==== 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 24-JAN-08 3C2E . COMPND 2 MOLECULE: NICOTINATE-NUCLEOTIDE PYROPHOSPHORYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR E.DI LUCCIO,D.K.WILSON . 267 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14767.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 175 65.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 8.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 24 9.0 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 . 13 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 84 31.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.5 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 1 2 0 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 0 189 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 159.6 -25.9 7.2 -14.3 2 3 A V > - 0 0 74 1,-0.1 3,-2.2 0, 0.0 4,-0.2 -0.966 360.0-146.4-123.4 120.6 -22.5 8.6 -15.2 3 4 A Y G > S+ 0 0 112 -2,-0.5 3,-2.5 1,-0.3 4,-0.3 0.825 96.5 65.3 -50.3 -39.9 -21.6 9.5 -18.8 4 5 A E G > S+ 0 0 83 1,-0.3 3,-1.6 2,-0.2 -1,-0.3 0.727 86.0 73.0 -59.9 -19.7 -18.0 8.5 -18.4 5 6 A H G < S+ 0 0 137 -3,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.642 78.7 76.1 -69.8 -11.1 -19.1 4.9 -17.9 6 7 A L G < S+ 0 0 105 -3,-2.5 -1,-0.3 -4,-0.2 -2,-0.2 0.754 82.4 80.9 -68.2 -23.1 -19.9 4.9 -21.7 7 8 A L S < S- 0 0 19 -3,-1.6 4,-0.0 -4,-0.3 2,-0.0 -0.735 91.1-118.2 -87.5 127.0 -16.1 4.5 -22.1 8 9 A P - 0 0 67 0, 0.0 -2,-0.1 0, 0.0 3,-0.1 -0.358 24.8-113.3 -64.5 141.5 -14.7 1.0 -21.7 9 10 A V S S+ 0 0 134 1,-0.1 2,-0.3 -4,-0.1 -2,-0.0 0.859 103.0 8.6 -43.1 -41.4 -12.2 0.5 -18.8 10 11 A N S S+ 0 0 103 3,-0.0 2,-0.3 4,-0.0 -1,-0.1 -0.997 86.3 104.0-143.5 150.8 -9.7 -0.2 -21.6 11 12 A G S >> S- 0 0 32 -2,-0.3 3,-1.5 1,-0.1 4,-0.8 -0.965 79.5 -44.9 167.1-173.3 -9.7 0.1 -25.3 12 13 A A H >> S+ 0 0 63 -2,-0.3 4,-1.7 1,-0.3 3,-0.7 0.802 118.4 70.6 -51.0 -37.0 -8.6 2.2 -28.3 13 14 A W H 3> S+ 0 0 20 1,-0.3 4,-1.2 2,-0.2 -1,-0.3 0.831 96.4 51.1 -56.4 -32.2 -9.5 5.5 -26.7 14 15 A R H <> S+ 0 0 83 -3,-1.5 4,-1.5 1,-0.2 -1,-0.3 0.833 107.5 52.7 -74.8 -28.7 -6.7 5.2 -24.1 15 16 A Q H X S+ 0 0 24 -4,-2.1 4,-0.9 1,-0.2 3,-0.9 0.915 110.3 48.9 -64.8 -42.1 1.0 12.8 -26.1 22 23 A S H 3< S+ 0 0 70 -4,-2.0 3,-0.3 1,-0.3 -1,-0.2 0.820 