==== 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 OXIDOREDUCTASE 01-JUL-08 3DMT . COMPND 2 MOLECULE: GLYCERALDEHYDE-3-PHOSPHATE DEHYDROGENASE, GLYCOSO . SOURCE 2 ORGANISM_SCIENTIFIC: TRYPANOSOMA CRUZI; . AUTHOR R.V.C.GUIDO,T.L.BALLIANO,A.D.ANDRICOPULO,G.OLIVA . 1436 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 47411.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1073 74.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 200 13.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 148 10.3 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 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 144 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 156 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 323 22.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 31 2.2 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 9 1 4 0 4 5 0 0 5 3 0 4 0 0 1 0 1 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 12 4 4 16 0 4 0 4 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 6 0 10 2 0 4 4 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 . 2 0 0 0 0 4 0 0 4 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 M 0 0 112 0, 0.0 2,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0-177.6 -26.6 14.5 6.0 2 2 A P - 0 0 65 0, 0.0 2,-0.7 0, 0.0 29,-0.2 -0.343 360.0-119.8 -57.5 126.1 -23.7 14.9 8.4 3 3 A I E -a 31 0A 32 27,-1.2 29,-3.4 26,-0.3 2,-0.9 -0.598 28.2-143.7 -70.6 109.7 -22.9 11.6 10.1 4 4 A K E +a 32 0A 60 -2,-0.7 102,-2.5 27,-0.2 101,-1.4 -0.649 27.8 174.8 -88.1 105.2 -23.3 12.4 13.8 5 5 A V E -ab 33 106A 1 27,-3.5 29,-2.6 -2,-0.9 30,-0.9 -0.785 18.1-168.9-114.5 151.9 -20.7 10.6 15.9 6 6 A G E -ab 35 107A 0 100,-2.6 102,-2.6 -2,-0.3 2,-0.7 -0.994 12.1-148.9-137.4 133.7 -19.8 10.5 19.5 7 7 A I E -ab 36 108A 0 28,-1.8 30,-1.0 -2,-0.4 2,-0.9 -0.894 6.3-160.1-106.9 112.6 -16.7 8.9 21.0 8 8 A N E S+ab 37 109A 3 100,-2.3 102,-1.7 -2,-0.7 103,-0.4 -0.802 74.3 26.4 -93.9 103.3 -17.1 7.6 24.6 9 9 A G > - 0 0 8 28,-2.0 2,-1.4 -2,-0.9 5,-0.6 0.738 69.7-150.2 107.9 82.4 -13.6 7.2 26.1 10 10 A F T 5 + 0 0 1 27,-1.7 2,-0.1 4,-0.2 29,-0.1 -0.627 52.9 110.8 -85.0 88.7 -10.9 9.5 24.6 11 11 A G T >>S- 0 0 21 -2,-1.4 4,-2.7 99,-0.2 5,-0.5 -0.358 89.7 -43.1-131.1-148.7 -7.7 7.4 25.0 12 12 A R H >5S+ 0 0 21 1272,-0.2 4,-2.1 2,-0.2 5,-0.1 0.949 144.8 32.3 -48.8 -48.2 -5.3 5.6 22.7 13 13 A I H >5S+ 0 0 34 97,-0.3 4,-2.9 2,-0.2 5,-0.3 0.949 118.8 51.4 -81.9 -48.9 -8.3 4.3 20.7 14 