==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 01-MAR-04 1UXU . COMPND 2 MOLECULE: GLYCERALDEHYDE-3-PHOSPHATE DEHYDROGENASE (NADP+); . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOPROTEUS TENAX; . AUTHOR E.LORENTZEN,R.HENSEL,E.POHL . 499 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20771.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 362 72.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 53 10.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 46 9.2 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 . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 36 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 58 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 152 30.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 4 0 1 0 0 1 1 1 2 3 0 0 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 2 3 4 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 . 3 4 1 1 1 0 0 0 1 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 1 1 0 0 1 1 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 3 A A > 0 0 86 0, 0.0 3,-1.0 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0-168.9 1.1 79.6 20.0 2 4 A G G > - 0 0 46 1,-0.3 3,-1.1 2,-0.2 89,-0.0 -0.663 360.0 -7.2 83.2-128.2 -1.6 82.3 20.2 3 5 A L G 3 S+ 0 0 18 -2,-0.4 -1,-0.3 1,-0.2 3,-0.2 0.606 134.8 64.0 -78.6 -8.7 -4.3 81.7 22.7 4 6 A L G X> + 0 0 3 -3,-1.0 4,-2.2 1,-0.2 3,-1.4 0.166 69.0 129.7 -99.3 19.7 -2.9 78.3 23.2 5 7 A E T <4 S+ 0 0 136 -3,-1.1 -1,-0.2 1,-0.3 -2,-0.1 0.872 79.6 22.6 -35.2 -78.8 0.4 79.7 24.6 6 8 A G T 34 S+ 0 0 81 -3,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.360 122.3 62.5 -80.7 9.3 0.9 77.7 27.8 7 9 A V T <4 S+ 0 0 13 -3,-1.4 -2,-0.2 11,-0.0 -1,-0.2 0.904 84.5 69.6 -96.2 -60.6 -1.3 74.9 26.5 8 10 A I S < S- 0 0 11 -4,-2.2 2,-0.6 9,-0.1 9,-0.2 -0.366 71.4-144.2 -63.6 137.8 0.3 73.4 23.5 9 11 A K B -A 16 0A 94 7,-2.0 7,-2.3 -2,-0.1 2,-2.2 -0.925 6.2-152.2-108.3 116.4 3.6 71.5 24.1 10 12 A E + 0 0 136 -2,-0.6 2,-0.4 5,-0.2 -2,-0.0 -0.352 37.2 169.1 -81.6 57.2 6.2 71.8 21.4 11 13 A K > - 0 0 121 -2,-2.2 2,-0.9 3,-0.3 3,-0.7 -0.601 60.0 -30.6 -74.8 124.3 7.4 68.3 22.6 12 14 A G T 3 S- 0 0 86 -2,-0.4 -2,-0.1 1,-0.2 4,-0.0 -0.518 122.9 -33.0 70.0-104.0 9.9 66.9 20.1 13 15 A G T 3 S+ 0 0 77 -2,-0.9 -1,-0.2 1,-0.2 -3,-0.0 0.676 119.9 53.5-124.5 -30.2 9.0 68.2 16.7 14 16 A V S < S- 0 0 42 -3,-0.7 -3,-0.3 -5,-0.0 -1,-0.2 -0.826 89.5 -94.3-112.3 151.1 5.3 68.8 16.3 15 17 A P - 0 0 45 0, 0.0 30,-2.0 0, 0.0 2,-0.6 -0.380 36.8-147.0 -61.9 133.3 2.8 70.7 18.5 16 18 A V E -Ab 9 45A 2 -7,-2.3 -7,-2.0 28,-0.2 30,-0.2 -0.907 7.0-157.6-110.3 108.2 1.1 68.4 21.1 17 19 A Y E - b 0 46A 21 28,-3.6 30,-2.4 -2,-0.6 -9,-0.1 -0.721 11.0-154.0 -85.9 116.4 -2.5 69.4 22.0 18 