==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 22-JAN-12 4DF0 . COMPND 2 MOLECULE: OROTIDINE 5'-PHOSPHATE DECARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOPROTEUS NEUTROPHILUS; . AUTHOR A.A.FEDOROV,E.V.FEDOROV,B.DESAI,J.A.GERLT,S.C.ALMO . 398 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15807.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 305 76.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 77 19.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 2 0.5 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 . 30 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 66 16.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 105 26.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.0 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 1 3 0 6 0 0 0 4 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 8 6 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 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 2 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 4 A N 0 0 112 0, 0.0 25,-0.2 0, 0.0 24,-0.1 0.000 360.0 360.0 360.0 164.5 2.1 -7.8 -29.3 2 5 A L E -a 26 0A 23 23,-2.3 2,-2.3 1,-0.1 25,-0.8 -0.524 360.0-115.4 -81.5 146.5 4.4 -10.8 -28.9 3 6 A P E S+ 0 0 0 0, 0.0 169,-2.1 0, 0.0 2,-0.4 -0.276 77.9 117.3 -78.7 57.4 4.4 -12.7 -25.6 4 7 A L E - b 0 172A 0 -2,-2.3 23,-1.9 167,-0.2 24,-1.1 -0.973 51.8-159.0-133.2 130.4 8.0 -11.6 -24.9 5 8 A V E -ab 28 173A 0 167,-3.0 169,-2.3 -2,-0.4 2,-0.6 -0.974 24.1-141.7-109.1 120.2 9.6 -9.6 -22.2 6 9 A V E -ab 29 174A 0 22,-2.5 24,-2.4 -2,-0.6 2,-0.5 -0.724 6.2-138.7 -90.7 118.6 13.0 -8.3 -23.4 7 10 A A E -a 30 0A 4 167,-2.9 2,-1.2 -2,-0.6 172,-0.2 -0.651 9.0-153.1 -76.6 121.8 15.8 -8.2 -20.8 8 11 A L + 0 0 0 22,-2.9 2,-1.6 -2,-0.5 24,-0.3 -0.498 31.1 158.0 -95.7 64.9 17.7 -5.0 -21.2 9 12 A D + 0 0 62 -2,-1.2 2,-0.3 22,-0.1 -2,-0.1 -0.611 47.4 78.8 -90.8 80.6 21.1 -6.2 -19.9 10 13 A T S S- 0 0 41 -2,-1.6 -2,-0.1 2,-0.0 2,-0.1 -0.866 88.7 -45.7-166.2-176.3 23.1 -3.5 -21.6 11 14 A E > - 0 0 103 -2,-0.3 4,-2.8 1,-0.1 5,-0.2 -0.341 55.6-108.2 -73.5 153.9 24.2 0.1 -21.4 12 15 A V H > S+ 0 0 27 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.892 115.3 42.4 -46.0 -57.1 21.6 2.9 -20.6 13 16 A L H > S+ 0 0 129 