==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 27-APR-06 2GT2 . COMPND 2 MOLECULE: GDP-MANNOSE MANNOSYL HYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR S.B.GABELLI,M.A.BIANCHET,H.F.AZURMENDI,A.S.MILDVAN,L.M.AMZEL . 608 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27852.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 400 65.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 7.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 106 17.4 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 . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.7 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 . 53 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 69 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 108 17.8 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 8 0 4 0 0 0 4 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 0 0 0 0 0 0 4 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 . 8 4 4 2 2 0 0 4 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 . 0 0 0 0 0 0 4 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 3 A F 0 0 259 0, 0.0 2,-0.3 0, 0.0 163,-0.0 0.000 360.0 360.0 360.0 147.8 26.4 31.8 97.6 2 4 A L - 0 0 64 162,-0.1 2,-0.3 2,-0.0 162,-0.0 -0.658 360.0-135.3 -97.7 139.5 25.7 33.8 100.7 3 5 A R >> - 0 0 154 -2,-0.3 4,-1.8 1,-0.1 3,-1.5 -0.679 33.6-107.2 -85.1 145.0 27.8 36.3 102.6 4 6 A Q H 3> S+ 0 0 106 -2,-0.3 4,-1.9 1,-0.3 5,-0.1 0.792 118.7 51.9 -32.3 -51.7 28.0 36.1 106.4 5 7 A E H 3> S+ 0 0 98 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.828 110.3 47.9 -63.7 -36.3 25.8 39.2 106.9 6 8 A D H <> S+ 0 0 34 -3,-1.5 4,-2.1 2,-0.2 -1,-0.2 0.822 110.6 49.7 -77.5 -33.6 23.0 37.9 104.6 7 9 A F H X S+ 0 0 43 -4,-1.8 4,-3.1 2,-0.2 -2,-0.2 0.832 109.2 53.6 -72.9 -33.2 22.9 34.4 106.2 8 10 A A H X S+ 0 0 17 -4,-1.9 4,-2.5 -5,-0.3 -2,-0.2 0.923 109.6 47.6 -60.5 -47.7 22.7 36.1 109.6 9 11 A T H X S+ 0 0 17 -4,-1.7 4,-1.6 2,-0.2 -2,-0.2 0.902 113.5 49.3 -58.4 -45.0 19.7 38.1 108.3 10 12 A V H >X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 3,-0.5 0.970 113.3 43.9 -57.6 -57.1 18.2 34.9 107.0 11 13 A V H 3< S+ 0 0 2 -4,-3.1 89,-0.2 1,-0.2 -2,-0.2 0.878 115.6 50.9 -58.8 -38.3 18.7 32.9 110.3 12 14 A R H 3< S+ 0 0 105 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.826 120.2 32.4 -64.1 -35.0 17.4 36.0 112.2 13 15 A S H << S+ 0 0 27 -4,-1.6 191,-0.6 -3,-0.5 -2,-0.2 0.639 116.8 22.7-106.2 -20.1 14.3 36.4 110.1 