==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 08-MAY-07 2PU1 . COMPND 2 MOLECULE: ENOLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: TRYPANOSOMA BRUCEI; . AUTHOR M.V.A.S.NAVARRO,D.J.RIGDEN,R.C.GARRATT,S.M.G.DIAS . 431 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17127.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 311 72.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 7.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 38 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 1 0.2 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 . 31 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 141 32.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 2.6 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 1 0 0 0 4 1 1 1 1 1 0 0 1 0 1 0 0 0 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 3 2 2 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 . 2 2 0 1 1 1 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 2 0 0 0 0 0 0 0 1 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 0 127 0, 0.0 3,-2.2 0, 0.0 80,-0.1 0.000 360.0 360.0 360.0 -35.1 32.1 -13.9 -12.1 2 0 A H T 3 + 0 0 130 1,-0.3 27,-0.4 26,-0.1 4,-0.1 0.755 360.0 49.6 -58.2 -21.7 34.2 -13.8 -15.3 3 1 A M T 3 S+ 0 0 88 25,-0.1 -1,-0.3 26,-0.1 81,-0.3 0.429 95.3 97.9 -98.3 2.7 31.8 -11.3 -16.7 4 2 A T S < S- 0 0 21 -3,-2.2 25,-0.4 1,-0.2 2,-0.3 -0.137 89.5 -64.0 -87.3 179.2 31.7 -8.9 -13.7 5 3 A I + 0 0 2 77,-2.4 76,-3.0 74,-0.3 23,-0.2 -0.471 47.3 179.6 -63.9 123.0 33.6 -5.7 -12.8 6 4 A Q + 0 0 101 21,-3.0 2,-0.3 1,-0.3 22,-0.2 0.807 62.0 3.7 -95.5 -37.8 37.3 -6.4 -12.6 7 5 A K E -A 27 0A 111 20,-1.5 20,-2.8 72,-0.1 2,-0.4 -0.984 52.1-165.5-151.7 147.3 38.8 -3.0 -11.7 8 6 A V E +A 26 0A 4 -2,-0.3 2,-0.4 18,-0.2 18,-0.2 -0.972 19.1 169.1-136.0 129.6 37.5 0.6 -11.0 9 7 A H E -A 25 0A 65 16,-2.5 16,-2.9 -2,-0.4 2,-0.3 -0.993 14.8-162.1-146.1 132.7 39.9 3.5 -11.0 10 8 A G E -A 24 0A 1 -2,-0.4 2,-0.3 58,-0.3 14,-0.2 -0.773 9.4-179.8-108.4 158.8 39.5 7.3 -10.9 11 9 A R E -A 23 0A 79 12,-2.3 12,-2.2 -2,-0.3 2,-0.5 -0.983 33.0-108.1-151.0 154.0 41.9 10.0 -11.9 12 10 A E E +A 22 0A 42 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.725 44.5 170.5 -81.5 126.7 42.0 13.8 -11.9 13 11 A V E -A 21 0A 27 8,-2.2 8,-3.0 -2,-0.5 2,-0.4 -0.839 33.5 -98.1-127.7 171.2 41.8 15.2 -15.5 14 12 A L E -A 20 0A 84 -2,-0.3 2,-0.1 6,-0.2 8,-0.0 -0.756 27.6-145.1 -97.4 140.8 41.3 18.7 -17.0 15 13 A D > - 0 0 10 4,-2.9 3,-2.4 -2,-0.4 363,-0.2 -0.295 42.7 -84.2 -89.2-179.0 38.0 20.1 -18.2 16 14 A S T 3 S+ 0 0 30 361,-2.4 362,-0.1 1,-0.3 388,-0.1 0.523 130.9 51.8 -74.1 -8.8 37.6 22.5 -21.2 17 15 A R T 3 S- 0 0 64 360,-0.2 -1,-0.3 2,-0.2 359,-0.1 0.316 121.8-106.3 -98.8 3.9 38.4 25.5 -18.9 18 16 A G S < S+ 0 0 33 -3,-2.4 -2,-0.2 1,-0.3 358,-0.0 0.638 78.1 134.3 78.7 13.9 41.5 23.9 -17.6 19 17 A N - 0 0 38 1,-0.1 -4,-2.9 20,-0.1 -1,-0.3 -0.769 61.8-101.5 -95.1 146.7 40.0 23.0 -14.2 20 18 A P E +A 14 0A 0 0, 0.0 2,-0.3 0, 0.0 -6,-0.2 -0.251 46.8 167.5 -61.5 145.8 40.4 19.5 -12.6 21 19 A T E -A 13 0A 2 -8,-3.0 -8,-2.2 -6,-0.1 2,-0.4 -0.871 34.2 -91.8-144.6-175.9 37.6 17.1 -12.8 22 20 A V E -A 12 0A 0 -2,-0.3 15,-2.8 15,-0.2 2,-0.4 -0.851 30.6-178.1-104.1 137.1 37.0 13.4 -12.2 23 21 A E E -AB 11 36A 15 -12,-2.2 -12,-2.3 -2,-0.4 2,-0.4 -0.986 9.1-161.9-126.4 145.6 37.2 10.6 -14.8 24 22 A V E -AB 10 35A 0 11,-2.8 11,-2.8 -2,-0.4 2,-0.5 -0.976 6.1-159.9-128.3 137.3 36.5 6.9 -14.0 25 23 A E E -AB 9 34A 23 -16,-2.9 -16,-2.5 -2,-0.4 2,-0.5 -0.975 2.1-165.8-114.8 126.3 37.4 3.7 -15.7 26 24 A V E -AB 8 33A 0 7,-2.6 7,-2.7 -2,-0.5 2,-0.5 -0.967 13.7-158.0-103.6 124.6 35.5 0.4 -15.1 27 25 A T E +AB 7 32A 34 -20,-2.8 -21,-3.0 -2,-0.5 -20,-1.5 -0.898 20.6 159.5-107.0 132.6 37.4 -2.6 -16.5 28 26 A T E > - B 0 31A 3 3,-2.4 3,-1.7 -2,-0.5 -23,-0.1 -0.790 61.7 -86.9-130.1-178.9 35.7 -5.9 -17.4 29 27 A E T 3 S+ 0 0 93 -27,-0.4 3,-0.1 -25,-0.4 -26,-0.1 0.728 127.3 62.3 -63.6 -18.0 36.9 -8.7 -19.7 30 28 A K T 3 S- 0 0 129 1,-0.3 2,-0.3 -27,-0.1 -1,-0.3 0.546 118.1 -91.7 -84.0 -13.5 35.2 -6.7 -22.5 31 29 A G E < -B 28 0A 26 -3,-1.7 -3,-2.4 2,-0.1 2,-0.5 -0.928 53.0 -40.8 142.9-160.3 37.5 -3.7 -22.1 32 30 A V E -B 27 0A 82 -2,-0.3 2,-0.6 -5,-0.2 -5,-0.2 -0.938 45.1-162.4-112.6 122.0 38.1 -0.4 -20.4 33 31 A F E -B 26 0A 29 -7,-2.7 -7,-2.6 -2,-0.5 2,-0.4 -0.938 10.4-167.0-115.8 117.6 35.0 1.9 -20.1 34 32 A R E +B 25 0A 141 -2,-0.6 2,-0.4 -9,-0.2 -9,-0.2 -0.885 11.5 173.7-117.9 129.6 35.9 5.5 -19.4 35 33 A S E -B 24 0A 0 -11,-2.8 -11,-2.8 -2,-0.4 2,-0.3 -0.990 12.1-157.4-135.0 141.2 33.5 8.3 -18.3 36 34 A A E -B 23 0A 4 -2,-0.4 -13,-0.2 -13,-0.2 346,-0.1 -0.904 16.3-126.4-121.6 150.8 34.3 11.9 -17.2 37 35 A V - 0 0 1 -15,-2.8 -15,-0.2 -2,-0.3 72,-0.1 -0.784 19.4-142.1 -99.7 130.7 32.3 14.3 -15.2 38 36 A P - 0 0 8 0, 0.0 2,-0.4 0, 0.0 339,-0.2 -0.227 13.0-141.2 -81.4 178.4 31.4 17.8 -16.4 39 37 A S B -C 376 0B 6 337,-3.1 337,-1.6 -18,-0.1 2,-0.1 -0.944 4.8-140.3-148.8 126.1 31.3 21.0 -14.2 40 38 A G - 0 0 9 -2,-0.4 3,-0.2 335,-0.2 334,-0.1 -0.379 10.2-167.7 -76.8 156.7 29.0 24.0 -14.1 41 39 A A S S+ 0 0 23 1,-0.1 2,-1.6 -2,-0.1 -1,-0.1 0.735 93.1 45.7-103.6 -52.2 29.9 27.6 -13.5 42 40 A S S S+ 0 0 8 115,-0.1 2,-0.3 2,-0.0 -1,-0.1 -0.486 89.0 178.1 -86.2 67.9 26.4 29.0 -13.0 43 41 A T - 0 0 59 -2,-1.6 2,-0.1 -3,-0.2 278,-0.0 -0.545 28.7-118.3 -82.2 135.1 25.5 26.1 -10.6 44 42 A G > - 0 0 6 -2,-0.3 3,-1.7 1,-0.1 -1,-0.1 -0.387 18.8-123.1 -65.1 147.8 22.0 25.9 -9.0 45 43 A V T 3 S+ 0 0 100 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.1 0.737 111.7 54.5 -61.8 -23.7 21.9 26.0 -5.2 46 44 A Y T 3 S+ 0 0 94 275,-0.3 -1,-0.3 3,-0.0 283,-0.1 0.323 80.9 120.8 -96.9 8.0 20.0 22.7 -5.2 47 45 A E S < S- 0 0 24 -3,-1.7 302,-0.2 1,-0.1 3,-0.1 -0.340 74.2 -93.4 -70.6 150.4 22.6 20.8 -7.3 48 46 A A - 0 0 14 300,-2.2 2,-0.2 276,-0.2 55,-0.2 -0.259 61.1 -76.9 -56.1 150.6 24.2 17.6 -5.9 49 47 A C - 0 0 28 53,-3.3 59,-2.9 300,-0.1 2,-0.8 -0.329 36.0-158.2 -62.0 120.6 27.5 18.2 -4.2 50 48 A E - 0 0 61 -2,-0.2 2,-0.6 58,-0.2 -1,-0.1 -0.868 23.0-143.9 -94.5 108.6 30.6 18.8 -6.5 51 49 A L + 0 0 35 -2,-0.8 16,-0.3 52,-0.1 2,-0.3 -0.662 24.2 176.6 -87.8 118.1 33.3 17.8 -4.1 52 50 A R - 0 0 55 -2,-0.6 12,-0.2 14,-0.1 10,-0.1 -0.847 33.4-125.7-117.3 159.4 36.6 19.9 -4.4 53 51 A D - 0 0 49 10,-2.4 9,-0.2 -2,-0.3 3,-0.1 0.813 22.7-146.6 -77.9 -35.2 39.7 19.8 -2.3 54 52 A G + 0 0 48 7,-2.2 2,-0.9 1,-0.2 8,-0.1 0.687 43.8 149.0 73.5 20.1 40.1 23.4 -1.2 55 53 A D > - 0 0 73 3,-0.2 6,-2.3 1,-0.2 3,-2.2 -0.776 36.4-160.0 -90.6 107.5 43.9 23.2 -1.3 56 54 A K T 3> S+ 0 0 141 -2,-0.9 4,-0.6 4,-0.3 -1,-0.2 0.755 88.3 63.8 -58.2 -25.8 45.1 