==== 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 29-MAR-01 1IBU . COMPND 2 MOLECULE: HISTIDINE DECARBOXYLASE BETA CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: LACTOBACILLUS SP.; . AUTHOR S.WORLEY,E.SCHELP,A.F.MONZINGO,S.ERNST,J.D.ROBERTUS . 886 9 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33652.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 608 68.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 60 6.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 181 20.4 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 . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.7 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 . 62 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 83 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 166 18.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.4 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 3 0 0 3 3 0 3 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 RESIDUES PER ALPHA HELIX . 15 6 3 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 . 7 9 0 3 1 0 1 1 3 3 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 3 3 5 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 1 A S >> 0 0 53 0, 0.0 3,-1.7 0, 0.0 4,-1.2 0.000 360.0 360.0 360.0 172.0 -12.0 5.0 73.3 2 2 A E H 3> + 0 0 126 1,-0.3 4,-1.9 2,-0.2 5,-0.2 0.768 360.0 59.5 -40.3 -37.2 -14.0 7.9 74.7 3 3 A L H 3> S+ 0 0 39 1,-0.2 4,-2.7 2,-0.2 -1,-0.3 0.926 99.4 55.3 -62.3 -45.0 -10.9 9.9 75.3 4 4 A D H <> S+ 0 0 17 -3,-1.7 4,-3.6 1,-0.3 5,-0.3 0.930 105.3 55.2 -54.6 -43.8 -9.8 9.8 71.7 5 5 A A H X S+ 0 0 46 -4,-1.2 4,-0.9 1,-0.3 -1,-0.3 0.897 112.2 39.9 -60.6 -41.8 -13.2 11.3 70.9 6 6 A K H < S+ 0 0 106 -4,-1.9 -1,-0.3 -3,-0.2 -2,-0.2 0.844 119.3 50.6 -76.3 -23.5 -12.7 14.3 73.2 7 7 A L H ><>S+ 0 0 1 -4,-2.7 5,-1.7 -5,-0.2 3,-1.6 0.841 99.9 61.5 -78.3 -36.3 -9.1 14.4 72.0 8 8 A N H ><5S+ 0 0 82 -4,-3.6 3,-2.3 1,-0.3 -1,-0.2 0.891 92.4 64.5 -65.6 -33.9 -9.7 14.4 68.3 9 9 A K T 3<5S+ 0 0 184 -4,-0.9 -1,-0.3 1,-0.3 -2,-0.2 0.639 100.0 54.5 -69.4 -10.0 -11.7 17.6 68.4 10 10 A L T < 5S- 0 0 42 -3,-1.6 307,-2.0 2,-0.2 -1,-0.3 0.578 126.1-104.3 -90.5 -17.3 -8.4 19.3 69.5 11 11 A G T < 5S+ 0 0 37 -3,-2.3 2,-0.5 -4,-0.5 -3,-0.2 0.452 81.3 126.9 108.4 7.3 -6.7 17.8 66.4 12 12 A V < + 0 0 1 -5,-1.7 -1,-0.3 -8,-0.1 2,-0.3 -0.835 31.1 176.9-103.1 128.1 -4.8 15.1 68.3 13 13 A D - 0 0 26 -2,-0.5 -8,-0.0 22,-0.1 251,-0.0 -0.762 21.9-151.6-114.3 174.8 -5.1 11.4 67.2 14 14 A R + 0 0 8 -2,-0.3 2,-0.3 22,-0.1 -10,-0.0 -0.293 46.0 134.8-140.4 43.2 -3.2 8.5 68.7 15 15 A I + 0 0 33 2,-0.0 21,-2.3 234,-0.0 20,-0.6 -0.762 24.5 174.6 -86.9 144.6 -3.0 6.2 65.8 16 16 A A E +A 34 0A 3 -2,-0.3 234,-2.5 247,-0.2 2,-0.4 -0.599 9.1 159.7-152.5 88.4 0.6 4.7 65.4 17 17 A I E -Ab 33 250A 0 16,-2.6 16,-2.1 232,-0.3 233,-0.1 -0.904 24.6-151.5-115.2 143.7 0.8 2.1 62.7 18 18 A S E - b 0 251A 0 232,-3.0 234,-0.7 -2,-0.4 2,-0.1 -0.835 13.3-137.7-109.1 146.0 4.1 1.0 61.0 19 19 A P + 0 0 37 0, 0.0 2,-0.4 0, 0.0 5,-0.1 -0.154 67.4 106.2 -91.9 37.7 4.2 -0.2 57.4 20 20 A Y S S- 0 0 7 3,-0.4 2,-0.5 -2,-0.1 232,-0.4 -0.928 77.1-107.3-119.5 153.8 6.6 -3.1 58.1 21 21 A K S S- 0 0 94 583,-2.2 2,-2.2 -2,-0.4 583,-0.1 -0.609 93.7 -28.0 -75.3 122.5 6.1 -6.8 58.2 22 22 A Q S S+ 0 0 60 -2,-0.5 -1,-0.2 1,-0.1 2,-0.0 -0.220 111.1 108.6 68.2 -47.7 6.3 -7.8 61.8 23 23 A W - 0 0 8 -2,-2.2 -3,-0.4 104,-0.1 2,-0.2 -0.264 57.4-144.2 -66.3 141.8 8.7 -5.1 63.0 24 24 A T B -c 129 0B 0 104,-1.9 106,-2.4 226,-0.1 2,-0.3 -0.657 22.3-169.9 -88.8 161.6 7.8 -2.1 65.2 25 25 A R E -D 249 0C 0 224,-1.1 224,-2.2 -2,-0.2 2,-0.2 -0.904 20.3 -81.7-145.0 179.8 9.5 1.2 64.5 26 26 A G E > -D 248 0C 0 -2,-0.3 3,-2.0 222,-0.3 222,-0.3 -0.435 39.9 -87.4-102.4 159.7 9.7 4.5 66.2 27 27 A Y T 3 S+ 0 0 5 220,-2.0 109,-0.3 1,-0.3 -1,-0.1 -0.301 111.9 14.1 -54.2 127.8 7.9 7.7 66.7 28 28 A M T 3 S+ 0 0 21 1,-0.3 -1,-0.3 -3,-0.1 4,-0.1 -0.027 83.5 137.6 90.4 -17.9 8.7 10.1 63.9 29 29 A E X - 0 0 1 -3,-2.0 3,-1.2 105,-0.2 -1,-0.3 -0.315 65.1 -99.5 -62.2 137.1 10.3 7.7 61.5 30 30 A P T 3 S+ 0 0 34 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.156 103.1 34.7 -60.7 146.1 9.0 8.5 58.0 31 31 A G T 3 S+ 0 0 32 1,-0.3 2,-0.3 -3,-0.1 -2,-0.1 0.347 77.4 135.9 95.1 -4.2 6.3 6.4 56.6 32 32 A N < - 0 0 34 -3,-1.2 2,-0.5 -14,-0.1 -1,-0.3 -0.587 51.8-135.1 -77.3 138.3 4.5 5.8 59.8 33 33 A I E +A 17 0A 60 -16,-2.1 -16,-2.6 -2,-0.3 2,-0.2 -0.813 69.0 27.6 -93.0 126.2 0.8 6.1 59.4 34 34 A G E S-A 16 0A 21 -2,-0.5 -18,-0.2 -18,-0.2 -2,-0.0 -0.583 76.3-108.8 122.4 179.5 -0.8 8.1 62.2 35 35 A N S S+ 0 0 42 -20,-0.6 2,-0.2 -2,-0.2 -19,-0.2 0.161 83.2 73.6-136.6 25.6 0.4 10.9 64.6 36 36 A G - 0 0 6 -21,-2.3 2,-0.3 -24,-0.1 37,-0.1 -0.450 64.0-133.7-121.5-168.0 0.6 9.2 67.9 37 37 A Y - 0 0 1 35,-1.9 2,-0.4 -2,-0.2 212,-0.2 -0.933 4.3-138.4-146.6 165.9 2.9 6.8 69.6 38 38 A V E -E 248 0C 0 210,-2.4 210,-3.0 -2,-0.3 2,-0.2 -0.998 26.2-175.2-127.4 132.8 2.7 3.6 71.7 39 39 A T E +Ef 247 75C 0 35,-2.5 37,-2.8 -2,-0.4 2,-0.2 -0.664 6.3 179.3-121.3-178.9 5.0 3.2 74.7 40 40 A G - 0 0 0 206,-0.6 2,-0.4 35,-0.2 72,-0.1 -0.886 29.0 -97.5-164.6-175.0 5.8 0.5 77.2 41 41 A L + 0 0 1 -2,-0.2 2,-0.4 70,-0.2 204,-0.2 -0.974 33.4 171.8-126.3 127.3 8.1 -0.3 80.2 42 42 A K E +G 244 0D 5 202,-2.1 202,-2.0 -2,-0.4 2,-0.4 -0.976 7.9 158.2-138.7 127.2 11.3 -2.2 80.2 43 43 A V E +G 243 0D 0 -2,-0.4 2,-0.3 200,-0.2 200,-0.2 -0.972 16.9 149.2-142.7 124.7 13.8 -2.6 83.0 44 44 A D E -G 242 0D 2 198,-1.6 198,-2.1 -2,-0.4 2,-0.3 -0.958 19.3-168.5-154.9 156.8 16.2 -5.5 82.9 45 45 A A E +G 241 0D 11 250,-1.0 2,-0.3 -2,-0.3 196,-0.2 -0.972 4.3 180.0-148.0 162.4 19.8 -6.2 84.2 46 46 A G E G 240 0D 18 194,-2.0 194,-2.0 -2,-0.3 185,-0.1 -0.992 360.0 360.0-163.4 152.1 22.6 -8.8 83.7 47 47 A V 0 0 62 -2,-0.3 192,-0.3 192,-0.2 185,-0.0 -0.641 360.0 360.0 -89.8 360.0 26.1 -9.5 84.9 48 ! 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 49 64 A R 0 0 145 0, 0.0 191,-0.1 0, 0.0 -4,-0.1 0.000 360.0 360.0 360.0 -5.8 23.5 -7.8 77.4 50 65 A A > + 0 0 7 2,-0.1 3,-2.7 191,-0.1 -5,-0.1 0.823 360.0 43.0 -85.0 -71.3 21.1 -5.6 79.3 51 66 A E T 3 S+ 0 0 67 1,-0.3 6,-0.4 -7,-0.1 7,-0.1 0.647 109.1 55.7 -33.4 -57.6 18.9 -4.8 76.2 52 67 A T T 3 S+ 0 0 19 4,-0.2 70,-0.5 5,-0.1 2,-0.3 0.381 90.2 98.5 -63.7 -3.8 18.8 -8.3 74.7 53 68 A K S < S- 0 0 56 -3,-2.7 2,-0.4 2,-0.2 4,-0.1 -0.756 96.8 -27.0 -96.2 151.7 17.4 -9.8 77.9 54 69 A N S S+ 0 0 18 -2,-0.3 2,-0.5 2,-0.1 68,-0.3 -0.415 