14 16 A T S < S- 0 0 1 -4,-2.1 86,-0.4 -5,-0.1 2,-0.2 -0.974 76.8 -90.2-151.0 153.6 13.0 33.0 108.9 15 17 A P - 0 0 0 0, 0.0 86,-0.2 0, 0.0 2,-0.2 -0.491 39.1-132.4 -65.3 140.5 12.9 29.2 109.4 16 18 A L E -a 101 0A 1 84,-3.6 86,-3.3 -2,-0.2 2,-0.5 -0.578 14.6-132.9 -82.7 155.3 15.6 27.2 107.7 17 19 A V E +a 102 0A 2 34,-0.4 34,-3.8 -2,-0.2 2,-0.3 -0.965 33.2 169.2-113.2 126.7 14.7 24.1 105.7 18 20 A S E -aB 103 50A 4 84,-2.1 86,-2.8 -2,-0.5 2,-0.4 -0.908 31.8-134.0-135.5 161.4 16.7 20.9 106.3 19 21 A L E -aB 104 49A 0 30,-2.7 30,-1.8 -2,-0.3 2,-0.4 -0.964 20.1-163.3-110.6 132.3 16.8 17.2 105.7 20 22 A D E -aB 105 48A 17 84,-2.4 86,-2.4 -2,-0.4 2,-0.6 -0.958 8.4-147.5-114.5 137.4 17.6 14.9 108.5 21 23 A F E -a 106 0A 0 26,-3.1 2,-1.0 -2,-0.4 86,-0.2 -0.907 8.3-159.6-112.0 120.7 18.7 11.3 107.9 22 24 A I E -a 107 0A 2 84,-3.1 86,-2.3 -2,-0.6 2,-0.6 -0.849 25.3-169.3 -93.7 100.5 17.9 8.4 110.2 23 25 A V E -a 108 0A 0 -2,-1.0 8,-2.0 8,-0.4 2,-0.4 -0.845 6.1-168.4-106.4 115.8 20.6 6.0 109.0 24 26 A E E -aC 109 30A 38 84,-2.5 86,-3.2 -2,-0.6 6,-0.2 -0.841 2.6-160.3-107.2 138.5 20.5 2.4 110.2 25 27 A N > - 0 0 2 4,-2.4 3,-1.3 -2,-0.4 86,-0.1 -0.290 43.1 -77.6 -98.9-168.4 23.2 -0.2 109.7 26 28 A S T 3 S+ 0 0 110 1,-0.2 85,-0.1 2,-0.1 -2,-0.0 0.796 127.8 51.2 -56.9 -37.9 23.3 -4.1 109.8 27 29 A R T 3 S- 0 0 187 2,-0.1 -1,-0.2 1,-0.0 3,-0.1 0.335 119.7-105.1 -88.3 4.9 23.2 -4.3 113.6 28 30 A G S < S+ 0 0 24 -3,-1.3 96,-0.4 1,-0.3 2,-0.2 0.725 77.7 138.7 73.5 23.8 20.1 -2.0 113.9 29 31 A E - 0 0 40 94,-0.2 -4,-2.4 95,-0.1 2,-0.4 -0.644 45.8-131.3 -97.5 158.4 22.3 0.9 115.1 30 32 A F E -CD 24 122A 15 92,-3.7 92,-2.5 -2,-0.2 2,-0.3 -0.892 16.0-114.2-119.7 141.4 22.0 4.5 113.9 31 33 A L E + D 0 121A 11 -8,-2.0 -8,-0.4 -2,-0.4 2,-0.3 -0.531 35.5 174.7 -76.0 129.1 24.6 7.0 112.7 32 34 A L E - D 0 120A 0 88,-2.2 88,-2.2 -2,-0.3 2,-0.4 -0.978 12.6-156.9-131.2 146.6 25.2 10.1 114.8 33 35 A G E -ED 45 119A 14 12,-3.4 12,-2.9 -2,-0.3 2,-0.4 -0.963 20.1-118.8-126.2 142.5 27.8 12.8 114.4 34 36 A K E -E 44 0A 84 84,-3.2 2,-0.5 -2,-0.4 10,-0.2 -0.640 25.7-132.6 -79.1 129.2 29.4 15.2 116.9 35 37 A R - 0 0 89 8,-2.8 7,-2.9 -2,-0.4 -1,-0.0 -0.730 21.9-177.6 -82.9 127.3 28.7 18.9 116.2 36 38 A T + 0 0 87 -2,-0.5 2,-0.3 5,-0.2 -1,-0.1 0.463 65.3 41.5-105.1 -6.6 31.9 21.0 116.4 37 39 A N S S- 0 0 101 2,-0.2 5,-0.1 3,-0.1 55,-0.1 -0.888 93.9 -39.6-134.3 167.3 30.4 24.4 115.8 38 40 A R S S+ 0 0 92 54,-0.4 2,-0.1 -2,-0.3 