20 A P - 0 0 4 0, 0.0 9,-0.2 0, 0.0 2,-0.1 -0.402 20.5-104.8 -86.0 166.3 -3.6 68.1 25.4 19 21 A S E -D 26 0B 0 7,-2.1 7,-3.1 28,-0.4 2,-0.7 -0.492 28.7-119.8 -82.9 157.7 -7.2 67.3 26.4 20 22 A Y E -DE 25 217B 7 197,-2.0 197,-2.7 5,-0.2 2,-0.5 -0.899 23.4-165.3-102.1 113.9 -9.1 69.7 28.7 21 23 A L - 0 0 30 3,-2.3 195,-0.2 -2,-0.7 4,-0.1 -0.211 53.2 -86.1 -93.2 43.7 -10.1 67.7 31.8 22 24 A A S S+ 0 0 6 -2,-0.5 194,-0.1 193,-0.3 -1,-0.1 0.960 119.7 16.6 56.0 58.1 -12.6 70.1 33.4 23 25 A G S S+ 0 0 24 192,-0.1 2,-0.3 188,-0.0 -1,-0.2 -0.112 125.8 36.1 146.8 -42.5 -10.2 72.2 35.3 24 26 A E S S- 0 0 150 188,-0.1 -3,-2.3 189,-0.0 2,-0.2 -0.998 73.9-120.9-142.2 139.9 -6.7 71.6 33.9 25 27 A W E +D 20 0B 57 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.580 68.2 85.3 -75.9 145.6 -5.4 70.9 30.4 26 28 A G E -D 19 0B 16 -7,-3.1 -7,-2.1 -2,-0.2 21,-0.1 -0.964 41.0-170.9 165.8-146.2 -3.6 67.6 30.3 27 29 A G - 0 0 19 -2,-0.3 21,-0.1 -9,-0.2 -2,-0.0 -0.241 18.8-147.3 126.9 145.1 -3.9 63.9 29.9 28 30 A S + 0 0 86 -2,-0.1 2,-0.2 19,-0.1 3,-0.1 -0.112 62.9 101.1-134.8 37.4 -1.8 60.7 30.2 29 31 A G S S- 0 0 24 19,-1.5 21,-0.1 1,-0.2 19,-0.1 -0.456 84.3 -47.3-109.6-174.3 -3.1 58.4 27.5 30 32 A Q - 0 0 111 19,-0.2 18,-2.3 -2,-0.2 2,-0.3 -0.157 55.6-128.8 -54.0 144.6 -1.8 57.5 24.1 31 33 A E E -C 47 0A 62 16,-0.2 2,-0.4 -3,-0.1 16,-0.2 -0.706 25.9-154.1 -92.0 152.3 -0.8 60.5 21.9 32 34 A I E -C 46 0A 33 14,-2.2 14,-2.1 -2,-0.3 2,-0.2 -0.994 11.5-120.3-135.6 138.1 -2.3 60.5 18.4 33 35 A E E -C 45 0A 102 -2,-0.4 2,-0.6 12,-0.2 12,-0.3 -0.475 15.8-154.7 -76.3 141.5 -1.2 62.1 15.1 34 36 A V E -C 44 0A 1 10,-2.9 9,-2.8 -2,-0.2 10,-0.9 -0.957 18.2-169.0-117.1 110.3 -3.4 64.6 13.4 35 37 A K E -C 42 0A 101 -2,-0.6 7,-0.2 7,-0.3 5,-0.1 -0.574 17.7-124.1-100.4 162.9 -2.7 64.7 9.6 36 38 A S >> - 0 0 2 5,-1.9 4,-1.6 -2,-0.2 3,-0.9 -0.876 6.4-143.5-105.8 136.3 -3.8 67.1 6.9 37 39 A P T 34 S+ 0 0 7 0, 0.0 300,-0.2 0, 0.0 -1,-0.1 0.704 97.3 72.8 -69.5 -14.9 -5.7 66.0 3.9 38 40 A I T 34 S- 0 0 21 63,-0.5 332,-0.1 1,-0.2 64,-0.1 0.851 126.8 -6.5 -66.9 -35.2 -3.7 68.6 2.0 39 41 A D T <4 S- 0 0 86 -3,-0.9 -1,-0.2 2,-0.2 3,-0.1 0.113 87.9-116.9-148.8 23.2 -0.5 66.6 2.1 40 42 A L S < S+ 0 0 91 -4,-1.6 2,-0.3 1,-0.2 -5,-0.0 0.644 70.7 140.8 45.8 18.3 -1.2 63.6 4.3 41 43 A A - 0 0 41 -5,-0.4 -5,-1.9 1,-0.1 2,-0.6 -0.632 61.5-107.0 -93.1 149.6 1.5 65.0 6.6 42 44 A T E + C 0 35A 42 -2,-0.3 -7,-0.3 -7,-0.2 3,-0.1 -0.589 37.2 173.5 -73.1 115.5 1.3 65.0 10.4 43 45 A I E - 0 0 39 -9,-2.8 2,-0.3 -2,-0.6 -8,-0.2 0.533 61.5 -22.6-102.8 -6.1 0.7 68.6 11.6 44 46 A A E - C 0 34A 1 -10,-0.9 -10,-2.9 -30,-0.1 2,-0.3 -0.977 56.3-120.2 179.7 178.7 0.2 67.9 15.3 45 47 A K E -bC 16 33A 68 -30,-2.0 -28,-3.6 -2,-0.3 2,-0.4 -0.955 14.8-148.7-137.8 