==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 16-OCT-02 1N13 . COMPND 2 MOLECULE: PYRUVOYL-DEPENDENT ARGININE DECARBOXYLASE BETA . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOCALDOCOCCUS JANNASCHII; . AUTHOR W.D.TOLBERT,D.E.GRAHAM,R.H.WHITE,S.E.EALICK . 949 12 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37459.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 650 68.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 5.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 268 28.2 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 . 87 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 164 17.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.3 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 0 0 0 0 0 6 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 6 0 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 . 11 0 0 0 0 0 6 6 0 6 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 6 0 1 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 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 7 A P 0 0 144 0, 0.0 3,-0.2 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0 150.1 14.7 28.3 -7.1 2 8 A L + 0 0 191 1,-0.2 2,-0.4 2,-0.0 0, 0.0 0.578 360.0 48.1 -81.6 -13.5 12.6 30.2 -4.6 3 9 A H S S- 0 0 69 2,-0.0 -1,-0.2 162,-0.0 162,-0.0 -0.893 92.4-126.9-133.3 102.7 9.5 28.1 -5.4 4 10 A A - 0 0 33 -2,-0.4 2,-0.5 -3,-0.2 161,-0.1 -0.177 22.6-143.8 -49.5 127.9 10.1 24.3 -5.5 5 11 A Y - 0 0 156 160,-0.0 2,-0.1 -4,-0.0 -1,-0.1 -0.878 13.2-124.3-103.2 125.6 8.9 22.9 -8.8 6 12 A F + 0 0 60 -2,-0.5 2,-0.3 324,-0.0 324,-0.1 -0.438 42.1 166.8 -65.8 135.4 7.3 19.4 -8.8 7 13 A K - 0 0 78 322,-0.3 3,-0.1 -2,-0.1 151,-0.0 -0.993 35.3-123.1-153.1 153.4 9.1 17.0 -11.1 8 14 A L - 0 0 37 -2,-0.3 219,-0.1 1,-0.2 218,-0.0 -0.530 58.2 -72.9 -87.5 161.3 9.3 13.4 -12.0 9 15 A P - 0 0 3 0, 0.0 149,-0.2 0, 0.0 -1,-0.2 -0.295 44.6-172.8 -55.6 139.2 12.8 11.7 -11.9 10 16 A N + 0 0 42 147,-1.8 44,-2.4 43,-0.1 2,-0.3 0.285 61.5 60.8-118.8 7.4 14.9 12.9 -14.8 11 17 A T E -aB 54 157A 1 146,-1.7 146,-2.1 42,-0.2 2,-0.4 -0.978 55.2-170.0-135.0 146.6 17.9 10.5 -14.4 12 18 A V E -aB 55 156A 0 42,-2.1 44,-2.4 -2,-0.3 2,-0.4 -0.996 7.6-170.1-135.1 130.7 18.2 6.7 -14.5 13 19 A S E - B 0 155A 1 142,-1.9 142,-3.0 -2,-0.4 2,-0.5 -0.992 13.7-143.4-128.7 129.0 21.4 4.9 -13.5 14 20 A L E + B 0 154A 37 -2,-0.4 2,-0.3 42,-0.3 44,-0.2 -0.788 