26.7 -2.3 57 55 A K T 34 S+ 0 0 192 1,-0.1 2,-0.4 3,-0.1 -1,-0.3 0.491 102.4 53.6 -77.9 -7.6 48.5 25.2 -3.4 58 56 A R T X4>S- 0 0 75 -3,-2.2 3,-1.1 1,-0.0 5,-0.7 -0.961 133.2 -27.0-129.8 120.5 46.8 23.2 -6.2 59 57 A Y G >45S- 0 0 101 -2,-0.4 3,-1.9 1,-0.3 -2,-0.1 0.815 111.0 -72.7 52.9 34.9 44.6 24.7 -8.8 60 58 A V G 3<5S- 0 0 110 -4,-0.6 -4,-0.3 1,-0.3 -1,-0.3 0.891 100.5 -45.0 34.2 59.7 43.7 27.5 -6.2 61 59 A G G < 5S+ 0 0 7 -6,-2.3 -7,-2.2 -3,-1.1 -1,-0.3 0.437 115.8 109.7 71.6 9.0 41.6 24.9 -4.4 62 60 A K T < 5 + 0 0 96 -3,-1.9 -3,-0.2 -4,-0.4 -2,-0.1 0.253 42.5 132.8 -98.7 12.5 39.7 23.3 -7.3 63 61 A G < - 0 0 1 -5,-0.7 -10,-2.4 -8,-0.3 -9,-0.2 -0.188 46.9-153.7 -55.7 153.9 41.6 19.9 -7.1 64 62 A C > + 0 0 0 -12,-0.2 4,-2.7 -43,-0.2 5,-0.2 0.064 57.5 119.0-118.0 26.7 39.5 16.7 -7.3 65 63 A L H > S+ 0 0 79 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.874 76.6 50.8 -56.7 -42.1 42.0 14.4 -5.4 66 64 A Q H > S+ 0 0 80 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.954 111.4 46.2 -65.5 -46.7 39.4 13.7 -2.6 67 65 A A H > S+ 0 0 0 -16,-0.3 4,-2.0 1,-0.2 -2,-0.2 0.923 114.8 49.0 -58.4 -41.7 36.6 12.8 -5.1 68 66 A V H X S+ 0 0 15 -4,-2.7 4,-3.0 2,-0.2 -58,-0.3 0.913 109.7 50.8 -63.6 -44.1 39.2 10.6 -6.9 69 67 A K H X S+ 0 0 98 -4,-2.9 4,-3.1 2,-0.2 5,-0.4 0.887 107.1 55.3 -61.5 -39.7 40.3 9.0 -3.6 70 68 A N H X>S+ 0 0 16 -4,-2.6 5,-2.7 2,-0.2 4,-1.5 0.892 110.8 45.1 -58.5 -41.6 36.6 8.3 -2.8 71 69 A V H <>S+ 0 0 0 -4,-2.0 5,-3.0 3,-0.2 -2,-0.2 0.957 119.2 41.2 -62.0 -53.8 36.3 6.4 -6.2 72 70 A N H <5S+ 0 0 49 -4,-3.0 -2,-0.2 1,-0.2 -3,-0.2 0.835 127.7 27.6 -68.3 -33.0 39.6 4.5 -5.6 73 71 A E H <5S+ 0 0 123 -4,-3.1 -3,-0.2 -5,-0.2 -1,-0.2 0.608 133.4 17.6-109.0 -17.6 39.2 3.6 -1.9 74 72 A V T X5S+ 0 0 56 -4,-1.5 4,-1.1 -5,-0.4 -3,-0.2 0.715 126.2 32.8-122.2 -58.3 35.5 3.5 -1.2 75 73 A I H >> - 0 0 68 -79,-0.2 3,-2.0 -2,-0.2 7,-0.2 -0.663 25.2-157.6 -74.3 103.9 27.3 -7.5 -12.1 84 82 A E T 3 S+ 0 0 3 -2,-0.9 38,-0.3 1,-0.3 -1,-0.1 0.682 85.0 72.8 -58.8 -20.8 27.5 -4.2 -14.1 85 83 A L T 3 S+ 0 0 48 1,-0.2 2,-2.0 37,-0.1 -1,-0.3 0.716 75.9 83.5 -63.9 -21.3 24.0 -4.9 -15.8 86 84 A K <> + 0 0 99 -3,-2.0 4,-2.8 1,-0.2 5,-0.3 -0.484 54.8 161.3 -88.1 67.7 