==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 25-JAN-08 3C2O . COMPND 2 MOLECULE: NICOTINATE-NUCLEOTIDE PYROPHOSPHORYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR E.DI LUCCIO,D.K.WILSON . 265 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14428.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 181 68.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 8.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 24 9.1 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 . 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 . 15 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 32.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.1 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 1 1 0 0 2 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 1 0 5 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 . 0 1 0 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 1 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 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 2 A P 0 0 186 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 171.9 -25.8 7.2 20.4 2 3 A V > - 0 0 70 1,-0.1 3,-1.9 2,-0.0 4,-0.2 -0.964 360.0-150.7-121.7 120.5 -22.4 8.4 19.4 3 4 A Y G > S+ 0 0 110 -2,-0.5 3,-2.9 1,-0.3 4,-0.3 0.889 95.9 63.6 -53.6 -44.5 -21.6 9.4 15.8 4 5 A E G > S+ 0 0 84 1,-0.3 3,-1.2 2,-0.2 -1,-0.3 0.683 86.8 74.6 -57.6 -15.1 -17.9 8.5 16.1 5 6 A H G < S+ 0 0 136 -3,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.645 78.6 74.1 -72.3 -11.8 -19.1 4.9 16.7 6 7 A L G < S+ 0 0 106 -3,-2.9 -1,-0.3 -4,-0.2 -2,-0.2 0.801 82.5 82.7 -67.8 -28.5 -19.8 4.8 12.9 7 8 A L S < S- 0 0 19 -3,-1.2 2,-0.1 -4,-0.3 4,-0.0 -0.642 91.4-118.3 -80.3 127.3 -16.1 4.5 12.4 8 9 A P - 0 0 66 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.396 24.2-115.0 -65.3 140.0 -14.7 1.0 12.8 9 10 A V S S+ 0 0 134 1,-0.2 2,-0.3 -4,-0.1 -2,-0.0 0.815 103.1 12.1 -45.6 -32.9 -12.2 0.6 15.7 10 11 A N S S+ 0 0 106 4,-0.0 2,-0.3 3,-0.0 -1,-0.2 -0.990 85.0 106.7-149.0 141.4 -9.8 -0.2 13.0 11 12 A G S >> S- 0 0 32 -2,-0.3 3,-1.0 -3,-0.1 4,-0.7 -0.954 78.9 -51.2 178.1-166.8 -9.8 0.1 9.2 12 13 A A H >> S+ 0 0 60 -2,-0.3 4,-1.8 1,-0.2 3,-0.7 0.813 118.0 71.3 -63.1 -31.7 -8.4 2.2 6.3 13 14 A W H 3> S+ 0 0 17 1,-0.3 4,-1.3 2,-0.2 -1,-0.2 0.834 96.0 52.7 -57.6 -30.8 -9.4 5.5 7.8 14 15 A R H <> S+ 