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.889 115.9 49.3 -66.9 -36.6 21.5 4.5 -24.0 14 17 A K H > S+ 0 0 112 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.872 109.8 52.4 -68.5 -34.6 21.5 1.2 -25.9 15 18 A A H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.924 109.4 48.5 -64.9 -44.1 18.7 -0.0 -23.6 16 19 A I H X S+ 0 0 20 -4,-2.4 4,-2.8 1,-0.2 5,-0.2 0.909 109.7 54.0 -62.5 -40.5 16.6 3.1 -24.4 17 20 A D H X S+ 0 0 97 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.905 110.1 46.2 -60.0 -43.3 17.3 2.5 -28.1 18 21 A V H X S+ 0 0 20 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.917 112.5 49.8 -66.3 -42.1 16.0 -1.0 -27.9 19 22 A A H X S+ 0 0 0 -4,-2.5 4,-1.0 1,-0.2 -2,-0.2 0.916 111.9 48.3 -64.2 -41.8 12.9 -0.0 -25.9 20 23 A K H < S+ 0 0 92 -4,-2.8 3,-0.5 1,-0.2 -1,-0.2 0.918 114.1 47.4 -59.8 -45.1 12.2 2.8 -28.5 21 24 A R H < S+ 0 0 155 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.881 119.9 37.1 -64.7 -39.4 12.6 0.3 -31.3 22 25 A L H >X S+ 0 0 6 -4,-2.6 3,-2.6 -5,-0.1 4,-1.3 0.375 79.1 135.3-100.2 2.9 10.5 -2.4 -29.8 23 26 A K T 3< S+ 0 0 117 -4,-1.0 28,-0.1 -3,-0.5 4,-0.1 -0.285 83.3 7.4 -54.3 131.4 7.7 -0.3 -28.2 24 27 A G T 34 S+ 0 0 69 26,-0.5 -1,-0.3 2,-0.3 -2,-0.1 0.340 116.4 81.3 77.4 -7.9 4.4 -1.9 -29.0 25 28 A A T <4 S+ 0 0 33 -3,-2.6 -23,-2.3 -24,-0.1 2,-0.3 0.724 93.9 37.9 -99.2 -24.8 6.0 -5.0 -30.5 26 29 A V E < S-a 2 0A 10 -4,-1.3 -2,-0.3 -25,-0.2 -21,-0.1 -0.768 82.2-115.4-123.6 169.1 6.8 -6.8 -27.3 27 30 A A E S- 0 0 8 -23,-1.9 25,-0.4 -25,-0.8 2,-0.3 0.701 79.4 -50.6 -79.3 -22.5 5.0 -7.3 -24.0 28 31 A G E -a 5 0A 1 -24,-1.1 -22,-2.5 23,-0.1 2,-0.3 -0.984 51.0 -94.8 171.0-173.8 7.5 -5.5 -21.8 29 32 A F E -ac 6 53A 2 23,-2.7 25,-2.9 -2,-0.3 2,-0.5 -0.961 20.0-140.0-132.6 144.7 11.1 -5.0 -20.7 30 33 A K E -ac 7 54A 21 -24,-2.4 -22,-2.9 -2,-0.3 2,-0.4 -0.947 17.1-164.9-110.3 124.9 13.2 -6.3 -17.8 31 34 A V E + c 0 55A 0 23,-2.4 25,-2.9 -2,-0.5 2,-0.2 -0.929 17.0 164.8-113.0 129.9 15.5 -3.9 -16.1 32 35 A G > - 0 0 2 -2,-0.4 4,-2.1 -24,-0.3 3,-0.4 -0.465 53.5 -64.1-129.2-161.5 18.3 -5.2 -13.8 33 36 A W H > S+ 0 0 21 23,-0.4 4,-3.0 1,-0.2 5,-0.3 0.818 119.6 68.2 -65.9 -31.0 21.5 -4.2 -12.0 34 37 A D H > S+ 0 0 27 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.953 111.4 33.7 -51.3 -50.4 