==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 03-AUG-00 1FI4 . COMPND 2 MOLECULE: MEVALONATE 5-DIPHOSPHATE DECARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR J.B.BONANNO,C.EDO,N.ESWAR,U.PIEPER,M.J.ROMANOWSKI,V.ILYIN, . 391 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17541.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 263 67.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 67 17.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 0 0.0 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 . 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 . 28 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 119 30.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.8 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 1 0 0 0 1 3 0 1 0 2 1 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 2 2 0 2 2 1 3 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 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 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 V 0 0 71 0, 0.0 2,-0.4 0, 0.0 50,-0.2 0.000 360.0 360.0 360.0 100.7 45.8 35.6 21.4 2 4 A Y E -A 50 0A 98 48,-2.4 48,-2.3 95,-0.0 2,-0.3 -0.742 360.0-179.5 -91.8 133.4 44.9 38.7 19.4 3 5 A T E +A 49 0A 53 -2,-0.4 2,-0.3 46,-0.2 46,-0.2 -0.931 15.4 177.3-135.0 158.1 43.0 41.4 21.2 4 6 A A E -A 48 0A 8 44,-2.1 44,-3.2 -2,-0.3 2,-0.3 -0.946 8.1-164.6-158.5 135.2 41.4 44.8 20.5 5 7 A S E +A 47 0A 5 375,-0.5 375,-1.7 -2,-0.3 2,-0.3 -0.946 10.2 173.3-126.3 147.6 39.3 47.2 22.6 6 8 A V E -AB 46 379A 1 40,-1.9 40,-2.2 -2,-0.3 2,-0.4 -0.932 23.5-140.9-144.6 164.4 37.2 50.2 21.7 7 9 A T E -AB 45 378A 15 371,-1.5 371,-2.9 -2,-0.3 38,-0.2 -0.992 22.5-169.2-127.5 135.2 34.8 52.7 23.3 8 10 A A E -A 44 0A 0 36,-1.9 36,-2.0 -2,-0.4 2,-0.2 -0.927 11.3-133.7-126.2 153.1 31.7 53.8 21.3 9 11 A P - 0 0 0 0, 0.0 2,-0.2 0, 0.0 34,-0.1 -0.560 12.1-121.9-103.4 169.0 29.2 56.6 22.0 10 12 A V - 0 0 2 32,-0.3 27,-2.4 27,-0.2 2,-0.3 -0.577 25.7-153.5 -98.0 166.8 25.4 56.8 22.0 11 13 A N E -F 36 0B 11 25,-0.2 2,-0.5 -2,-0.2 106,-0.3 -0.982 8.0-141.1-142.3 148.3 23.7 59.4 19.7 12 14 A I E -F 35 0B 3 23,-2.3 23,-2.5 -2,-0.3 2,-0.2 -0.968 25.0-128.0-113.5 