0 0 82 -3,-1.0 4,-1.5 1,-0.2 -1,-0.3 0.850 108.1 50.4 -73.3 -29.5 -6.7 5.2 10.4 15 16 A Q H X S+ 0 0 23 -4,-1.5 4,-1.4 -3,-0.3 3,-1.1 0.926 111.0 49.3 -70.8 -43.9 1.2 12.9 8.4 22 23 A S H 3< S+ 0 0 69 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.830 103.7 60.8 -63.4 -32.4 3.5 11.5 5.7 23 24 A E H 3< S+ 0 0 163 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.734 109.4 43.5 -65.3 -23.3 2.2 14.0 3.3 24 25 A D H << S+ 0 0 86 -3,-1.1 -1,-0.2 -4,-0.5 -2,-0.2 0.696 121.7 37.0 -96.3 -22.0 3.4 16.7 5.7 25 26 A V < + 0 0 39 -4,-1.4 -1,-0.2 1,-0.1 4,-0.1 -0.655 58.2 161.3-131.2 78.6 6.8 15.1 6.4 26 27 A P S S- 0 0 122 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.898 84.1 -7.4 -65.4 -36.4 8.3 13.4 3.4 27 28 A S S S- 0 0 80 1,-0.4 2,-0.3 -5,-0.0 -2,-0.1 0.604 121.7 -4.1-120.2 -83.3 11.8 13.5 4.9 28 29 A F - 0 0 151 4,-0.0 2,-0.9 3,-0.0 -1,-0.4 -0.862 47.9-133.3-122.8 156.1 12.7 15.2 8.2 29 30 A D > + 0 0 63 -2,-0.3 4,-1.3 1,-0.2 3,-0.3 -0.791 25.8 179.6-106.3 84.7 10.8 17.5 10.6 30 31 A F H > S+ 0 0 145 -2,-0.9 4,-1.6 1,-0.2 3,-0.2 0.861 79.6 52.0 -54.1 -41.1 13.4 20.2 11.1 31 32 A G H > S+ 0 0 36 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.871 104.5 55.4 -65.7 -38.1 11.2 22.1 13.6 32 33 A G H > S+ 0 0 6 -3,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.818 107.0 52.9 -63.8 -29.0 10.6 19.1 15.7 33 34 A Y H < S+ 0 0 202 -4,-1.3 -1,-0.2 -3,-0.2 -2,-0.2 0.872 110.5 44.9 -74.0 -38.6 14.4 18.8 16.0 34 35 A V H < S+ 0 0 112 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.804 116.5 46.0 -76.4 -28.6 14.8 22.4 17.2 35 36 A V H < S- 0 0 51 -4,-2.1 3,-0.3 -5,-0.1 -2,-0.2 0.838 94.8-159.8 -85.1 -34.5 11.9 22.3 19.7 36 37 A G < - 0 0 26 -4,-1.7 63,-2.5 -5,-0.2 64,-0.2 -0.194 30.9 -69.4 86.5-177.4 12.6 19.0 21.4 37 38 A S S S+ 0 0 72 61,-0.2 -1,-0.2 60,-0.2 3,-0.1 0.279 71.5 138.5-102.7 7.8 10.6 16.5 23.4 38 39 A D - 0 0 106 -3,-0.3 60,-2.3 59,-0.2 58,-0.1 -0.277 64.8-102.3 -54.3 139.1 10.0 18.4 26.6 39 40 A L E -A 97 0A 126 58,-0.2 2,-0.3 59,-0.1 -1,-0.1 -0.375 49.5-178.5 -63.7 143.2 6.4 17.9 27.8 40 41 A K E -A 96 0A 86 56,-1.7 56,-1.5 -3,-0.1 2,-0.3 -0.927 24.0-128.6-141.0 163.9 4.2 20.9 27.0 41 42 A E E -A 95 0A 140 -2,-0.3 226,-2.6 54,-0.2 2,-0.3 -0.875 27.9-178.8-112.7 148.3 0.6 22.0 27.5 42 43 A A E -AB 94 266A 2 52,-2.3 52,-3.6 -2,-0.3 2,-0.4 -0.998 