23.4 -3.6 -15.3 35 38 A L H > S+ 0 0 0 -3,-0.4 4,-1.1 -27,-0.2 5,-0.5 0.909 118.1 51.2 -72.1 -42.3 21.2 -0.6 -16.0 36 39 A I H X S+ 0 0 0 -4,-2.1 4,-1.6 1,-0.2 -2,-0.2 0.877 105.3 57.4 -69.0 -34.0 20.7 0.6 -12.4 37 40 A F H < S+ 0 0 5 -4,-3.0 204,-2.8 203,-0.2 205,-0.4 0.861 99.3 62.1 -58.3 -36.6 24.4 0.5 -11.7 38 41 A E H < S- 0 0 101 -4,-0.9 -2,-0.2 -3,-0.4 -1,-0.2 0.948 133.8 -17.0 -63.8 -51.5 25.1 2.9 -14.5 39 42 A G H < S- 0 0 45 -4,-1.1 3,-0.3 1,-0.4 2,-0.2 0.441 99.9-104.9-133.5 -4.0 23.1 6.0 -13.4 40 43 A G >< - 0 0 0 -4,-1.6 3,-1.3 -5,-0.5 -1,-0.4 -0.639 62.9 -32.9 108.0-168.9 20.7 4.8 -10.7 41 44 A I T >> S+ 0 0 5 196,-2.7 3,-2.0 1,-0.3 4,-0.6 0.653 111.0 86.5 -69.1 -15.7 17.0 4.1 -10.4 42 45 A S H >> S+ 0 0 68 195,-0.4 4,-1.5 1,-0.3 3,-0.7 0.803 75.3 71.2 -56.9 -27.1 16.1 6.9 -12.9 43 46 A I H <> S+ 0 0 6 -3,-1.3 4,-2.4 1,-0.2 -1,-0.3 0.810 87.1 65.0 -61.7 -27.4 16.6 4.4 -15.7 44 47 A V H <> S+ 0 0 0 -3,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.933 102.6 47.3 -59.7 -45.2 13.4 2.6 -14.6 45 48 A G H < S+ 0 0 67 -4,-1.5 3,-0.9 1,-0.2 4,-0.3 0.948 112.8 42.6 -64.1 -47.3 13.0 6.1 -18.9 47 50 A I H >X S+ 0 0 0 -4,-2.4 3,-2.2 1,-0.2 4,-0.7 0.888 105.3 65.2 -66.1 -34.9 12.3 2.6 -20.0 48 51 A A H 3< S+ 0 0 30 -4,-2.1 -1,-0.2 1,-0.3 3,-0.2 0.696 87.2 71.0 -65.0 -16.4 8.8 2.7 -18.5 49 52 A R T << S+ 0 0 165 -3,-0.9 -1,-0.3 -4,-0.7 -2,-0.2 0.796 104.6 40.2 -60.3 -29.7 8.0 5.4 -21.1 50 53 A Y T <4 S- 0 0 48 -3,-2.2 -26,-0.5 -4,-0.3 2,-0.3 0.509 126.6 -36.0-107.2 -10.5 8.1 2.7 -23.8 51 54 A G S < S- 0 0 28 -4,-0.7 -1,-0.3 -3,-0.2 2,-0.2 -0.965 84.3 -37.9 172.3 178.8 6.4 -0.2 -22.2 52 55 A N - 0 0 63 -25,-0.4 -23,-2.7 -2,-0.3 2,-0.6 -0.422 55.2-150.0 -60.3 128.2 5.7 -2.3 -19.1 53 56 A V E -c 29 0A 1 24,-0.4 26,-2.3 -25,-0.2 27,-1.4 -0.917 12.6-167.5-111.0 120.0 8.8 -2.6 -16.9 54 57 A I E -cd 30 80A 1 -25,-2.9 -23,-2.4 -2,-0.6 2,-0.6 -0.923 16.6-148.3 -97.0 118.6 9.6 -5.5 -14.8 55 58 A V E -cd 31 81A 0 25,-2.4 27,-2.1 -2,-0.6 2,-0.6 -0.826 12.5-168.0 -88.9 124.4 12.5 -4.7 -12.4 56 59 A D E + 0 0 9 -25,-2.9 -23,-0.4 -2,-0.6 27,-0.1 -0.840 36.3 136.3-118.5 91.2 14.5 -7.8 -11.7 57 60 A L E S- 0 0 5 -2,-0.6 3,-0.2 25,-0.5 203,-0.1 -0.046 71.9-117.3-112.9 23.4 17.0 -7.3 -8.8 58 61 A K E - 0 0 22 1,-0.2 25,-0.2 25,-0.1 26,-0.1 