100.9 64.4 -67.2 -31.9 3.4 11.6 -28.8 23 24 A E H 3< S+ 0 0 163 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.791 107.4 43.8 -61.1 -27.0 2.1 14.1 -31.2 24 25 A D H << S+ 0 0 91 -3,-0.9 -1,-0.2 -4,-0.7 -2,-0.2 0.676 121.5 36.4 -93.3 -20.0 3.5 16.8 -28.8 25 26 A V < + 0 0 41 -4,-0.9 -1,-0.2 -3,-0.3 4,-0.1 -0.600 56.6 158.0-132.9 77.2 6.9 15.1 -28.1 26 27 A P S S- 0 0 118 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.729 85.6 -1.8 -74.9 -15.4 8.4 13.3 -31.2 27 28 A S S S- 0 0 81 1,-0.3 2,-0.3 -5,-0.0 -2,-0.1 0.403 122.8 -12.0-132.6 -73.5 11.9 13.5 -29.7 28 29 A F - 0 0 146 4,-0.0 2,-1.0 0, 0.0 -1,-0.3 -0.914 46.9-129.7-145.5 148.8 12.6 15.2 -26.4 29 30 A D > + 0 0 66 -2,-0.3 4,-1.4 1,-0.2 3,-0.3 -0.792 28.0 177.9-104.1 87.3 10.8 17.5 -24.0 30 31 A F H > S+ 0 0 147 -2,-1.0 4,-1.7 1,-0.2 3,-0.2 0.885 78.7 53.7 -59.0 -42.1 13.4 20.2 -23.5 31 32 A G H > S+ 0 0 42 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.835 105.5 55.0 -62.8 -32.3 11.2 22.2 -21.1 32 33 A G H > S+ 0 0 5 -3,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.868 104.1 54.2 -68.5 -36.0 10.7 19.2 -19.0 33 34 A Y H < S+ 0 0 205 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.899 112.7 43.3 -64.5 -40.7 14.5 18.8 -18.6 34 35 A V H < S+ 0 0 112 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.857 114.7 47.7 -75.9 -34.7 14.8 22.3 -17.4 35 36 A V H < S- 0 0 49 -4,-2.2 3,-0.4 -5,-0.2 -2,-0.2 0.802 95.3-161.0 -79.2 -27.8 11.9 22.3 -15.0 36 37 A G < - 0 0 28 -4,-1.9 63,-2.0 -5,-0.2 64,-0.1 -0.164 30.6 -68.9 79.9-174.3 12.7 19.1 -13.3 37 38 A S S S+ 0 0 75 61,-0.2 -1,-0.2 60,-0.1 3,-0.1 0.188 70.8 139.7-107.9 16.1 10.6 16.6 -11.3 38 39 A D - 0 0 112 -3,-0.4 60,-2.2 59,-0.2 58,-0.1 -0.377 63.2-103.6 -61.5 135.8 9.9 18.6 -8.0 39 40 A L E -A 97 0A 144 58,-0.2 2,-0.3 59,-0.1 -1,-0.1 -0.367 49.4-179.3 -61.2 137.1 6.3 18.0 -6.9 40 41 A K E -A 96 0A 61 56,-2.6 56,-1.6 -3,-0.1 2,-0.3 -0.896 23.6-131.3-135.7 163.9 4.1 21.0 -7.6 41 42 A E E +A 95 0A 131 -2,-0.3 227,-2.4 54,-0.2 2,-0.3 -0.821 28.8 174.4-112.5 154.9 0.5 22.0 -7.2 42 43 A A E -AB 94 267A 1 52,-1.6 52,-3.5 -2,-0.3 2,-0.4 -0.985 23.0-138.6-161.0 152.1 -1.6 23.5 -9.9 43 44 A N E -AB 93 266A 46 223,-1.9 223,-1.6 -2,-0.3 2,-0.5 -0.942 12.7-142.3-117.1 135.4 -5.2 24.6 -10.7 44 45 A L E -AB 92 