19.2-146.2-150.4 146.9 -1.6 23.2 24.6 43 44 A N E -AB 93 265A 55 222,-2.2 222,-1.9 -2,-0.3 2,-0.6 -0.915 13.9-142.8-111.8 138.4 -5.1 24.6 24.0 44 45 A L E -AB 92 264A 0 48,-2.8 47,-2.9 -2,-0.4 48,-1.0 -0.896 25.4-156.9 -99.4 122.6 -7.0 23.9 20.9 45 46 A Y E -AB 90 263A 46 218,-3.6 218,-2.1 -2,-0.6 2,-0.6 -0.841 16.8-151.3-108.4 142.3 -9.0 27.0 20.0 46 47 A C E -AB 89 262A 0 43,-2.4 43,-1.4 -2,-0.4 216,-0.3 -0.938 15.6-178.4-104.0 119.5 -12.2 27.4 17.9 47 48 A K + 0 0 100 214,-3.1 2,-0.3 -2,-0.6 215,-0.2 0.216 57.7 52.7-107.6 15.6 -12.1 31.0 16.4 48 49 A Q S S- 0 0 79 213,-0.4 31,-0.2 41,-0.1 34,-0.1 -0.983 87.1-101.0-152.6 138.7 -15.3 31.1 14.5 49 50 A D S S+ 0 0 66 -2,-0.3 2,-0.3 32,-0.3 31,-0.2 -0.329 72.9 97.9 -56.6 128.3 -19.0 30.4 15.2 50 51 A G E S-D 79 0B 1 29,-1.8 29,-2.9 -2,-0.1 2,-0.4 -0.951 73.4 -61.8 168.3 175.0 -20.0 27.0 13.9 51 52 A M E -D 78 0B 8 65,-0.4 69,-0.4 -2,-0.3 2,-0.3 -0.705 47.4-121.5 -89.1 131.7 -20.6 23.3 14.7 52 53 A L + 0 0 0 25,-2.8 24,-2.3 -2,-0.4 2,-0.3 -0.516 46.0 155.8 -70.1 126.4 -17.7 21.2 16.0 53 54 A C + 0 0 0 -2,-0.3 63,-0.5 59,-0.3 62,-0.2 -0.996 40.2 50.9-153.0 153.4 -17.0 18.2 13.8 54 55 A G >> + 0 0 0 -2,-0.3 4,-2.7 61,-0.2 3,-0.5 0.543 60.8 141.5 96.5 10.1 -14.1 15.8 12.9 55 56 A V H 3> + 0 0 13 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.903 68.8 48.9 -51.8 -52.4 -13.3 15.0 16.5 56 57 A P H 3> S+ 0 0 9 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.838 113.8 48.4 -61.7 -28.6 -12.6 11.3 16.0 57 58 A F H <> S+ 0 0 4 -3,-0.5 4,-1.5 2,-0.2 3,-0.2 0.936 112.3 45.9 -75.5 -47.0 -10.3 12.1 13.1 58 59 A A H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.871 111.5 55.2 -61.6 -35.7 -8.4 14.8 14.9 59 60 A Q H X S+ 0 0 42 -4,-2.5 4,-2.6 -5,-0.3 -1,-0.2 0.838 103.2 53.9 -66.3 -34.3 -8.1 12.5 17.9 60 61 A E H X S+ 0 0 11 -4,-1.2 4,-2.5 -3,-0.2 -1,-0.2 0.861 107.9 51.1 -68.6 -34.2 -6.6 9.8 15.7 61 62 A V H X S+ 0 0 0 -4,-1.5 4,-1.3 2,-0.2 -2,-0.2 0.942 112.4 45.8 -65.7 -47.3 -3.9 12.3 14.6 62 63 A F H <>S+ 0 0 1 -4,-2.2 5,-1.8 1,-0.2 -2,-0.2 0.866 111.9 52.5 -62.7 -39.6 -3.3 13.1 18.3 63 64 A N H ><5S+ 0 0 77 -4,-2.6 3,-1.7 1,-0.2 -2,-0.2 0.929 109.8 46.9 -63.1 -47.1 -3.2 9.4 19.1 64 65 A Q H 3<5S+ 0 0 59 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.730 110.8 53.1 -68.2 -21.4 -0.6 8.6 16.4 65 66 A C T 3<5S- 0 0 7 