127.0 20.3 61.1 20.0 13 15 A A E -F 34 0B 5 -2,-0.5 21,-0.3 21,-0.3 3,-0.2 -0.520 24.3-179.2 -77.8 137.8 18.3 61.6 16.7 14 16 A T E S+ 0 0 0 19,-2.5 2,-0.7 1,-0.3 20,-0.2 0.714 87.8 42.8-101.9 -33.7 17.1 65.0 15.8 15 17 A L E S-F 33 0B 0 18,-1.8 18,-1.4 239,-0.0 -1,-0.3 -0.961 107.0-123.7-112.0 106.7 15.4 63.7 12.6 16 18 A K - 0 0 5 -2,-0.7 2,-0.7 -3,-0.2 18,-0.1 -0.219 14.6-147.5 -66.4 139.8 13.8 60.5 13.8 17 19 A Y + 0 0 32 16,-0.1 2,-0.2 15,-0.0 15,-0.1 -0.903 39.1 147.4 -98.1 118.6 14.3 57.0 12.5 18 20 A W + 0 0 7 -2,-0.7 2,-0.1 1,-0.3 -2,-0.0 -0.726 44.8 29.9-159.3 103.4 10.9 55.2 13.0 19 21 A G - 0 0 0 -2,-0.2 10,-1.8 10,-0.1 11,-0.4 0.046 62.0-131.6 118.3 132.3 9.7 52.6 10.7 20 22 A K E -I 28 0C 50 8,-0.3 3,-0.2 9,-0.1 194,-0.0 -0.917 7.9-164.7-114.1 141.8 11.4 49.9 8.5 21 23 A R E S+ 0 0 96 6,-2.5 2,-0.3 -2,-0.4 -1,-0.1 0.557 92.6 27.9 -96.1 -11.0 10.5 49.3 4.9 22 24 A D E >> -I 27 0C 47 5,-1.6 5,-1.7 1,-0.1 4,-0.5 -0.911 63.1-170.3-150.4 115.3 12.4 46.0 5.1 23 25 A T T 45S+ 0 0 101 -2,-0.3 -1,-0.1 3,-0.2 -2,-0.0 0.618 85.7 56.7 -83.9 -13.7 12.7 44.1 8.4 24 26 A K T 45S+ 0 0 144 1,-0.1 -1,-0.2 3,-0.0 -2,-0.0 0.866 119.6 26.5 -85.2 -38.8 15.3 41.6 7.2 25 27 A L T 45S- 0 0 42 2,-0.1 -2,-0.2 146,-0.1 -1,-0.1 0.440 106.0-120.3-101.4 -2.2 17.9 44.1 6.0 26 28 A N T <5 + 0 0 4 -4,-0.5 -3,-0.2 1,-0.2 125,-0.1 0.947 50.5 167.8 61.4 49.4 16.9 46.8 8.4 27 29 A L E < -I 22 0C 2 -5,-1.7 -6,-2.5 144,-0.1 -5,-1.6 -0.827 26.0-133.3 -95.1 133.1 16.1 49.3 5.6 28 30 A P E -I 20 0C 0 0, 0.0 -8,-0.3 0, 0.0 3,-0.1 -0.402 13.3-130.4 -87.8 162.9 14.3 52.4 6.9 29 31 A T S S+ 0 0 16 -10,-1.8 2,-0.3 1,-0.1 -9,-0.1 0.621 94.1 7.6 -81.9 -14.6 11.2 54.3 5.6 30 32 A N S S- 0 0 1 -11,-0.4 -1,-0.1 198,-0.1 2,-0.1 -0.976 83.9 -95.1-159.0 164.0 13.1 57.5 5.8 31 33 A S - 0 0 19 -2,-0.3 2,-0.3 193,-0.1 135,-0.2 -0.393 37.7-155.2 -79.7 165.5 16.6 58.9 6.5 32 34 A S E - G 0 165B 0 133,-1.6 133,-3.0 -2,-0.1 2,-0.4 -0.976 7.3-153.2-141.9 153.5 17.5 60.1 10.0 33 35 A I E +FG 15 164B 0 -18,-1.4 -19,-2.5 -2,-0.3 -18,-1.8 -0.977 18.4 178.6-127.3 140.2 20.1 62.5 11.5 34 36 A S E -FG 13 163B 0 129,-2.6 129,-2.3 -2,-0.4 2,-0.5 -0.944 26.9-127.5-141.0 163.1 