29.2 165.2 -93.1 125.8 22.1 1.3 -14.0 15 21 A V E + B 0 153A 14 138,-2.5 138,-3.1 -2,-0.5 2,-0.3 -0.937 10.5 179.3-136.1 159.0 24.1 -0.4 -11.2 16 22 A A E + B 0 152A 24 -2,-0.3 2,-0.3 136,-0.2 136,-0.2 -0.987 7.6 154.9-157.8 153.5 24.8 -4.0 -10.2 17 23 A G E - B 0 151A 1 134,-2.6 134,-2.6 -2,-0.3 2,-0.3 -0.985 19.0-149.9-169.8 169.6 26.8 -5.9 -7.5 18 24 A S E + B 0 150A 25 -2,-0.3 2,-0.3 132,-0.2 132,-0.2 -0.971 15.3 169.4-148.0 162.5 27.1 -9.1 -5.5 19 25 A S E - B 0 149A 27 130,-1.8 130,-2.2 -2,-0.3 12,-0.2 -0.970 31.0-117.2-172.0 153.4 28.3 -10.2 -2.1 20 26 A E E - B 0 148A 42 -2,-0.3 2,-0.3 128,-0.2 128,-0.2 -0.491 38.0-177.2 -86.6 165.6 28.5 -13.0 0.4 21 27 A G - 0 0 14 126,-2.0 6,-0.1 -2,-0.2 125,-0.1 -0.984 41.4-124.4-164.0 155.1 26.7 -12.5 3.7 22 28 A E S S+ 0 0 133 -2,-0.3 -1,-0.1 1,-0.1 126,-0.1 0.721 104.0 16.0 -73.3 -23.1 26.1 -14.2 7.1 23 29 A T S > S- 0 0 31 124,-0.1 4,-2.4 1,-0.1 5,-0.2 -0.941 89.1-103.2-142.8 161.0 22.4 -13.8 6.5 24 30 A P H > S+ 0 0 71 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.919 122.1 48.0 -53.5 -44.9 20.2 -13.1 3.4 25 31 A L H > S+ 0 0 47 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.856 111.7 49.3 -66.8 -35.7 19.6 -9.5 4.4 26 32 A N H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.849 111.1 49.9 -70.9 -34.0 23.3 -9.0 5.1 27 33 A A H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 122,-0.2 0.902 111.7 48.8 -67.8 -41.5 24.3 -10.5 1.7 28 34 A F H X S+ 0 0 15 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.930 110.8 50.0 -62.9 -46.0 21.7 -8.2 0.1 29 35 A D H X S+ 0 0 11 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.916 110.8 50.3 -59.3 -43.9 23.1 -5.2 2.0 30 36 A G H X S+ 0 0 5 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.866 108.6 51.7 -62.8 -37.0 26.6 -6.2 0.8 31 37 A A H X S+ 0 0 0 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.905 109.9 48.8 -66.9 -42.0 25.4 -6.5 -2.8 32 38 A L H X>S+ 0 0 5 -4,-2.4 5,-2.3 2,-0.2 4,-0.7 0.885 111.2 50.8 -63.7 -39.9 23.9 -2.9 -2.6 33 39 A L H ><5S+ 0 0 52 -4,-2.2 3,-1.0 4,-0.3 5,-0.2 0.924 109.9 49.3 -62.8 -43.8 27.2 -1.7 -1.1 34 40 A N H 3<5S+ 0 0 104 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.836 110.3 52.5 -64.3 -31.9 29.1 -3.4 -4.0 35 41 A A H 3<5S- 0 0 12 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.593 118.6-112.4 -79.4 -14.1 26.7 -1.7 -6.4 36 42 A G T <<5S+ 0 0 49 -3,-1.0 -3,-0.2 -4,-0.7 3,-0.1 0.548 