==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 14-DEC-11 3VMN . COMPND 2 MOLECULE: DEXTRANASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS MUTANS; . AUTHOR N.SUZUKI,Z.FUJIMOTO,Y.M.KIM,M.MOMMA,M.OKUYAMA,H.MORI,K.FUNAN . 633 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23993.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 435 68.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 39 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 133 21.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.8 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 . 59 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 66 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 105 16.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 0.9 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 1 1 0 1 1 0 0 1 0 2 1 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 1 1 4 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 PARALLEL BRIDGES PER LADDER . 9 5 6 2 1 0 3 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 4 1 2 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 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 1 102 A N 0 0 161 0, 0.0 2,-0.1 0, 0.0 469,-0.0 0.000 360.0 360.0 360.0 18.4 6.0 0.4 35.3 2 103 A G - 0 0 51 1,-0.1 2,-0.1 99,-0.0 99,-0.1 -0.434 360.0-117.0 -83.3 163.7 5.3 3.3 33.0 3 104 A N - 0 0 59 -2,-0.1 3,-0.2 97,-0.1 -1,-0.1 -0.429 8.9-133.3 -91.8 172.9 4.8 6.9 34.1 4 105 A M S S+ 0 0 104 -2,-0.1 97,-0.1 1,-0.1 -1,-0.0 0.028 77.9 104.5-113.1 23.5 1.6 9.0 33.7 5 106 A I - 0 0 0 95,-0.1 20,-2.0 19,-0.1 3,-0.2 0.792 64.7-156.4 -78.3 -25.8 3.4 12.1 32.4 6 107 A N - 0 0 107 -3,-0.2 2,-0.2 1,-0.2 17,-0.1 0.934 12.3-160.7 46.9 55.2 2.3 11.5 28.8 7 108 A L + 0 0 12 17,-0.1 2,-0.3 18,-0.1 17,-0.2 -0.426 19.0 173.7 -67.1 122.3 5.2 13.5 27.5 8 109 A T E -A 23 0A 21 15,-2.4 15,-2.5 -2,-0.2 2,-0.3 -0.975 21.2-157.4-135.7 153.3 4.2 14.4 23.9 9 110 A T E -A 22 0A 3 -2,-0.3 13,-0.2 13,-0.2 11,-0.0 -0.859 28.2-121.7-123.4 160.7 5.5 16.6 21.1 10 111 A D S S+ 0 0 65 11,-1.4 2,-0.3 -2,-0.3 12,-0.1 0.729 94.6 23.1 -73.9 -20.2 3.8 18.2 18.2 11 112 A K - 0 0 50 10,-0.2 189,-0.2 1,-0.1 188,-0.1 -0.920 66.4-130.4-138.3 161.1 6.1 16.4 15.7 12 113 A A S S+ 0 0 0 187,-2.4 94,-0.4 -2,-0.3 2,-0.3 0.755 96.1 16.0 -76.9 -29.3 8.4 13.4 15.5 13 114 A V S S- 0 0 13 186,-1.2 2,-0.3 92,-0.1 -1,-0.2 -0.967 70.7-148.8-147.8 152.8 11.3 15.4 14.1 14 115 A Y B -c 107 0B 3 92,-2.3 94,-2.6 -2,-0.3 2,-0.2 -0.960 14.8-131.5-131.0 139.8 12.3 19.1 13.9 15 116 A Q > - 0 0 86 -2,-0.3 3,-1.9 92,-0.2 61,-0.2 -0.624 39.1-112.6 -72.7 154.3 14.3 21.4 11.7 16 117 A A T 3 S+ 0 0 24 1,-0.3 60,-2.7 -2,-0.2 62,-0.5 0.818 118.3 54.7 -61.2 -31.9 16.7 23.5 13.7 17 118 A G T 3 S+ 0 0 48 58,-0.2 2,-0.4 59,-0.1 -1,-0.3 0.161 94.3 90.7 -85.6 18.2 14.6 26.7 12.9 18 119 A E S < S- 0 0 54 -3,-1.9 59,-0.2 56,-0.1 58,-0.2 -0.929 76.0-123.1-117.8 138.4 11.5 25.1 14.2 19 120 A A - 0 0 24 -2,-0.4 2,-0.6 56,-0.2 -4,-0.1 -0.495 18.9-130.4 -74.4 149.4 10.1 25.4 17.8 20 121 A V E - B 0 73A 2 53,-2.9 53,-2.1 -2,-0.2 2,-0.7 -0.907 18.1-159.7 -97.8 116.4 9.5 22.2 19.8 21 122 A H E - B 0 72A 40 -2,-0.6 -11,-1.4 51,-0.2 2,-0.3 -0.899 15.2-174.5 -98.0 116.9 6.0 22.3 21.4 22 123 A L E -AB 9 71A 3 49,-2.0 49,-0.6 -2,-0.7 2,-0.4 -0.784 12.1-164.5-108.4 149.0 5.8 19.9 24.3 23 124 A N E +A 8 0A 44 -15,-2.5 -15,-2.4 -2,-0.3 2,-0.3 -0.994 12.5 174.3-130.0 138.5 2.9 18.9 26.5 24 125 A L - 0 0 0 -2,-0.4 42,-3.0 -17,-0.2 2,-0.5 -0.974 24.5-127.8-141.0 158.9 3.2 17.1 29.8 25 126 A T E -G 65 0C 13 -20,-2.0 2,-0.6 -2,-0.3 40,-0.3 -0.948 10.4-154.8-115.4 127.6 0.8 16.1 32.5 26 127 A L E -G 64 0C 0 38,-3.1 38,-2.4 -2,-0.5 2,-0.6 -0.884 15.8-164.8 -99.4 121.5 1.2 17.0 36.2 27 128 A N E -G 63 0C 14 -2,-0.6 2,-1.5 36,-0.2 36,-0.2 -0.947 16.8-153.6-115.0 119.0 -0.6 14.4 38.5 28 129 A N + 0 0 2 34,-2.9 33,-1.7 -2,-0.6 34,-0.1 -0.675 23.9 168.1 -83.4 87.0 -1.2 15.1 42.1 29 130 A T + 0 0 80 -2,-1.5 2,-0.2 31,-0.1 -1,-0.2 0.181 48.4 95.5 -83.7 18.1 -1.3 11.4 43.2 30 131 A T S S- 0 0 26 2,-0.2 31,-1.0 29,-0.2 32,-0.2 -0.656 82.6-121.7-105.6 165.6 -1.2 12.6 46.9 31 132 A S S S+ 0 0 115 -2,-0.2 2,-0.4 29,-0.2 -1,-0.0 0.296 88.0 82.6 -83.2 7.5 -3.9 13.2 49.4 32 133 A L S S- 0 0 103 27,-0.1 2,-0.3 26,-0.0 -2,-0.2 -0.962 79.5-125.1-122.7 130.7 -2.8 16.9 49.9 33 134 A A + 0 0 30 -2,-0.4 2,-0.3 27,-0.1 26,-0.2 -0.507 60.0 131.9 -65.8 124.3 -3.7 20.0 47.8 34 135 A Q E -D 58 0B 14 24,-2.1 24,-2.5 -2,-0.3 2,-0.3 -0.985 61.7 -71.9-167.9 164.6 -0.3 21.4 47.0 35 136 A N E -D 57 0B 77 -2,-0.3 2,-0.4 22,-0.3 22,-0.3 -0.565 40.9-160.6 -68.2 128.6 2.0 22.7 44.2 36 137 A I E -D 56 0B 0 20,-2.7 20,-2.7 -2,-0.3 2,-0.5 -0.957 9.1-153.8-113.2 133.7 3.1 20.0 41.9 37 138 A T E -DE 55 91B 22 54,-2.7 54,-2.6 -2,-0.4 2,-0.5 -0.935 9.8-160.5-115.4 129.0 6.3 20.9 39.8 38 139 A A E -DE 54 90B 0 16,-3.1 16,-2.1 -2,-0.5 2,-0.5 -0.945 11.6-174.1-103.5 123.8 7.3 19.6 36.4 39 140 A T E -DE 53 89B 22 50,-2.7 50,-2.5 -2,-0.5 2,-0.5 -0.987 3.0-174.7-119.5 121.2 11.0 20.1 35.7 40 141 A A E -DE 52 88B 0 12,-2.6 12,-2.8 -2,-0.5 2,-0.4 -0.957 9.3-159.4-120.4 106.8 12.2 19.1 32.2 41 142 A E E -DE 51 87B 36 46,-2.8 46,-3.0 -2,-0.5 2,-0.7 -0.759 9.4-144.0 -89.8 130.7 16.0 19.3 31.8 42 143 A V E -DE 50 86B 1 8,-2.6 7,-2.2 -2,-0.4 8,-1.5 -0.866 23.6-170.9 -96.0 112.2 17.2 19.6 28.1 43 144 A Y E -DE 48 85B 48 42,-3.6 42,-2.3 -2,-0.7 2,-0.6 -0.849 26.2-163.0-106.8 142.8 20.5 17.7 27.7 44 145 A S E > S-D 47 0B 23 3,-2.8 3,-2.3 -2,-0.4 2,-0.2 -0.951 78.2 -57.2-112.4 100.4 22.9 17.6 24.8 45 146 A L T 3 S- 0 0 15 -2,-0.6 554,-0.1 439,-0.3 40,-0.1 -0.434 122.8 -16.3 55.5-124.5 24.8 14.5 25.8 46 147 A E T 3 S+ 0 0 50 -2,-0.2 2,-0.5 -3,-0.1 -1,-0.3 0.572 118.4 97.0 -83.0 -8.0 26.2 15.3 29.3 47 148 A N E < -D 44 0B 84 -3,-2.3 -3,-2.8 1,-0.0 2,-1.0 -0.698 68.2-141.9 -92.5 125.7 25.6 19.0 29.0 48 149 A K E +D 43 0B 100 -2,-0.5 -5,-0.3 -5,-0.2 3,-0.1 -0.702 22.7 176.9 -83.5 105.4 22.4 20.5 30.5 49 150 A L E - 0 0 74 -7,-2.2 2,-0.3 -2,-1.0 -1,-0.2 0.842 62.6 -1.0 -75.8 -40.6 21.4 23.2 28.0 50 151 A K E -D 42 0B 72 -8,-1.5 -8,-2.6 2,-0.0 2,-0.5 -0.989 52.1-142.1-148.0 155.2 18.2 24.3 29.7 51 152 A T E -D 41 0B 69 -2,-0.3 2,-0.3 -10,-0.2 -10,-0.2 -0.994 21.7-165.5-116.3 118.7 16.0 23.7 32.6 52 153 A L E +D 40 0B 25 -12,-2.8 -12,-2.6 -2,-0.5 2,-0.3 -0.777 15.7 173.6 -95.8 146.0 12.3 23.9 31.8 53 154 A Q E +D 39 0B 126 -2,-0.3 2,-0.3 -14,-0.2 -14,-0.2 -0.983 17.3 171.2-158.3 144.5 9.9 24.2 34.7 54 155 A Y E -D 38 0B 51 -16,-2.1 -16,-3.1 -2,-0.3 2,-0.4 -0.957 12.1-160.8-155.4 138.0 6.2 24.8 35.5 55 156 A T E -D 37 0B 61 -2,-0.3 2,-0.4 -18,-0.2 -18,-0.2 -0.939 6.3-175.8-124.5 142.6 4.3 24.5 38.7 56 157 A K E -D 36 0B 73 -20,-2.7 -20,-2.7 -2,-0.4 2,-0.5 -0.998 27.4-126.9-136.8 132.5 0.5 24.1 39.3 57 158 A Y E -D 35 0B 130 -2,-0.4 2,-0.4 -22,-0.3 -22,-0.3 -0.683 39.4-176.6 -74.7 122.0 -1.4 24.0 42.5 58 159 A L E -D 34 0B 0 -24,-2.5 -24,-2.1 -2,-0.5 3,-0.1 -0.977 23.8-127.4-131.0 138.2 -3.5 20.9 42.3 59 160 A L > - 0 0 94 -2,-0.4 3,-2.4 -26,-0.2 -31,-0.2 -0.254 58.4 -62.8 -72.0 167.8 -6.1 19.4 44.7 60 161 A P T 3 S+ 0 0 49 0, 0.0 -29,-0.2 0, 0.0 -1,-0.2 -0.304 126.1 3.7 -56.2 134.4 -5.7 15.8 45.8 61 162 A N T 3 S+ 0 0 127 -33,-1.7 2,-0.2 -31,-1.0 -32,-0.1 0.440 99.8 137.6 69.4 -0.2 -5.9 13.4 42.8 62 163 A E < - 0 0 79 -3,-2.4 -34,-2.9 -32,-0.2 2,-0.3 -0.544 34.2-164.8 -80.5 144.9 -6.2 16.4 40.4 63 164 A S E -G 27 0C 61 -36,-0.2 2,-0.4 -2,-0.2 -36,-0.2 -0.910 6.8-164.1-126.2 152.2 -4.2 16.4 37.2 64 165 A Y E -G 26 0C 42 -38,-2.4 -38,-3.1 -2,-0.3 2,-0.5 -0.982 8.1-153.5-137.6 128.1 -3.3 19.2 34.7 65 166 A T E -G 25 0C 71 -2,-0.4 -40,-0.2 -40,-0.3 -59,-0.0 -0.872 32.0-115.3 -99.9 128.3 -2.0 18.8 31.1 66 167 A T - 0 0 3 -42,-3.0 2,-0.2 -2,-0.5 3,-0.1 -0.262 29.5-130.0 -64.3 151.6 0.1 21.8 30.0 67 168 A Q > - 0 