54,-0.1 -0.290 92.1 60.9 -63.5 152.9 27.3 26.3 116.8 39 41 A P S S- 0 0 6 0, 0.0 -2,-0.2 0, 0.0 53,-0.1 0.581 131.4 -10.0 -83.3 161.6 24.4 25.8 117.2 40 42 A A S > S- 0 0 7 1,-0.1 3,-1.6 -2,-0.1 -5,-0.2 0.889 88.0-160.5 52.9 44.6 24.3 23.3 120.1 41 43 A Q T 3 + 0 0 105 1,-0.2 -5,-0.2 -5,-0.1 -1,-0.1 -0.250 67.9 26.3 -51.2 134.4 28.0 22.7 119.8 42 44 A G T 3 S+ 0 0 35 -7,-2.9 -1,-0.2 1,-0.3 2,-0.1 0.126 93.3 113.9 98.3 -20.4 29.2 19.5 121.4 43 45 A Y < - 0 0 42 -3,-1.6 -8,-2.8 -9,-0.1 2,-0.4 -0.454 66.1-118.4 -82.9 158.3 26.0 17.5 121.0 44 46 A W E +Ef 34 133A 23 88,-2.9 90,-1.9 -10,-0.2 2,-0.3 -0.849 36.2 177.4-100.6 131.4 25.6 14.4 118.7 45 47 A F E -E 33 0A 20 -12,-2.9 -12,-3.4 -2,-0.4 3,-0.1 -0.906 34.9-100.0-130.1 154.1 23.0 14.6 115.9 46 48 A V - 0 0 8 -2,-0.3 -14,-0.2 -14,-0.2 -24,-0.1 -0.311 59.2 -88.0 -56.8 154.5 21.8 12.5 113.0 47 49 A P S S+ 0 0 4 0, 0.0 -26,-3.1 0, 0.0 2,-0.3 -0.346 72.5 113.0 -64.8 153.9 23.4 13.5 109.6 48 50 A G E -B 20 0A 17 -28,-0.2 2,-0.3 16,-0.1 -28,-0.2 -0.975 35.9-154.1 168.7-172.6 21.7 16.2 107.6 49 51 A G E -B 19 0A 20 -30,-1.8 -30,-2.7 -2,-0.3 2,-0.1 -0.967 32.0 -77.8-178.2 167.5 21.8 19.7 106.2 50 52 A R E -B 18 0A 39 -2,-0.3 2,-0.4 -32,-0.3 -32,-0.3 -0.464 37.8-118.5 -85.3 149.5 19.8 22.6 105.0 51 53 A V - 0 0 0 -34,-3.8 -34,-0.4 -2,-0.1 2,-0.2 -0.705 35.4-138.3 -81.0 134.1 18.0 23.0 101.6 52 54 A Q > - 0 0 84 -2,-0.4 3,-2.0 4,-0.2 113,-0.1 -0.511 30.8 -70.9 -97.9 161.9 19.3 25.9 99.6 53 55 A K T 3 S+ 0 0 39 111,-0.7 -1,-0.1 1,-0.3 3,-0.1 -0.233 116.6 0.9 -50.7 129.8 17.6 28.5 97.5 54 56 A D T 3 S+ 0 0 76 1,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.599 99.2 128.7 62.6 16.5 16.1 27.2 94.3 55 57 A E < - 0 0 29 -3,-2.0 -1,-0.2 196,-0.0 2,-0.1 -0.865 56.3-129.8 -97.4 133.0 17.3 23.6 95.1 56 58 A T > - 0 0 52 -2,-0.4 4,-2.3 1,-0.1 -4,-0.2 -0.374 18.9-118.2 -73.3 159.0 14.7 20.9 94.8 57 59 A L H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.883 116.9 56.2 -60.6 -39.0 14.3 18.4 97.7 58 60 A E H > S+ 0 0 59 1,-0.2 4,-1.6 2,-0.2 17,-0.2 0.912 110.6 42.0 -61.0 -46.6 15.3 15.7 95.2 59 61 A A H > S+ 0 0 43 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.866 113.5 53.7 -68.3 -38.7 18.6 17.4 94.4 60 62 A A H X S+ 0 0 0 -4,-2.3 4,-3.1 2,-0.2 5,-0.3 0.915 106.6 51.7 -61.7 -45.5 19.2 18.3 98.1 61 63 A F H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 12,-0.3 0.932 112.9 45.0 -57.9 -48.2 18.7 14.6 99.2 62 64 A E H X S+ 0 0 70 -4,-1.6 4,-1.3 