135.3 34.4 54.9-103.8 13.8 -10.5 78.5 55 70 A A S S- 0 0 2 -2,-0.4 2,-0.4 66,-0.1 -2,-0.2 -0.630 89.6-135.5 -81.9 119.3 12.1 -7.9 76.2 56 71 A Y + 0 0 3 64,-2.1 -4,-0.2 -2,-0.5 -5,-0.1 -0.575 42.0 155.9 -81.9 121.1 14.2 -7.4 73.1 57 72 A I > + 0 0 6 -2,-0.4 3,-0.7 -6,-0.4 -5,-0.1 -0.399 40.6 161.5-122.4 51.8 14.9 -3.9 71.8 58 73 A G T 3 + 0 0 2 1,-0.2 -2,-0.0 -7,-0.1 -7,-0.0 -0.312 47.9 12.9 -84.0 158.9 17.9 -5.3 70.2 59 74 A Q T 3 S+ 0 0 15 1,-0.2 73,-1.5 72,-0.1 -1,-0.2 0.753 91.3 147.5 57.5 34.8 20.0 -3.8 67.4 60 75 A I < - 0 0 2 -3,-0.7 2,-0.9 71,-0.1 -1,-0.2 -0.636 54.8-128.2-102.2 150.0 18.2 -0.5 67.7 61 76 A N - 0 0 3 72,-2.1 74,-0.3 -2,-0.2 2,-0.2 -0.842 36.6-151.4 -94.5 106.0 19.5 3.1 67.2 62 77 A M - 0 0 9 -2,-0.9 603,-1.9 72,-0.1 2,-0.4 -0.534 14.4-167.6 -79.6 143.5 18.5 4.8 70.5 63 78 A T E -h 136 0D 7 72,-1.2 74,-2.9 601,-0.2 2,-0.3 -0.988 20.2-133.8-125.5 119.8 17.7 8.4 70.7 64 79 A T E -h 137 0D 63 599,-0.4 298,-0.5 -2,-0.4 2,-0.4 -0.563 22.3-178.8 -80.9 139.5 17.4 9.9 74.2 65 80 A A B K 361 0E 4 72,-2.0 74,-0.3 -2,-0.3 296,-0.2 -0.990 360.0 360.0-125.7 137.3 14.6 12.1 75.2 66 81 A S 0 0 102 294,-1.7 295,-0.1 -2,-0.4 -1,-0.1 0.576 360.0 360.0-132.6 360.0 14.6 13.5 78.8 67 !* 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 68 83 B F 0 0 53 0, 0.0 2,-0.4 0, 0.0 111,-0.2 0.000 360.0 360.0 360.0 174.8 6.4 11.7 79.5 69 84 B T B +P 178 0F 4 109,-2.4 109,-1.7 4,-0.1 361,-0.1 -0.930 360.0 164.4-138.9 117.2 3.5 10.1 77.7 70 85 B G > - 0 0 10 360,-0.4 3,-2.5 -2,-0.4 360,-0.2 0.023 51.4 -32.4-112.4-140.9 0.9 12.6 76.8 71 86 B V T 3 S+ 0 0 2 358,-1.7 359,-0.1 1,-0.3 -64,-0.1 0.796 132.3 51.9 -57.7 -35.2 -2.1 13.2 74.6 72 87 B Q T 3 S+ 0 0 0 357,-0.4 -35,-1.9 -36,-0.1 -1,-0.3 0.357 96.4 118.2 -82.7 14.1 -0.7 11.0 71.9 73 88 B G < + 0 0 6 -3,-2.5 2,-0.3 -37,-0.1 -35,-0.1 -0.457 31.7 163.3-101.4 157.7 -0.1 8.1 74.4 74 89 B R - 0 0 3 -2,-0.2 -35,-2.5 -37,-0.1 2,-0.6 -0.920 28.6-139.1-156.2 129.9 -1.1 4.6 75.0 75 90 B V B >>> -f 39 0C 1 -2,-0.3 4,-2.0 -37,-0.2 5,-1.5 -0.869 22.9-120.6-100.6 122.9 0.8 2.3 77.3 76 91 B I B 345S+q 80 0G 1 -37,-2.8 39,-0.3 -2,-0.6 -35,-0.2 -0.469 103.2 20.5 -62.3 