14 A G H >S+ 0 0 3 -4,-2.1 5,-2.9 2,-0.2 6,-0.7 0.831 115.1 48.8 -73.7 -34.1 -11.3 10.1 10.8 22 22 A C H ><5S+ 0 0 3 -4,-2.0 3,-1.5 4,-0.2 -2,-0.2 0.936 113.3 46.6 -60.0 -52.0 -9.5 13.5 10.6 23 23 A E H 3<5S+ 0 0 74 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.771 105.1 58.8 -66.0 -33.6 -6.7 12.0 8.6 24 24 A D T 3<5S- 0 0 59 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.342 119.4-116.7 -74.5 6.7 -9.1 10.2 6.3 25 25 A G T < 5S+ 0 0 40 -3,-1.5 5,-0.3 -5,-0.1 -3,-0.2 0.744 81.9 122.3 67.2 28.1 -10.4 13.8 5.7 26 26 A L X + 0 0 3 -5,-2.9 5,-3.2 -6,-0.1 -4,-0.2 0.714 27.8 114.4 -95.6 -24.8 -13.8 13.0 7.1 27 27 A L B 5S-c 31 0A 27 -6,-0.7 2,-0.8 1,-0.2 5,-0.2 -0.287 95.3 -5.7 -57.6 123.0 -14.1 15.5 10.0 28 28 A G T 5S+ 0 0 35 3,-3.5 -1,-0.2 1,-0.2 4,-0.1 -0.314 134.4 57.1 90.9 -49.1 -17.0 17.9 9.2 29 29 A T T 5S+ 0 0 105 -2,-0.8 -26,-0.3 -4,-0.2 -1,-0.2 0.963 126.7 4.5 -77.2 -85.3 -17.7 16.6 5.7 30 30 A E T 5S+ 0 0 78 -5,-0.3 -27,-1.2 -4,-0.2 2,-0.4 0.850 136.6 38.6 -69.2 -34.9 -18.4 12.9 5.9 31 31 A I E < -ac 3 27A 1 -5,-3.2 -3,-3.5 -29,-0.2 2,-0.8 -0.966 59.2-162.0-132.7 128.1 -18.3 12.8 9.7 32 32 A D E -a 4 0A 32 -29,-3.4 -27,-3.5 -2,-0.4 2,-1.1 -0.903 8.9-160.2-106.8 101.2 -19.5 15.1 12.4 33 33 A V E +a 5 0A 0 -2,-0.8 -27,-0.2 -29,-0.2 3,-0.1 -0.774 16.8 176.7 -75.3 103.1 -17.8 14.3 15.7 34 34 A V E + 0 0 23 -29,-2.6 52,-2.1 -2,-1.1 2,-0.3 0.890 59.6 0.8 -77.4 -44.1 -20.4 16.1 17.9 35 35 A A E -ad 6 86A 0 -30,-0.9 -28,-1.8 50,-0.2 -1,-0.3 -0.991 53.4-163.0-148.4 149.0 -18.9 15.1 21.3 36 36 A V E -ad 7 87A 0 50,-2.6 52,-2.4 -2,-0.3 2,-0.3 -0.725 18.5-152.9-116.6 172.5 -16.0 13.2 22.8 37 37 A V E +ad 8 88A 2 -30,-1.0 -28,-2.0 -2,-0.3 -27,-1.7 -0.940 25.8 136.2-155.6 133.4 -15.8 12.0 26.5 38 38 A D E - d 0 89A 12 50,-0.8 52,-0.8 2,-0.5 -27,-0.1 -0.745 67.2 -62.9-144.4-161.2 -13.3 11.2 29.2 39 39 A M S S+ 0 0 123 -2,-0.2 51,-0.8 50,-0.1 2,-0.1 0.986 115.3 30.8 -54.6 -67.6 -12.7 11.9 32.8 40 40 A N - 0 0 29 49,-0.1 -2,-0.5 2,-0.1 48,-0.0 -0.364 67.0-137.4 -91.7 170.7 -12.4 15.7 32.7 41 41 A T + 0 0 57 -2,-0.1 2,-1.1 -4,-0.1 46,-0.2 0.253 59.3 134.5-105.2 3.8 -14.0 18.2 30.4 42 42 A D >> - 0 0 21 1,-0.2 4,-2.2 2,-0.1 3,-0.6 -0.404 34.1-174.9 -59.8 91.4 -10.7 20.1 30.2 43 43 A A H 3> S+ 0 0 0 32,-2.4 4,-3.2 -2,-1.1 -1,-0.2 0.818 81.7 61.9 -62.8 -29.1 -10.6 20.7 26.4 44 44 A E H 3> S+ 0 0 92 31,-0.5 4,-1.7 2,-0.2 -1,-0.2 0.861 106.0 44.7 -63.9 -39.6 -7.1 22.1 26.9 45 45 A Y H <> S+ 0 0 2 -3,-0.6 