21.6 62.3 15.0 35 37 A V E -FG 12 162B 1 -23,-2.5 -23,-2.3 -2,-0.3 2,-0.4 -0.962 27.1-133.1-115.3 124.9 24.1 64.0 17.2 36 38 A T E -F 11 0B 0 125,-2.6 338,-2.4 -2,-0.5 2,-0.3 -0.609 20.8-137.8 -78.1 130.1 26.8 61.9 18.8 37 39 A L B -J 373 0D 0 -27,-2.4 336,-0.2 -2,-0.4 -27,-0.2 -0.661 29.1 -88.9 -94.8 145.0 27.3 62.4 22.5 38 40 A S >> - 0 0 10 334,-3.0 4,-2.2 -2,-0.3 3,-0.9 -0.154 20.8-145.7 -53.0 137.5 30.7 62.6 24.2 39 41 A Q T 34 S+ 0 0 22 1,-0.2 -1,-0.2 2,-0.2 -31,-0.1 0.473 94.9 76.4 -81.6 -2.9 32.3 59.4 25.4 40 42 A D T 34 S+ 0 0 149 1,-0.1 -1,-0.2 2,-0.0 3,-0.1 0.663 112.0 25.0 -79.1 -14.7 33.7 61.4 28.3 41 43 A D T <4 S+ 0 0 34 -3,-0.9 2,-0.4 1,-0.4 -2,-0.2 0.752 135.0 19.6-112.0 -51.6 30.2 61.2 29.7 42 44 A L S < S+ 0 0 4 -4,-2.2 -1,-0.4 -32,-0.1 2,-0.3 -0.988 73.8 143.4-129.2 135.1 28.6 58.2 28.2 43 45 A R - 0 0 46 -2,-0.4 66,-1.3 -34,-0.1 2,-0.4 -0.995 39.2-134.4-164.9 160.3 30.2 55.2 26.6 44 46 A T E -AC 8 108A 2 -36,-2.0 -36,-1.9 -2,-0.3 2,-0.6 -0.958 20.8-153.2-117.4 135.5 30.3 51.5 25.9 45 47 A L E +AC 7 107A 1 62,-3.7 62,-1.2 -2,-0.4 2,-0.5 -0.955 16.6 179.8-114.0 116.4 33.7 49.6 26.3 46 48 A T E -AC 6 106A 1 -40,-2.2 -40,-1.9 -2,-0.6 2,-0.5 -0.968 9.6-169.6-123.5 123.4 34.0 46.5 24.2 47 49 A S E -AC 5 105A 0 58,-2.7 58,-2.2 -2,-0.5 2,-0.4 -0.924 6.9-166.2-109.5 131.4 37.0 44.2 24.1 48 50 A A E +AC 4 104A 0 -44,-3.2 -44,-2.1 -2,-0.5 2,-0.3 -0.955 7.8 179.2-119.7 137.3 37.2 41.5 21.4 49 51 A A E +AC 3 103A 0 54,-2.3 54,-2.8 -2,-0.4 2,-0.3 -0.991 6.0 174.7-138.2 145.0 39.7 38.6 21.5 50 52 A T E +AC 2 102A 0 -48,-2.3 -48,-2.4 -2,-0.3 52,-0.1 -0.988 10.5 163.7-148.9 141.0 40.3 35.7 19.2 51 53 A A > - 0 0 5 50,-0.6 3,-1.1 -2,-0.3 50,-0.3 -0.980 49.8 -47.7-155.8 166.0 43.0 33.0 19.3 52 54 A P T 3 S- 0 0 85 0, 0.0 3,-0.1 0, 0.0 45,-0.0 -0.123 108.6 -42.8 -43.6 101.0 44.2 29.6 18.0 53 55 A E T 3 S+ 0 0 103 1,-0.1 2,-0.3 -2,-0.1 47,-0.0 0.581 78.0 146.7 45.6 32.3 41.1 27.5 18.6 54 56 A F < - 0 0 45 -3,-1.1 47,-0.6 47,-0.2 2,-0.3 -0.762 59.1-111.1 -77.9 149.8 39.7 28.3 22.0 55 57 A E + 0 0 132 -2,-0.3 45,-0.1 1,-0.1 -1,-0.0 -0.657 55.0 3.5-118.5 162.7 36.1 27.7 20.9 56 58 A R S S- 0 0 178 -2,-0.3 -1,-0.1 9,-0.0 