22.3 -4.1 -12.5 87 85 A Q H > S+ 0 0 5 -2,-2.0 4,-3.0 1,-0.2 5,-0.3 0.923 72.5 43.7 -57.0 -53.9 22.3 -0.3 -13.0 88 86 A E H > S+ 0 0 148 -3,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.924 115.0 49.9 -60.5 -46.0 19.6 0.5 -10.5 89 87 A E H > S+ 0 0 91 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.917 115.3 42.5 -57.4 -46.5 21.0 -1.9 -7.9 90 88 A L H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.920 114.2 50.2 -74.5 -40.3 24.6 -0.4 -8.2 91 89 A D H X S+ 0 0 1 -4,-3.0 4,-2.6 -5,-0.3 -2,-0.2 0.942 112.8 48.3 -56.8 -46.6 23.4 3.3 -8.4 92 90 A T H X S+ 0 0 60 -4,-2.9 4,-2.6 -5,-0.3 -2,-0.2 0.894 108.4 53.9 -62.4 -40.9 21.3 2.6 -5.2 93 91 A L H X S+ 0 0 52 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.918 109.9 47.7 -57.2 -44.3 24.4 1.0 -3.6 94 92 A M H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.910 109.6 53.3 -67.7 -39.0 26.4 4.1 -4.3 95 93 A L H X S+ 0 0 24 -4,-2.6 4,-2.8 1,-0.2 5,-0.3 0.935 113.4 43.1 -56.0 -47.7 23.5 6.3 -2.9 96 94 A R H < S+ 0 0 160 -4,-2.6 -1,-0.2 2,-0.2 -2,-0.2 0.805 108.2 58.6 -71.1 -33.0 23.6 4.2 0.3 97 95 A L H < S+ 0 0 58 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.900 112.5 41.4 -60.4 -41.5 27.4 4.3 0.4 98 96 A D H < S- 0 0 5 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.940 87.9-167.8 -68.9 -51.8 27.2 8.1 0.5 99 97 A G < + 0 0 58 -4,-2.8 -3,-0.1 1,-0.2 -4,-0.1 0.487 48.2 101.6 81.9 3.3 24.2 8.1 2.9 100 98 A T S > S- 0 0 49 -5,-0.3 3,-1.2 1,-0.1 -1,-0.2 -0.902 74.9-125.6-124.6 151.3 23.4 11.9 2.4 101 99 A P T 3 S+ 0 0 136 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.794 110.0 39.7 -66.1 -28.6 20.7 13.6 0.4 102 100 A N T 3 S- 0 0 84 -54,-0.1 -53,-3.3 -55,-0.0 6,-0.3 0.206 109.5-113.1-104.2 12.4 23.1 15.8 -1.6 103 101 A K <> + 0 0 6 -3,-1.2 4,-1.4 -55,-0.2 5,-0.3 0.865 69.0 146.0 55.7 37.5 25.9 13.3 -2.2 104 102 A G T 4 + 0 0 29 3,-0.2 -1,-0.1 2,-0.2 -5,-0.0 0.586 59.3 56.2 -83.7 -10.6 28.0 15.5 0.1 105 103 A K T 4 S+ 0 0 133 -5,-0.1 -1,-0.1 1,-0.0 -7,-0.1 0.960 126.2 13.0 -83.3 -58.7 30.0 12.6 1.7 106 104 A L T 4 S- 0 0 2 -12,-0.1 -36,-0.2 -6,-0.1 -2,-0.2 0.756 111.1-112.1 -86.8 -27.9 31.5 10.9 -1.4 107 105 A G >X - 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