4,-2.4 2,-0.2 -2,-0.2 0.933 113.5 49.7 -70.6 -45.4 -5.9 18.7 28.2 46 46 A F H X S+ 0 0 1 -4,-2.2 4,-2.6 1,-0.2 5,-0.2 0.939 110.6 52.2 -50.6 -51.3 -7.7 16.8 25.4 47 47 A A H X S+ 0 0 2 -4,-3.2 4,-2.5 1,-0.2 -1,-0.2 0.894 109.8 47.1 -55.0 -46.4 -6.1 19.2 22.9 48 48 A Y H X S+ 0 0 5 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.904 112.5 50.8 -61.1 -43.4 -2.6 18.6 24.3 49 49 A Q H < S+ 0 0 8 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.850 115.1 42.3 -62.9 -39.9 -3.3 14.8 24.2 50 50 A M H < S+ 0 0 0 -4,-2.6 9,-0.2 -5,-0.2 -2,-0.2 0.839 113.0 54.0 -73.5 -35.5 -4.4 15.0 20.6 51 51 A R H < S+ 0 0 53 -4,-2.5 8,-2.1 -5,-0.2 2,-0.4 0.899 112.5 41.5 -66.6 -40.6 -1.6 17.4 19.6 52 52 A Y < + 0 0 27 -4,-2.1 2,-0.4 6,-0.2 6,-0.2 -0.912 59.9 173.2-123.6 130.2 1.2 15.2 20.9 53 53 A D > - 0 0 1 -2,-0.4 4,-1.5 4,-0.2 -3,-0.0 -0.992 27.5-146.1-140.4 127.1 1.6 11.4 20.6 54 54 A T T 4 S+ 0 0 19 -2,-0.4 -1,-0.1 2,-0.2 4,-0.1 0.846 101.7 21.8 -59.2 -39.9 4.6 9.5 21.7 55 55 A V T 4 S+ 0 0 23 2,-0.1 -1,-0.2 198,-0.1 199,-0.1 0.847 128.6 42.3 -96.2 -44.0 4.2 6.9 18.8 56 56 A H T 4 S- 0 0 15 1,-0.2 -2,-0.2 -4,-0.0 -1,-0.1 0.493 98.0-140.2 -94.1 1.0 2.1 8.7 16.2 57 57 A G < - 0 0 30 -4,-1.5 -1,-0.2 2,-0.1 -4,-0.2 -0.253 49.6 -14.7 79.1-165.6 3.8 12.0 16.4 58 58 A K S S- 0 0 96 -6,-0.2 -6,-0.2 1,-0.1 2,-0.2 -0.480 74.9-105.6 -75.5 142.0 2.2 15.4 16.2 59 59 A F - 0 0 22 -8,-2.1 -1,-0.1 -9,-0.2 4,-0.1 -0.496 22.5-137.5 -64.2 131.1 -1.4 15.7 15.0 60 60 A K S S+ 0 0 125 -2,-0.2 2,-0.4 -41,-0.1 -1,-0.1 0.660 83.6 71.7 -69.0 -16.4 -1.5 17.1 11.4 61 61 A Y S S- 0 0 46 -42,-0.0 2,-0.2 1,-0.0 -2,-0.1 -0.836 88.1-114.1-105.0 140.9 -4.4 19.3 12.3 62 62 A E - 0 0 144 -2,-0.4 19,-1.3 1,-0.0 2,-0.5 -0.477 30.1-158.7 -68.6 131.4 -4.4 22.4 14.5 63 63 A V E +E 80 0A 3 -2,-0.2 2,-0.2 17,-0.2 17,-0.2 -0.970 17.1 167.8-120.8 118.9 -6.4 21.9 17.7 64 64 A T E -E 79 0A 73 15,-2.3 15,-2.8 -2,-0.5 2,-0.3 -0.598 22.3-133.6-113.2-179.4 -7.8 24.9 19.6 65 65 A T E +E 78 0A 35 13,-0.3 2,-0.3 -2,-0.2 13,-0.2 -0.902 22.5 168.3-133.7 159.0 -10.3 25.1 22.4 66 66 A T E -E 77 0A 45 11,-2.1 11,-2.5 -2,-0.3 10,-0.9 -0.945 37.8 -99.4-157.6 169.2 -13.4 27.2 23.2 67 67 A K - 0 0 82 -2,-0.3 8,-0.1 8,-0.3 19,-0.0 -0.753 17.8-149.2 -92.8 144.7 -16.3 27.3 25.6 68 68 A S S S+ 0 0 50 -2,-0.3 -1,-0.1 1,-0.3 7,-0.1 0.883 93.5 23.9 -76.1 -43.7 -19.6 26.1 24.3 69 69 A S S > S- 0 0 50 -3,-0.1 3,-2.1 1,-0.1 -1,-0.3 -0.971 79.4-133.1-119.4 136.1 -21.4 28.5 26.6 70 70 