119.5 1.2 -1.3 76.1 77 92 B G T 345S+ 0 0 0 3,-2.6 6,-0.9 -2,-0.2 -1,-0.3 -0.346 127.1 46.6 114.0 -43.6 -0.4 -3.2 78.9 78 93 B Y T <45S+ 0 0 39 -3,-1.0 -2,-0.2 4,-0.2 4,-0.1 0.941 126.9 16.8 -94.5 -50.0 -2.6 -0.5 80.5 79 94 B D T <5S+ 0 0 44 -4,-2.0 2,-0.3 1,-0.2 -3,-0.2 0.723 134.0 25.0 -95.3 -43.3 -4.4 1.2 77.6 80 95 B I B - 0 0 10 -6,-0.9 3,-1.2 191,-0.2 4,-0.3 -0.746 19.7-128.5 -83.3 139.1 -3.1 -7.8 81.0 84 99 B P T >> S+ 0 0 52 0, 0.0 4,-1.4 0, 0.0 3,-1.3 0.870 99.8 76.3 -50.3 -45.1 -5.9 -9.0 83.4 85 100 B E H 3> S+ 0 0 74 1,-0.3 4,-2.3 2,-0.2 24,-0.0 0.782 76.3 76.9 -37.0 -43.1 -3.6 -8.5 86.4 86 101 B V H <4 S+ 0 0 6 -3,-1.2 -1,-0.3 1,-0.3 3,-0.2 0.797 105.5 27.6 -50.6 -50.6 -3.9 -4.8 86.3 87 102 B D H <4 S+ 0 0 115 -3,-1.3 -1,-0.3 -4,-0.3 -2,-0.2 0.834 117.2 63.2 -84.1 -23.1 -7.4 -4.4 88.0 88 103 B K H < S+ 0 0 135 -4,-1.4 -2,-0.2 2,-0.0 -1,-0.2 0.817 91.8 94.8 -59.3 -30.5 -6.8 -7.7 89.8 89 104 B A < - 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0 0 62 -5,-2.5 -1,-0.3 -6,-0.1 2,-0.2 -0.972 47.5-131.0-116.8 127.4 33.8 16.7 39.6 884 300 F K - 0 0 129 -2,-0.5 -5,-0.0 1,-0.1 0, 0.0 -0.489 34.8-103.9 -65.4 147.8 37.6 16.2 39.9 885 301 F S - 0 0 49 -2,-0.2 -1,-0.1 1,-0.1 4,-0.0 -0.157 31.1-176.5 -71.3 168.7 38.6 13.5 42.3 886 302 F L S S+ 0 0 36 -3,-0.1 -1,-0.1 -174,-0.1 3,-0.1 0.323 85.6 50.0-135.9 -22.1 40.0 14.2 45.7 887 303 F S S > S+ 0 0 28 1,-0.1 4,-0.8 4,-0.1 5,-0.3 0.954 82.7 117.9 -77.5 -52.1 40.7 10.7 46.9 888 304 F A T 4 S+ 0 0 62 1,-0.2 2,-1.2 2,-0.2 -1,-0.1 0.027 81.0 14.2 33.3 -96.8 42.5 10.1 43.7 889 305 F N T 4 S- 0 0 155 1,-0.1 -1,-0.2 -3,-0.1 2,-0.2 -0.660 118.2 -83.5-111.6 72.6 46.2 9.3 44.5 890 306 F N T 4 S+ 0 0 121 -2,-1.2 -2,-0.2 1,-0.2 2,-0.1 0.406 81.2 146.8 47.1 12.6 45.9 8.8 48.3 891 307 F A < + 0 0 77 -4,-0.8 2,-0.7 -2,-0.2 -1,-0.2 0.326 36.3 95.9 -62.5 2.5 46.0 12.6 49.0 892 308 F L - 0 0 28 -5,-0.3 2,-0.1 -2,-0.1 -180,-0.1 -0.897 56.8-159.7-107.7 122.5 43.7 12.6 52.1 893 309 F K 0 0 97 -2,-0.7 -65,-0.0 1,-0.1 -2,-0.0 -0.373 360.0 360.0 -76.2 167.0 45.3 12.5 55.5 894 310 F Y 0 0 42 -2,-0.1 -255,-1.0 -65,-0.1 -66,-0.2 0.520 360.0 360.0-131.6 360.0 43.1 11.4 58.5