44,-0.0 0.958 82.6 -81.2 57.5 107.9 32.6 28.9 20.0 57 59 A D - 0 0 2 8,-0.1 9,-1.4 9,-0.1 2,-0.3 0.114 61.0-176.6 -29.2 123.7 31.8 32.7 20.0 58 60 A T B -De 65 103A 18 44,-2.4 46,-1.9 7,-0.2 2,-0.2 -0.868 23.1-151.8-131.9 161.8 31.1 33.7 23.6 59 61 A L > - 0 0 58 5,-3.6 4,-0.6 4,-0.3 2,-0.3 -0.529 25.5-132.3-116.0-173.3 30.0 36.8 25.7 60 62 A W T 4 + 0 0 53 -2,-0.2 46,-0.4 2,-0.2 331,-0.0 -0.845 66.1 124.3-166.1 126.1 31.0 37.5 29.3 61 63 A L T 4 S- 0 0 149 -2,-0.3 -1,-0.1 44,-0.1 44,-0.1 -0.161 121.1 -64.1-137.7 3.0 29.8 38.5 32.8 62 64 A N T 4 S+ 0 0 119 2,-0.1 2,-0.2 -3,-0.1 -2,-0.2 0.765 120.9 26.8 104.4 67.9 31.6 35.2 32.9 63 65 A G < + 0 0 30 -4,-0.6 -4,-0.3 1,-0.2 0, 0.0 -0.644 64.2 110.6 173.3-111.3 29.5 32.7 30.9 64 66 A E - 0 0 97 -2,-0.2 -5,-3.6 -6,-0.1 -1,-0.2 0.404 43.2-137.5 -19.0 124.9 27.1 33.0 28.0 65 67 A P B -D 58 0A 85 0, 0.0 2,-0.7 0, 0.0 -7,-0.2 0.130 31.6 -91.2 -67.3 176.3 27.5 31.8 24.3 66 68 A H S S+ 0 0 11 -9,-1.4 2,-0.1 2,-0.1 -9,-0.1 -0.760 80.9 82.4-115.4 96.7 26.5 33.5 21.1 67 69 A S S S+ 0 0 59 -2,-0.7 -1,-0.0 4,-0.0 0, 0.0 -0.418 101.3 6.4 171.3 102.1 23.0 33.0 19.6 68 70 A I S S+ 0 0 130 -2,-0.1 -2,-0.1 1,-0.0 0, 0.0 0.265 99.5 94.6 93.5 0.7 19.9 34.9 20.7 69 71 A D S S- 0 0 78 -4,-0.1 2,-0.1 -5,-0.0 -3,-0.0 -0.239 134.5 -29.9 -98.5 26.5 22.1 37.1 23.0 70 72 A N S S- 0 0 61 1,-0.1 -4,-0.0 3,-0.0 0, 0.0 -0.547 82.1-170.5 172.3 -95.4 21.4 38.5 19.7 71 73 A E S S+ 0 0 85 -2,-0.1 -1,-0.1 1,-0.1 -4,-0.0 0.920 77.0 62.3 55.7 73.5 20.9 36.1 17.0 72 74 A R S > S+ 0 0 72 79,-0.0 4,-0.7 0, 0.0 3,-0.1 -0.128 94.6 72.9-174.7 -21.3 20.8 38.0 13.8 73 75 A T H >> S+ 0 0 2 2,-0.2 4,-3.2 1,-0.2 3,-0.8 0.863 76.5 68.9 -77.0 -37.5 24.4 39.0 14.7 74 76 A Q H 3> S+ 0 0 22 1,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.880 102.0 54.1 -47.6 -33.7 26.2 35.7 14.0 75 77 A N H 3> S+ 0 0 59 2,-0.2 4,-1.0 1,-0.2 -1,-0.3 0.883 108.4 45.8 -68.5 -38.3 25.3 36.6 10.4 76 78 A C H < S+ 0 0 37 -4,-1.1 3,-1.9 1,-0.2 -2,-0.2 0.996 112.8 39.3 -64.2 -71.2 42.3 40.0 3.3 88 90 A E H >< S+ 0 0 21 -4,-2.0 3,-2.5 1,-0.3 6,-0.2 0.758 103.6 70.4 -54.7 -28.5 44.4 37.0 4.4 89 91 A S T 3< S+ 0 0 84 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.1 