265A 0 48,-2.9 47,-2.0 -2,-0.4 48,-1.1 -0.842 27.9-156.0 -91.9 128.9 -7.0 23.9 -13.9 45 46 A Y E -AB 90 264A 43 219,-3.2 219,-2.3 -2,-0.5 2,-0.6 -0.909 16.8-147.8-114.9 137.7 -9.1 27.1 -14.7 46 47 A C E -AB 89 263A 1 43,-3.2 43,-1.9 -2,-0.4 217,-0.3 -0.888 17.0-177.1 -96.0 120.5 -12.3 27.5 -16.7 47 48 A K + 0 0 94 215,-3.6 2,-0.3 -2,-0.6 216,-0.2 0.297 58.3 47.5-104.6 10.7 -12.1 31.0 -18.2 48 49 A Q S S- 0 0 76 214,-0.4 2,-0.2 41,-0.1 31,-0.1 -0.996 88.7 -95.4-149.8 149.8 -15.4 31.1 -20.1 49 50 A D S S+ 0 0 65 -2,-0.3 2,-0.3 31,-0.1 31,-0.2 -0.455 73.5 96.9 -64.4 125.8 -19.1 30.4 -19.4 50 51 A G E S-D 79 0B 1 29,-2.2 29,-3.1 -2,-0.2 2,-0.5 -0.975 73.0 -62.2 172.1 178.4 -20.0 27.0 -20.5 51 52 A M E -D 78 0B 9 65,-0.4 69,-0.3 -2,-0.3 2,-0.3 -0.761 47.9-120.7 -92.9 129.1 -20.6 23.3 -19.7 52 53 A L + 0 0 0 25,-2.5 24,-3.1 -2,-0.5 2,-0.3 -0.488 45.2 161.3 -67.3 122.3 -17.7 21.2 -18.4 53 54 A C + 0 0 0 -2,-0.3 63,-0.7 59,-0.3 62,-0.2 -0.999 41.2 46.8-148.4 145.3 -17.0 18.3 -20.8 54 55 A G > + 0 0 0 -2,-0.3 4,-2.7 61,-0.2 3,-0.4 0.530 59.4 143.2 104.4 11.9 -14.2 15.9 -21.5 55 56 A V H > S+ 0 0 13 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.903 70.9 44.9 -49.9 -57.6 -13.3 15.0 -17.9 56 57 A P H > S+ 0 0 10 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.827 114.5 50.8 -62.0 -29.4 -12.5 11.3 -18.3 57 58 A F H > S+ 0 0 4 -3,-0.4 4,-1.4 2,-0.2 -2,-0.2 0.940 114.8 42.0 -71.1 -46.7 -10.4 12.0 -21.5 58 59 A A H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 5,-0.2 0.887 112.2 56.4 -65.0 -38.1 -8.4 14.7 -19.6 59 60 A Q H X S+ 0 0 42 -4,-3.3 4,-2.2 -5,-0.3 -1,-0.2 0.862 103.8 53.2 -61.0 -37.4 -8.2 12.5 -16.6 60 61 A E H X S+ 0 0 11 -4,-1.6 4,-2.6 2,-0.2 -1,-0.2 0.861 106.3 52.7 -67.1 -35.9 -6.6 9.8 -18.8 61 62 A V H X S+ 0 0 0 -4,-1.4 4,-1.8 1,-0.2 -2,-0.2 0.958 111.7 46.5 -62.5 -48.4 -4.0 12.3 -19.9 62 63 A F H <>S+ 0 0 1 -4,-2.3 5,-2.5 1,-0.2 -2,-0.2 0.849 111.4 52.4 -61.3 -37.0 -3.3 13.1 -16.3 63 64 A N H ><5S+ 0 0 73 -4,-2.2 3,-2.0 3,-0.2 -1,-0.2 0.955 110.5 45.9 -64.5 -50.7 -3.1 9.4 -15.4 64 65 A Q H 3<5S+ 0 0 59 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.799 111.4 52.7 -64.5 -27.3 -0.6 8.6 -18.2 65 66 A C T 3<5S- 0 0 6 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.330 116.8-121.0 -89.2 9.5 1.4 11.6 -17.1 66 67 A E T < 5 + 0 0 156 -3,-2.0 2,-0.2 1,-0.2 -3,-0.2 0.901 60.8 143.3 53.1 54.0 1.3 10.1 -13.6 67 68 A L < - 0 0 14 -5,-2.5 2,-0.5 29,-0.1 29,-0.2 -0.718 49.3-124.0-115.9 166.8 -0.4 13.0 -11.8 68 69 A Q E -C 95 0A 140 27,-2.8 27,-2.4 -2,-0.2 2,-0.4 -0.958 32.8-172.4-113.8 125.6 -2.9 13.2 -9.0 69 70 A V E -C 94 0A 35 -2,-0.5 2,-0.5 25,-0.2 25,-0.2 -0.945 21.2-166.0-128.2 143.4 -6.1 15.1 -9.7 70 71 A E E -C 93 0A 104 23,-2.2 23,-2.0 -2,-0.4 2,-0.3 -0.947 17.8-149.9-124.2 107.2 -9.1 16.4 -7.8 71 72 A W E -C 92 0A 54 -2,-0.5 21,-0.3 21,-0.2 20,-0.1 -0.626 3.6-161.5 -77.5 132.5 -12.0 17.5 -10.0 72 73 A L S S+ 0 0 67 19,-2.9 2,-0.3 -2,-0.3 20,-0.2 0.553 72.4 39.4 -90.7 -11.3 -14.1 20.2 -8.2 73 74 A F S S- 0 0 77 18,-0.8 2,-0.2 4,-0.0 3,-0.1 -0.964 84.2-109.6-137.7 155.7 -17.1 19.8 -10.4 74 75 A K > - 0 0 170 -2,-0.3 3,-2.1 1,-0.1 -22,-0.2 -0.547 48.6 -94.4 -80.0 147.1 -19.1 16.9 -12.0 75 76 A E T 3 S+ 0 0 37 1,-0.3 -22,-0.2 -2,-0.2 -72,-0.1 -0.360 115.7 33.6 -59.6 141.4 -18.8 16.6 -15.8 76 77 A G T 3 S+ 0 0 28 -24,-3.1 -1,-0.3 1,-0.3 -23,-0.1 0.208 83.2 139.7 95.5 -17.3 -21.7 18.4 -17.3 77 78 A S < - 0 0 34 -3,-2.1 -25,-2.5 -26,-0.1 2,-0.7 -0.362 56.7-123.3 -60.5 137.6 -21.8 21.1 -14.6 78 79 A F E -D 51 0B 94 -27,-0.2 2,-0.4 -3,-0.1 -27,-0.3 -0.773 29.4-156.1 -87.9 117.4 -22.5 24.5 -16.1 79 80 A L E -D 50 0B 3 -29,-3.1 -29,-2.2 -2,-0.7 3,-0.1 -0.745 13.6-170.7 -97.7 139.5 -19.7 26.8 -15.1 80 81 A E > + 0 0 73 -2,-0.4 3,-1.6 -31,-0.2 -31,-0.1 -0.652 13.4 168.2-131.6 78.4 -20.0 30.6 -15.0 81 82 A P G > S+ 0 0 2 0, 0.0 3,-1.9 0, 0.0 6,-0.5 0.746 73.4 71.1 -57.0 -26.1 -16.6 32.3 -14.5 82 83 A S G 3 S+ 0 0 76 1,-0.3 6,-0.0 5,-0.1 -2,-0.0 0.686 82.5 69.6 -75.6 -11.7 -18.2 35.7 -15.3 83 84 A K G < S+ 0 0 141 -3,-1.6 -1,-0.3 4,-0.0 2,-0.1 0.444 93.6 99.8 -71.2 4.5 -20.0 35.5 -12.0 84 85 A N S < S- 0 0 78 -3,-1.9 5,-0.1 1,-0.1 0, 0.0 -0.440 71.4-148.1 -98.5 158.7 -16.4 36.0 -10.8 85 86 A D S S+ 0 0 150 -2,-0.1 -1,-0.1 3,-0.1 -3,-0.0 0.886 110.5 39.5 -80.2 -54.1 -14.2 38.8 -9.5 86 87 A S S S- 0 0 60 2,-0.2 3,-0.1 1,-0.1 -4,-0.1 0.679 108.0-123.6 -70.9 -27.3 -11.3 37.0 -11.1 87 88 A G S S+ 0 0 34 -6,-0.5 2,-0.3 1,-0.2 -5,-0.1 0.594 78.5 76.0 89.7 15.9 -13.0 35.9 -14.2 88 89 A K - 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