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.289 115.9-121.5 -94.3 9.2 1.4 11.6 17.6 66 67 A E T < 5 + 0 0 151 -3,-1.7 2,-0.3 1,-0.2 -3,-0.2 0.926 60.4 143.5 50.5 60.4 1.3 10.1 21.1 67 68 A L < - 0 0 13 -5,-1.8 2,-0.6 29,-0.1 29,-0.2 -0.797 50.4-121.5-122.8 164.6 -0.4 13.0 22.9 68 69 A Q E -C 95 0A 139 27,-3.0 27,-2.0 -2,-0.3 2,-0.4 -0.941 34.4-177.7-111.0 119.7 -3.0 13.3 25.7 69 70 A V E -C 94 0A 33 -2,-0.6 2,-0.4 25,-0.2 25,-0.2 -0.906 19.0-169.2-123.0 147.8 -6.1 15.2 24.8 70 71 A E E -C 93 0A 109 23,-1.8 23,-2.2 -2,-0.4 2,-0.4 -0.961 18.6-145.8-133.7 112.1 -9.3 16.2 26.7 71 72 A W E -C 92 0A 53 -2,-0.4 21,-0.3 21,-0.2 20,-0.1 -0.652 5.5-161.8 -80.7 132.1 -12.1 17.5 24.6 72 73 A L S S+ 0 0 63 19,-2.8 2,-0.3 -2,-0.4 20,-0.2 0.509 75.2 44.9 -89.6 -6.6 -14.1 20.2 26.4 73 74 A F S S- 0 0 72 18,-0.8 2,-0.1 4,-0.0 -1,-0.1 -0.995 82.8-117.0-140.3 144.9 -17.1 19.8 24.0 74 75 A K > - 0 0 169 -2,-0.3 3,-1.6 1,-0.1 -22,-0.2 -0.476 46.7 -95.7 -74.4 148.4 -19.0 16.9 22.6 75 76 A E T 3 S+ 0 0 38 1,-0.2 -22,-0.2 -2,-0.1 -72,-0.1 -0.418 113.5 39.9 -64.1 141.4 -18.9 16.6 18.8 76 77 A G T 3 S+ 0 0 30 -24,-2.3 -1,-0.2 1,-0.4 2,-0.2 0.276 83.9 138.2 100.4 -9.1 -21.9 18.2 17.2 77 78 A S < - 0 0 37 -3,-1.6 -25,-2.8 -25,-0.1 2,-0.7 -0.455 54.2-128.8 -72.1 139.3 -21.8 21.1 19.7 78 79 A F E -D 51 0B 96 -27,-0.2 2,-0.3 -2,-0.2 -27,-0.2 -0.796 26.8-157.5 -89.8 120.5 -22.4 24.6 18.3 79 80 A L E -D 50 0B 2 -29,-2.9 -29,-1.8 -2,-0.7 10,-0.0 -0.733 13.4-171.0-101.0 146.4 -19.7 26.9 19.4 80 81 A E > + 0 0 113 -2,-0.3 2,-4.4 -31,-0.2 3,-1.3 -0.500 19.3 168.9-138.7 67.6 -19.9 30.7 19.6 81 82 A P T 3 + 0 0 11 0, 0.0 -32,-0.3 0, 0.0 8,-0.1 -0.476 51.7 121.9 -66.2 71.2 -16.7 32.4 20.3 82 83 A S T 3 + 0 0 77 -2,-4.4 -3,-0.0 -34,-0.1 -33,-0.0 0.677 56.7 66.0-108.4 -40.9 -19.1 35.1 19.3 83 84 A K S < S- 0 0 83 -3,-1.3 -1,-0.0 1,-0.1 0, 0.0 0.893 76.9-162.2 -50.4 -47.4 -18.5 36.8 22.6 84 85 A N + 0 0 112 1,-0.1 -1,-0.1 4,-0.1 5,-0.0 0.894 42.5 143.8 51.3 41.5 -14.8 37.7 22.0 85 86 A D S S- 0 0 146 3,-0.1 -1,-0.1 1,-0.0 -2,-0.0 0.791 112.3 -13.9 -67.6 -25.0 -14.8 38.1 25.6 86 87 A S S S- 0 0 60 2,-0.2 3,-0.1 0, 0.0 -1,-0.0 0.380 99.1-117.9-135.3 -22.6 -11.7 36.7 24.0 87 88 A G S S+ 0 0 15 1,-0.3 2,-0.3 -7,-0.1 -4,-0.0 0.564 85.3 56.8 94.3 10.3 -12.8 35.8 20.5 88 89 A K - 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