A P T 3 S+ 0 0 126 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.672 105.2 71.9 -62.1 -14.3 -19.6 31.7 27.8 71 71 A S T 3 S+ 0 0 101 -4,-0.0 2,-0.2 0, 0.0 0, 0.0 0.644 76.5 97.8 -71.1 -21.5 -21.0 30.6 31.2 72 72 A V S < S- 0 0 40 -3,-2.1 4,-0.1 1,-0.1 -5,-0.0 -0.488 70.5-137.5 -81.1 143.0 -18.6 27.6 31.5 73 73 A A S S+ 0 0 98 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 0.942 82.3 21.9 -63.6 -56.7 -15.4 28.0 33.6 74 74 A K S S- 0 0 108 1,-0.1 -1,-0.1 -8,-0.0 -8,-0.1 -0.824 99.8 -81.8-112.5 153.4 -12.8 26.2 31.3 75 75 A D + 0 0 40 -2,-0.3 -32,-2.4 1,-0.2 -31,-0.5 -0.340 45.9 172.3 -48.6 125.0 -12.8 25.5 27.6 76 76 A D + 0 0 18 -10,-0.9 11,-3.4 -34,-0.2 2,-0.4 0.214 52.5 81.7-121.7 4.7 -14.9 22.4 27.1 77 77 A T E -EF 66 86A 2 -11,-2.5 -11,-2.1 9,-0.2 2,-0.3 -0.960 63.8-149.0-121.0 132.7 -15.0 22.5 23.3 78 78 A L E -EF 65 85A 0 7,-4.1 7,-2.7 -2,-0.4 2,-0.5 -0.744 7.3-157.5 -89.6 143.3 -12.3 21.3 20.9 79 79 A V E +EF 64 84A 22 -15,-2.8 -15,-2.3 -2,-0.3 2,-0.5 -0.976 12.8 178.7-122.3 117.5 -11.9 23.0 17.6 80 80 A V E > S-EF 63 83A 0 3,-2.8 3,-1.7 -2,-0.5 -17,-0.2 -0.956 75.8 -25.6-124.4 116.2 -10.2 20.9 14.9 81 81 A N T 3 S- 0 0 112 -19,-1.3 -1,-0.2 -2,-0.5 3,-0.1 0.914 129.8 -48.5 41.5 49.6 -9.8 22.5 11.5 82 82 A G T 3 S+ 0 0 66 1,-0.2 2,-0.5 -20,-0.2 -1,-0.3 0.511 112.3 123.4 76.0 8.3 -12.8 24.6 12.4 83 83 A H E < - 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0 0 1 -28,-0.5 4,-2.7 -30,-0.3 5,-0.8 -0.757 31.8-157.8 -75.2 98.5 18.0 2.5 44.2 1415 335 D N T 45S+ 0 0 8 -2,-1.4 4,-0.3 1,-0.2 -1,-0.2 0.801 86.7 38.1 -54.1 -35.1 14.8 4.5 44.6 1416 336 D E T >5S+ 0 0 7 3,-0.1 4,-1.4 -3,-0.1 -1,-0.2 0.927 124.9 34.0 -76.0 -50.5 12.9 1.4 45.6 1417 337 D W H >5S+ 0 0 6 2,-0.2 4,-1.8 3,-0.2 -2,-0.2 0.858 116.1 48.6 -81.7 -43.5 15.4 -0.5 47.7 1418 338 D G H X5S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 3,-0.3 0.982 116.2 45.5 -63.6 -55.2 17.4 2.2 49.5 1419 339 D Y H >X S+ 0 0 90 -4,-2.3 4,-2.7 2,-0.2 3,-1.1 0.933 111.6 48.3 -62.1 -51.8 11.3 1.9 74.3 1436 356 D S H 3< S+ 0 0 83 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.916 111.2 49.6 -55.9 -49.1 13.8 4.4 75.9 1437 357 D A T 3< S+ 0 0 77 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.508 117.2 42.1 -71.1 -8.6 11.0 7.0 76.5 1438 358 D R T <4 0 0 88 -3,-1.1 -2,-0.2 -4,-0.3 -1,-0.2 0.826 360.0 360.0-102.3 -56.0 8.7 4.4 78.2 1439 359 D L < 0 0 143 -4,-2.7 -1,-0.2 -5,-0.1 -2,-0.1 -0.784 360.0 360.0-121.2 360.0 11.1 2.4 80.4