0.349 102.4 48.2 -71.3 9.1 43.5 35.2 1.2 90 92 A K T < S+ 0 0 163 -3,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.190 121.8 32.4-127.8 4.7 45.8 37.9 -0.2 91 93 A D X - 0 0 65 -3,-2.5 3,-1.5 3,-0.1 -1,-0.3 -0.669 50.5-169.2-168.0 108.3 48.5 37.3 2.3 92 94 A A T 3 S+ 0 0 108 1,-0.3 -4,-0.1 -2,-0.2 -3,-0.1 0.568 89.0 75.6 -74.4 -7.3 49.6 34.1 4.0 93 95 A S T 3 S+ 0 0 101 -5,-0.1 -1,-0.3 2,-0.1 -5,-0.1 0.558 83.3 84.4 -77.9 -10.3 51.8 36.2 6.2 94 96 A L S < S- 0 0 56 -3,-1.5 -3,-0.1 -6,-0.2 -4,-0.0 -0.777 88.2-110.0 -97.7 138.4 48.5 37.2 8.0 95 97 A P - 0 0 40 0, 0.0 2,-1.0 0, 0.0 3,-0.3 -0.112 29.0-108.4 -60.5 160.7 47.0 35.0 10.8 96 98 A T >> + 0 0 73 1,-0.2 3,-1.8 2,-0.1 4,-0.6 -0.303 61.2 148.4 -88.2 50.4 43.8 33.0 10.3 97 99 A L G >4 + 0 0 8 -2,-1.0 3,-1.4 1,-0.3 -1,-0.2 0.866 64.1 62.1 -51.3 -42.9 41.8 35.3 12.5 98 100 A S G 34 S+ 0 0 9 -3,-0.3 -1,-0.3 1,-0.3 -13,-0.1 0.683 101.9 52.0 -60.7 -20.1 38.6 34.8 10.5 99 101 A Q G <4 S+ 0 0 115 -3,-1.8 2,-0.3 2,-0.1 -1,-0.3 0.601 94.6 84.9 -92.9 -13.8 38.6 31.1 11.3 100 102 A W S << S- 0 0 21 -3,-1.4 -45,-0.1 -4,-0.6 2,-0.0 -0.652 82.1-112.1 -92.8 148.2 38.9 31.4 15.1 101 103 A K - 0 0 54 -47,-0.6 -50,-0.6 -50,-0.3 2,-0.3 -0.330 34.2-114.6 -74.1 157.8 36.0 32.0 17.4 102 104 A L E -C 50 0A 2 -52,-0.1 -44,-2.4 -2,-0.0 2,-0.5 -0.693 14.0-156.8-101.7 148.7 35.5 35.3 19.2 103 105 A H E -Ce 49 58A 17 -54,-2.8 -54,-2.3 -2,-0.3 2,-0.4 -0.989 21.4-171.5-119.3 117.9 35.6 36.2 22.9 104 106 A I E +C 48 0A 7 -46,-1.9 2,-0.4 -2,-0.5 -56,-0.2 -0.949 14.8 178.3-121.5 133.0 33.6 39.4 23.7 105 107 A V E +C 47 0A 17 -58,-2.2 -58,-2.7 -2,-0.4 2,-0.3 -0.984 14.9 171.7-131.5 121.1 33.4 41.4 26.9 106 108 A S E +C 46 0A 49 -2,-0.4 2,-0.3 -46,-0.4 -60,-0.2 -0.902 7.6 159.9-130.9 156.9 31.3 44.6 27.0 107 109 A E E -C 45 0A 90 -62,-1.2 -62,-3.7 -2,-0.3 2,-0.3 -0.962 11.9-165.6-167.3 156.5 30.1 47.1 29.5 108 110 A N E -C 44 0A 70 -2,-0.3 -64,-0.2 -64,-0.3 -66,-0.0 -0.861 25.1-135.2-141.9 176.0 28.8 50.7 29.7 109 111 A N + 0 0 66 -66,-1.3 -65,-0.1 -2,-0.3 3,-0.0 0.084 50.2 143.0-121.5 18.7 28.1 53.5 32.2 110 112 A F - 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