-2.4 2,-1.8 -40,-0.2 -40,-0.1 -0.908 87.6-136.4-102.8 126.9 9.0 -15.0 1.4 85 113 A S E -d 49 0A 23 -37,-0.6 -35,-2.0 -2,-0.5 -2,-0.1 -0.455 27.3-170.5 -86.5 68.4 12.4 -13.3 1.5 86 114 A F E +d 50 0A 0 -2,-1.8 -35,-0.2 -37,-0.2 3,-0.1 -0.285 18.2 165.2 -61.5 143.0 13.0 -13.2 5.3 87 115 A R E + 0 0 62 -37,-2.8 39,-2.2 1,-0.4 2,-0.3 0.604 59.5 16.4-128.3 -40.3 15.9 -11.0 6.4 88 116 A Y E -de 51 126A 11 -38,-1.9 -36,-2.7 37,-0.2 2,-0.5 -0.994 46.7-154.7-139.2 148.3 15.5 -10.5 10.2 89 117 A I E -de 52 127A 0 37,-2.3 39,-2.5 -2,-0.3 2,-0.7 -0.996 20.6-157.6-112.5 119.4 13.7 -11.8 13.2 90 118 A A E -de 53 128A 0 -38,-2.2 -36,-2.7 -2,-0.5 2,-1.4 -0.876 4.6-152.3 -99.0 110.0 13.4 -9.1 15.9 91 119 A V E -d 54 0A 0 37,-3.0 18,-0.1 -2,-0.7 -38,-0.1 -0.661 67.9 -17.5 -86.7 89.3 12.9 -10.6 19.3 92 120 A G E - 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