97.9 87.5 94.7 7.8 27.3 1.7 -4.9 37 43 A I > < + 0 0 3 -5,-2.3 3,-0.8 -6,-0.2 -4,-0.3 -0.086 45.7 117.1-128.3 35.1 23.9 2.3 -3.4 38 44 A G T 3 S+ 0 0 5 -6,-0.5 -5,-0.2 -5,-0.2 -6,-0.1 0.700 72.8 52.3 -77.2 -19.1 24.3 0.7 -0.0 39 45 A N T 3 S+ 0 0 39 -7,-0.2 25,-2.4 -3,-0.1 2,-0.3 0.079 97.3 75.4-108.1 24.7 23.8 3.8 2.0 40 46 A V S < S- 0 0 8 -3,-0.8 2,-0.7 23,-0.2 26,-0.2 -0.849 84.3-105.4-126.7 163.6 20.5 5.1 0.6 41 47 A N E -c 66 0A 1 24,-2.7 26,-2.8 -2,-0.3 2,-0.4 -0.829 30.5-145.8 -92.8 116.8 16.9 3.9 1.0 42 48 A L E -c 67 0A 0 -2,-0.7 330,-2.3 24,-0.2 2,-0.8 -0.695 6.9-162.1 -84.7 128.1 15.6 2.0 -2.0 43 49 A I E -c 68 0A 1 24,-2.7 26,-2.6 -2,-0.4 2,-0.2 -0.925 25.6-135.0-106.8 98.3 11.9 2.5 -2.7 44 50 A R E -c 69 0A 99 -2,-0.8 162,-0.5 326,-0.5 2,-0.3 -0.369 16.9-152.4 -61.2 125.6 11.2 -0.4 -5.0 45 51 A I B E 205 0B 4 24,-2.2 26,-0.4 -2,-0.2 160,-0.2 -0.763 360.0 360.0 -99.5 145.4 9.2 0.5 -8.0 46 52 A S 0 0 47 158,-2.4 159,-0.1 -2,-0.3 -1,-0.1 0.425 360.0 360.0-130.8 360.0 6.9 -2.0 -9.7 47 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 48 54 B I 0 0 16 0, 0.0 52,-0.2 0, 0.0 155,-0.1 0.000 360.0 360.0 360.0 125.7 9.2 3.1 -16.1 49 55 B M B -J 99 0C 11 50,-2.2 50,-2.7 41,-0.2 3,-0.1 -0.833 360.0-119.2 -89.5 116.8 11.8 5.7 -17.2 50 56 B P > - 0 0 5 0, 0.0 3,-1.9 0, 0.0 176,-0.2 -0.130 35.5 -90.5 -55.0 147.4 10.0 9.1 -17.4 51 57 B P T 3 S+ 0 0 28 0, 0.0 47,-0.1 0, 0.0 45,-0.1 -0.305 114.6 17.6 -57.4 145.4 9.9 10.8 -20.9 52 58 B E T 3 S+ 0 0 185 43,-0.5 2,-0.1 45,-0.3 46,-0.1 0.411 93.7 134.9 71.1 -4.0 13.0 13.1 -21.3 53 59 B A < - 0 0 15 -3,-1.9 2,-0.4 -44,-0.1 -42,-0.2 -0.418 46.8-138.4 -71.6 156.2 14.8 11.4 -18.5 54 60 B E E -a 11 0A 77 -44,-2.4 -42,-2.1 -3,-0.1 2,-0.6 -0.925 9.6-124.0-123.7 142.4 18.5 10.5 -19.2 55 61 B I E +a 12 0A 51 -2,-0.4 -42,-0.2 -44,-0.2 -44,-0.0 -0.754 48.5 161.6 -81.9 118.9 20.6 7.5 -18.5 56 62 B V - 0 0 24 -44,-2.4 -42,-0.3 -2,-0.6 716,-0.1 -0.890 45.3 -82.6-135.7 163.7 23.6 8.8 -16.6 57 63 B P S S- 0 0 61 0, 0.0 716,-0.1 0, 0.0 -42,-0.1 -0.411 70.8 -74.8 -66.7 149.1 26.3 7.4 -14.3 58 64 B L - 0 0 48 -44,-0.2 3,-0.0 715,-0.1 -45,-0.0 -0.198 56.8-136.6 -47.0 120.2 25.1 7.0 -10.6 59 65 B P - 0 0 39 0, 0.0 2,-0.9 0, 0.0 -1,-0.1 -0.135 31.8 -83.4 -72.4 173.2 25.0 10.6 -9.1 60 66 B K - 0 0 195 1,-0.0 -2,-0.0 0, 0.0 0, 0.0 -0.754 54.3-158.3 -81.3 107.2 26.2 11.5 -5.7 61 67 B L - 0 0 33 -2,-0.9 3,-0.1 -3,-0.0 2,-0.1 -0.787 