0 122 1,-0.1 3,-2.4 -44,-0.1 4,-0.5 -0.561 38.5 -68.3 -99.9 166.2 -1.3 23.9 27.1 68 169 A K T 3 S+ 0 0 160 1,-0.3 -1,-0.1 -2,-0.2 4,-0.1 -0.293 122.8 23.8 -54.7 129.2 0.3 25.1 24.0 69 170 A G T 3 S+ 0 0 49 2,-0.4 -1,-0.3 -47,-0.2 3,-0.2 0.047 96.6 94.7 103.9 -23.1 3.0 27.7 24.8 70 171 A E S < S+ 0 0 63 -3,-2.4 2,-0.5 1,-0.3 -2,-0.1 0.908 95.2 25.3 -74.5 -42.3 3.7 26.5 28.4 71 172 A F E S+B 22 0A 4 -49,-0.6 -49,-2.0 -4,-0.5 -2,-0.4 -0.986 84.2 150.3-117.7 116.0 6.6 24.2 27.6 72 173 A V E -B 21 0A 40 -2,-0.5 -51,-0.2 -51,-0.2 -53,-0.0 -0.998 39.7-153.5-144.6 140.9 8.4 25.2 24.5 73 174 A I E -B 20 0A 2 -53,-2.1 -53,-2.9 -2,-0.3 4,-0.1 -0.970 40.4-130.6-108.8 112.0 12.0 25.0 23.1 74 175 A P > - 0 0 72 0, 0.0 3,-1.1 0, 0.0 4,-0.2 -0.080 26.3 -83.1 -67.6 159.3 12.1 27.9 20.7 75 176 A A T 3 S+ 0 0 37 1,-0.2 -58,-0.2 -58,-0.2 -56,-0.2 -0.217 114.5 23.3 -49.0 147.1 13.3 27.9 17.1 76 177 A N T 3 S+ 0 0 133 -60,-2.7 -1,-0.2 -58,-0.2 -59,-0.1 0.720 90.0 110.9 64.8 23.7 17.1 28.1 16.7 77 178 A S S < S+ 0 0 38 -3,-1.1 2,-0.4 -61,-0.4 -2,-0.1 0.597 70.0 55.4 -92.3 -20.7 17.8 26.8 20.3 78 179 A L S S- 0 0 15 -62,-0.5 -2,-0.2 -4,-0.2 -1,-0.1 -0.953 85.1-115.2-123.3 136.1 19.3 23.5 19.2 79 180 A A - 0 0 61 -2,-0.4 3,-0.4 1,-0.1 28,-0.1 -0.385 44.9-102.5 -65.5 149.6 22.2 22.7 16.8 80 181 A N S S+ 0 0 57 1,-0.2 28,-0.2 -2,-0.1 -1,-0.1 -0.291 94.3 23.5 -78.2 157.9 21.2 20.8 13.7 81 182 A N S S+ 0 0 39 1,-0.2 2,-0.3 -2,-0.0 27,-0.2 0.906 98.8 114.9 57.0 48.8 21.5 17.0 13.0 82 183 A R E - F 0 107B 63 25,-1.5 25,-2.7 -3,-0.4 2,-0.4 -0.975 59.5-130.3-144.4 155.9 21.6 16.1 16.6 83 184 A G E - F 0 106B 0 -2,-0.3 -38,-0.3 401,-0.2 2,-0.3 -0.862 23.0-170.3-108.1 148.3 19.7 14.3 19.3 84 185 A Y E - F 0 105B 5 21,-2.3 21,-2.1 -2,-0.4 2,-0.5 -0.853 15.4-132.9-131.3 159.3 18.7 15.6 22.7 85 186 A L E -EF 43 104B 4 -42,-2.3 -42,-3.6 -2,-0.3 2,-0.6 -0.983 4.3-157.2-119.3 133.4 17.2 14.3 25.9 86 187 A L E -EF 42 103B 2 17,-3.2 17,-2.4 -2,-0.5 2,-0.7 -0.919 15.0-163.0-103.0 114.5 14.4 15.8 27.9 87 188 A K E -EF 41 102B 38 -46,-3.0 -46,-2.8 -2,-0.6 2,-0.5 -0.890 10.0-163.6-105.1 110.4 14.8 14.5 31.4 88 189 A V E +EF 40 101B 0 13,-1.9 13,-1.9 -2,-0.7 2,-0.4 -0.855 14.9 178.5-109.2 131.4 11.5 15.0 33.3 89 190 A N E -EF 39 100B 22 -50,-2.5 -50,-2.7 -2,-0.5 2,-0.5 -0.995 13.3-157.5-124.3 129.5 10.9 14.9 37.1 90 191 A I E -EF 38 99B 0 9,-3.0 8,-2.5 -2,-0.4 9,-1.3 -0.959 23.6-179.2-104.1 127.8 7.6 15.6 38.7 91 192 A S E -EF 37 97B 11 -54,-2.6 -54,-2.7 -2,-0.5 6,-0.2 -0.854 21.8-130.3-130.9 153.2 7.9 16.7 42.3 92 193 A D > - 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