0.903 39.0-140.2 44.4 53.6 16.0 -10.7 -7.4 59 62 A I E + d 0 83A 0 23,-2.0 25,-2.8 1,-0.1 -1,-0.2 -0.183 40.0 157.3 -61.4 127.5 14.7 -8.9 -4.3 60 63 A A + 0 0 0 -3,-0.2 2,-0.3 23,-0.2 -1,-0.1 -0.502 24.5 117.4-150.4 68.6 15.6 -10.8 -1.1 61 64 A D - 0 0 9 1,-0.1 23,-0.0 29,-0.1 242,-0.0 -0.833 68.1 -74.8-131.6 172.0 15.6 -8.6 1.9 62 65 A V >> - 0 0 14 -2,-0.3 4,-3.3 1,-0.1 3,-0.8 -0.216 55.8 -98.3 -67.3 158.6 13.7 -8.3 5.2 63 66 A P H 3> S+ 0 0 58 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.827 118.4 48.3 -55.1 -44.7 10.2 -6.8 5.0 64 67 A H H 3> S+ 0 0 118 2,-0.2 4,-1.2 1,-0.2 5,-0.1 0.834 119.7 41.1 -69.8 -25.6 10.8 -3.2 6.0 65 68 A V H <> S+ 0 0 15 -3,-0.8 4,-2.5 2,-0.2 -1,-0.2 0.931 114.8 49.1 -80.9 -49.0 13.7 -3.0 3.6 66 69 A A H X S+ 0 0 1 -4,-3.3 4,-2.8 1,-0.2 5,-0.3 0.887 109.3 55.3 -56.8 -40.0 12.0 -4.9 0.8 67 70 A S H X S+ 0 0 78 -4,-2.9 4,-2.4 -5,-0.3 -1,-0.2 0.927 109.8 44.6 -56.5 -50.5 8.9 -2.7 1.2 68 71 A R H X S+ 0 0 65 -4,-1.2 4,-2.4 -5,-0.2 -2,-0.2 0.894 114.2 50.3 -61.1 -41.8 10.9 0.5 0.8 69 72 A V H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.935 111.9 45.6 -66.2 -47.7 12.8 -1.0 -2.2 70 73 A V H X S+ 0 0 21 -4,-2.8 4,-2.9 1,-0.2 5,-0.3 0.936 112.5 52.7 -60.8 -45.7 9.6 -2.1 -4.0 71 74 A E H X S+ 0 0 123 -4,-2.4 4,-2.6 -5,-0.3 -2,-0.2 0.916 108.2 49.3 -57.2 -46.5 8.0 1.2 -3.3 72 75 A K H X S+ 0 0 71 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.919 113.8 47.5 -59.2 -43.1 10.9 3.2 -4.8 73 76 A L H <>S+ 0 0 0 -4,-2.1 5,-2.1 2,-0.2 4,-0.3 0.932 113.2 45.0 -66.5 -47.0 10.8 1.0 -7.9 74 77 A V H ><5S+ 0 0 33 -4,-2.9 3,-1.8 1,-0.2 -1,-0.2 0.911 110.6 56.5 -63.6 -39.2 7.1 1.1 -8.5 75 78 A N H 3<5S+ 0 0 122 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.824 102.8 55.0 -62.2 -29.5 7.2 4.9 -7.9 76 79 A R T 3<5S- 0 0 123 -4,-1.4 -1,-0.3 -3,-0.3 -28,-0.2 0.475 135.3 -85.3 -83.9 -3.5 9.7 5.3 -10.6 77 80 A G T < 5S+ 0 0 38 -3,-1.8 -24,-0.4 1,-0.3 -3,-0.2 0.327 73.9 151.7 122.8 -3.1 7.4 3.5 -13.1 78 81 A A < - 0 0 4 -5,-2.1 -1,-0.3 1,-0.2 -24,-0.2 -0.318 35.7-153.8 -60.8 138.0 7.9 -0.2 -12.7 79 82 A C S S- 0 0 21 -26,-2.3 2,-0.3 1,-0.3 -25,-0.2 0.784 74.6 -23.0 -76.7 -32.4 4.9 -2.3 -13.5 80 83 A C E -d 54 0A 1 -27,-1.4 -25,-2.4 -7,-0.1 2,-0.3 -0.974 59.9-130.1-170.6 171.8 6.1 -5.0 -11.1 