17.6-116.4 -93.8 131.7 23.2 10.4 -3.6 62 68 B P > - 0 0 64 0, 0.0 3,-2.1 0, 0.0 -1,-0.0 -0.417 43.7 -96.8 -64.1 138.0 22.7 11.9 -0.1 63 69 B M T 3 S+ 0 0 57 1,-0.3 -23,-0.2 -23,-0.1 -25,-0.0 -0.324 110.3 17.7 -57.3 132.0 22.9 9.2 2.6 64 70 B G T 3 S+ 0 0 0 -25,-2.4 -1,-0.3 1,-0.2 -24,-0.2 0.418 87.1 155.2 86.2 -0.5 19.5 8.0 3.5 65 71 B A < - 0 0 0 -3,-2.1 -24,-2.7 -26,-0.2 2,-1.2 -0.234 50.5-120.4 -60.3 145.2 17.8 9.5 0.4 66 72 B L E -c 41 0A 12 265,-0.3 -24,-0.2 261,-0.2 -1,-0.1 -0.772 38.7-171.0 -90.7 95.0 14.6 7.7 -0.6 67 73 B V E -c 42 0A 0 -26,-2.8 -24,-2.7 -2,-1.2 2,-0.3 -0.805 22.2-133.6 -97.6 115.4 15.6 6.6 -4.1 68 74 B P E +c 43 0A 2 0, 0.0 88,-3.0 0, 0.0 2,-0.4 -0.503 40.4 175.7 -64.3 123.2 12.9 5.1 -6.4 69 75 B T E -cD 44 155A 0 -26,-2.6 -24,-2.2 -2,-0.3 2,-0.5 -0.995 32.9-151.8-141.6 134.3 14.6 2.0 -7.8 70 76 B A E + D 0 154A 4 84,-2.3 84,-2.7 -2,-0.4 2,-0.3 -0.888 38.0 163.1 -97.9 130.6 13.6 -0.9 -10.0 71 77 B Y E - D 0 153A 12 -2,-0.5 2,-0.4 -26,-0.4 82,-0.2 -0.992 33.2-156.3-151.8 159.1 15.7 -3.9 -9.1 72 78 B G E + D 0 152A 1 80,-2.4 80,-2.4 -2,-0.3 2,-0.3 -0.976 23.3 168.3-131.3 141.2 16.1 -7.7 -9.3 73 79 B Y E - 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0 0 0 -47,-0.1 2,-0.2 -2,-0.1 -1,-0.1 -0.475 23.2-113.6 -97.2 166.9 8.6 6.6 -21.7 99 105 B G B -J 49 0C 1 -50,-2.7 -50,-2.2 -2,-0.2 2,-0.5 -0.661 26.2-129.0 -95.1 156.7 11.3 4.0 -21.4 100 106 B L E -L 90 0D 7 -10,-2.0 -10,-2.9 -2,-0.2 2,-0.5 -0.938 15.2-157.8-113.3 123.9 10.6 0.5 -20.0 101 107 B I E -L 89 0D 11 -2,-0.5 2,-0.3 -12,-0.2 -12,-0.2 -0.841 12.2-176.3-101.9 129.7 12.7 -1.0 -17.2 102 108 B M E -L 88 0D 3 -14,-2.4 -14,-2.3 -2,-0.5 2,-0.3 -0.942 6.9-160.0-124.8 146.1 12.8 -4.8 -16.8 103 109 B E E -L 87 0D 34 -2,-0.3 2,-0.3 -16,-0.2 -16,-0.2 -0.944 8.3-178.3-126.5 148.7 14.5 -6.9 -14.2 104 110 B Y E +L 86 0D 65 -18,-2.3 -18,-2.9 -2,-0.3 2,-0.3 -0.995 4.6 175.4-146.6 146.1 15.5 -10.5 -14.1 105 111 B E E +L 85 0D 89 -2,-0.3 2,-0.3 -20,-0.2 -20,-0.2 -0.984 17.5 133.1-147.7 148.7 17.2 -12.9 -11.6 106 112 B G E -L 84 0D 10 -22,-2.1 -22,-2.5 -2,-0.3 2,-1.7 -0.984 62.9 -77.5 178.9 171.6 17.9 -16.6 -11.7 107 113 B K S S+ 0 0 146 -2,-0.3 2,-0.3 -24,-0.2 -24,-0.2 -0.678 93.8 90.5 -87.3 79.7 20.2 -19.5 -11.2 108 114 B C S S- 0 0 13 -2,-1.7 -2,-0.2 -27,-0.1 2,-0.1 -0.905 79.8 -71.1-156.7-177.6 22.1 -18.9 -14.4 109 115 B S > - 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