1,-0.2 11,-0.3 0.886 116.4 45.7 -63.8 -43.2 21.3 13.5 96.6 63 65 A R H X S+ 0 0 83 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.913 116.6 44.5 -65.2 -44.9 23.8 16.3 97.5 64 66 A L H X S+ 0 0 8 -4,-3.1 4,-3.0 2,-0.2 5,-0.4 0.837 109.6 53.2 -75.7 -35.4 23.4 15.8 101.2 65 67 A T H X S+ 0 0 0 -4,-2.5 4,-1.6 -5,-0.3 6,-1.5 0.865 114.9 44.0 -64.9 -36.0 23.6 12.0 101.3 66 68 A M H X S+ 0 0 96 -4,-1.3 4,-1.2 4,-0.2 -2,-0.2 0.920 118.9 42.3 -71.9 -45.7 26.9 12.3 99.3 67 69 A A H < S+ 0 0 73 -4,-2.5 -2,-0.2 2,-0.2 -3,-0.2 0.930 125.5 32.9 -65.8 -47.0 28.2 15.1 101.5 68 70 A E H < S+ 0 0 61 -4,-3.0 -3,-0.2 -5,-0.1 -2,-0.2 0.838 135.3 21.5 -82.4 -37.5 27.2 13.7 104.8 69 71 A L H < S- 0 0 3 -4,-1.6 47,-1.9 -5,-0.4 -3,-0.2 0.576 94.6-121.2-110.1 -17.2 27.5 9.9 104.2 70 72 A G S < S+ 0 0 15 -4,-1.2 2,-0.4 -5,-0.5 -4,-0.2 0.615 85.4 98.5 78.2 14.5 29.9 9.7 101.3 71 73 A L S S- 0 0 48 -6,-1.5 2,-0.7 45,-0.1 -2,-0.2 -0.954 71.2-136.9-138.5 114.9 27.2 7.8 99.3 72 74 A R + 0 0 168 -2,-0.4 -10,-0.1 -6,-0.1 -9,-0.1 -0.607 31.9 178.1 -75.0 111.0 25.0 9.6 96.7 73 75 A L - 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0 0 24 -2,-0.3 2,-0.4 -86,-0.1 -9,-0.2 -0.380 21.9-133.5 -87.5 163.1 18.0 32.0 117.7 99 101 A T E - G 0 88A 3 -11,-2.9 -11,-3.4 -9,-0.3 2,-0.4 -0.965 17.0-166.5-116.9 139.7 18.0 29.4 115.0 100 102 A H E - G 0 87A 1 -2,-0.4 -84,-3.6 -86,-0.4 2,-0.4 -0.988 4.1-173.0-128.9 120.8 14.8 27.8 113.6 101 103 A Y E -aG 16 86A 46 -15,-3.1 -15,-2.4 -2,-0.4 2,-0.6 -0.951 17.4-159.2-112.1 133.2 14.6 24.6 111.4 102 104 A V E -aG 17 85A 3 -86,-3.3 -84,-2.1 -2,-0.4 2,-0.4 -0.966 33.3-156.5 -98.9 122.4 11.7 23.1 109.7 103 105 A V E -aG 18 84A 0 -19,-3.0 -19,-3.2 -2,-0.6 2,-0.6 -0.873 24.0-157.5-117.3 131.0 13.0 19.5 109.1 104 106 A L E -aG 19 83A 1 -86,-2.8 -84,-2.4 -2,-0.4 2,-0.3 -0.918 23.8-152.8-100.2 113.8 12.1 16.8 106.7 105 107 A G E -a 20 0A 0 -23,-2.3 -24,-3.2 -2,-0.6 2,-0.4 -0.664 11.3-170.7 -88.1 143.7 13.2 13.4 108.2 106 108 A F E -aG 21 80A 4 -86,-2.4 -84,-3.1 -2,-0.3 2,-0.4 -0.992 6.7-155.0-136.2 130.1 14.1 10.4 106.0 107 109 A R E +aG 22 79A 68 -28,-3.0 -28,-3.3 -2,-0.4 2,-0.3 -0.857 25.3 147.0-104.6 136.0 14.8 6.9 107.2 108 110 A F E -a 23 0A 18 -86,-2.3 -84,-2.5 -2,-0.4 2,-0.4 -0.983 38.1-120.1-159.9 164.6 16.9 4.3 105.4 109 111 A R E -a 24 0A 190 -2,-0.3 2,-0.3 -32,-0.2 -84,-0.2 -0.847 30.0-179.0-109.6 140.6 19.3 1.4 105.9 110 112 A V - 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