81 84 A V E -de 55 97A 0 15,-2.6 17,-3.0 -2,-0.3 2,-0.5 -0.964 17.9-123.8-137.0 148.6 9.2 -6.5 -9.5 82 85 A I E + e 0 98A 2 -27,-2.1 -23,-2.0 -2,-0.3 -25,-0.5 -0.830 33.1 178.3 -95.8 128.9 10.7 -10.0 -9.1 83 86 A V E -de 59 99A 0 15,-2.8 17,-3.1 -2,-0.5 2,-0.4 -0.902 32.4-100.5-125.3 157.8 11.2 -11.2 -5.5 84 87 A H E > - e 0 100A 0 -25,-2.8 3,-1.3 -2,-0.3 17,-0.1 -0.649 15.8-152.0 -81.2 126.6 12.6 -14.4 -4.1 85 88 A G G > S+ 0 0 0 15,-2.3 3,-2.1 -2,-0.4 -1,-0.1 0.697 87.3 79.9 -65.1 -20.4 10.1 -16.9 -2.8 86 89 A F G 3 S+ 0 0 0 1,-0.3 222,-2.4 14,-0.2 223,-0.4 0.686 76.3 74.7 -66.7 -13.7 12.6 -18.3 -0.3 87 90 A L G X S+ 0 0 1 -3,-1.3 3,-2.3 220,-0.2 -1,-0.3 0.672 81.5 163.8 -65.9 -21.0 11.8 -15.3 1.9 88 91 A H T < + 0 0 61 -3,-2.1 220,-0.1 1,-0.4 32,-0.0 -0.147 59.8 22.8 -47.4 134.0 8.5 -17.0 2.9 89 92 A P T 3 S+ 0 0 71 0, 0.0 2,-1.6 0, 0.0 -1,-0.4 -0.986 125.4 56.6 -83.3 -0.1 6.8 -16.3 5.2 90 93 A S S < S+ 0 0 18 -3,-2.3 -2,-0.2 216,-1.0 -29,-0.1 -0.424 82.9 148.1 -86.8 60.3 8.4 -12.9 5.0 91 94 A L - 0 0 6 -2,-1.6 -6,-0.1 -5,-0.0 2,-0.1 -0.829 51.5-123.7-107.0 124.8 7.4 -12.5 1.4 92 95 A P - 0 0 24 0, 0.0 2,-0.2 0, 0.0 -9,-0.1 -0.428 41.2-175.2 -57.7 138.1 6.5 -9.2 -0.3 93 96 A R + 0 0 150 30,-0.1 30,-0.2 -2,-0.1 3,-0.2 -0.767 24.3 87.3-133.6 178.2 3.0 -9.5 -1.7 94 97 A G E > S- f 0 123A 31 28,-2.9 3,-1.9 -2,-0.2 30,-1.0 -0.432 85.4 -62.2 114.3 169.2 0.5 -7.6 -3.8 95 98 A Q E 3 S+ 0 0 109 1,-0.3 -1,-0.1 28,-0.2 28,-0.1 0.540 127.1 60.7 -70.5 -8.1 -0.3 -7.2 -7.5 96 99 A H E 3 S+ 0 0 85 -3,-0.2 -15,-2.6 -16,-0.1 2,-0.5 0.449 90.0 94.4 -92.1 -1.0 3.1 -5.6 -8.2 97 100 A V E < -e 81 0A 4 -3,-1.9 27,-2.0 -17,-0.2 28,-1.3 -0.824 49.0-172.1-109.3 123.2 5.0 -8.8 -7.1 98 101 A Y E -ef 82 125A 0 -17,-3.0 -15,-2.8 -2,-0.5 2,-0.6 -0.925 21.1-145.9 -99.6 131.0 6.3 -11.7 -9.1 99 102 A V E -ef 83 126A 0 26,-2.6 28,-2.2 -2,-0.5 2,-0.4 -0.893 2.0-144.8-105.3 119.0 7.6 -14.5 -6.9 100 103 A L E +ef 84 127A 6 -17,-3.1 -15,-2.3 -2,-0.6 -14,-0.2 -0.664 26.5 166.0 -75.4 126.0 10.5 -16.6 -8.0 101 104 A V + 0 0 0 26,-1.8 2,-0.3 -2,-0.4 11,-0.1 0.469 66.1 19.2-123.9 -3.8 10.0 -20.3 -6.9 102 105 A K S S- 0 0 18 25,-0.7 -1,-0.4 10,-0.0 2,-0.2 -0.918 73.3-140.9-159.4 141.0 12.6 -22.2 -8.9 103 106 A M - 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