155.7 -0.6 65.4 18.0 46 48 A V E -bC 17 32A 1 -14,-2.1 -14,-2.2 -2,-0.3 2,-0.7 -0.969 15.5-131.6-126.9 143.5 -3.4 65.2 20.7 47 49 A I E - C 0 31A 6 -30,-2.4 172,-0.5 -2,-0.4 -28,-0.4 -0.854 21.6-151.0 -95.8 116.0 -3.1 63.6 24.1 48 50 A S - 0 0 2 -18,-2.3 -19,-1.5 -2,-0.7 2,-0.1 -0.573 23.7-109.3 -82.8 150.1 -6.1 61.3 24.7 49 51 A P - 0 0 4 0, 0.0 -19,-0.2 0, 0.0 -1,-0.1 -0.470 28.0-116.2 -79.7 153.2 -7.1 60.9 28.4 50 52 A S > - 0 0 30 -21,-0.1 4,-2.0 -2,-0.1 3,-0.4 -0.342 34.4-100.9 -78.3 167.6 -6.6 57.7 30.3 51 53 A R H > S+ 0 0 182 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.924 125.2 52.5 -57.1 -44.7 -9.6 55.8 31.5 52 54 A E H > S+ 0 0 141 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.818 109.4 50.2 -60.6 -31.2 -9.1 57.2 35.0 53 55 A E H > S+ 0 0 21 -3,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.827 108.8 50.4 -77.4 -32.4 -9.0 60.7 33.6 54 56 A V H X S+ 0 0 4 -4,-2.0 4,-2.6 2,-0.2 5,-0.3 0.955 113.3 48.0 -66.8 -47.8 -12.2 60.2 31.7 55 57 A E H X S+ 0 0 94 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.912 113.3 46.2 -57.6 -46.8 -13.8 58.9 34.9 56 58 A R H X S+ 0 0 133 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.882 112.1 51.6 -66.8 -37.5 -12.5 61.8 36.9 57 59 A T H X S+ 0 0 2 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.936 110.1 47.3 -64.7 -47.3 -13.6 64.4 34.3 58 60 A L H X S+ 0 0 4 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.923 111.5 53.5 -60.0 -41.7 -17.1 63.0 34.2 59 61 A D H X S+ 0 0 46 -4,-2.1 4,-2.6 -5,-0.3 5,-0.3 0.896 110.7 45.2 -61.6 -41.1 -17.2 63.0 38.0 60 62 A V H X>S+ 0 0 38 -4,-2.2 4,-2.9 2,-0.2 5,-2.3 0.952 111.9 51.1 -67.8 -47.6 -16.1 66.7 38.1 61 63 A L H <>S+ 0 0 0 -4,-2.9 5,-2.3 3,-0.2 -2,-0.2 0.889 117.2 41.4 -54.4 -41.9 -18.6 67.7 35.4 62 64 A F H <5S+ 0 0 65 -4,-2.4 -2,-0.2 3,-0.2 -1,-0.2 0.921 121.4 36.5 -74.4 -50.0 -21.4 66.0 37.3 63 65 A K H <5S+ 0 0 114 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.811 142.0 4.7 -77.3 -27.7 -20.7 66.9 40.8 64 66 A R T X5S+ 0 0 147 -4,-2.9 4,-2.4 -5,-0.3 -3,-0.2 0.712 120.0 63.4-122.4 -46.5 -19.4 70.5 40.1 65 67 A G H > S+ 0 0 116 -3,-0.2 4,-3.4 2,-0.2 -1,-0.2 0.875 111.9 51.1 -73.1 -35.6 -23.8 73.6 39.4 68 70 A S H < S+ 0 0 35 -4,-2.4 4,-0.3 2,-0.2 -2,-0.2 0.898 116.5 42.3 -66.6 -41.2 -21.1 76.1 38.1 69 71 A A H >< S+ 0 0 0 -4,-2.7 3,-1.0 -5,-0.2 -2,-0.2 0.965 121.0 40.9 -67.3 -53.5 -22.9 76.3 34.7 70 72 A R H 3< S+ 0 0 87 -4,-2.4 -2,-0.2 113,-0.4 -3,-0.2 0.899 113.1 52.6 -64.6 -42.9 -26.4 76.4 36.3 71 73 A D T 3< S+ 0 0 116 -4,-3.4 -1,-0.2 -5,-0.2 -2,-0.2 0.436 88.2 89.2 -77.8 1.6 -25.5 78.7 39.1 72 74 A M S < S- 0 0 22 -3,-1.0 5,-0.1 -4,-0.3 -4,-0.0 -0.892 91.0-119.3 -93.4 115.6 -24.0 81.3 36.7 73 75 A P >> - 0 0 67 0, 0.0 4,-2.0 0, 0.0 3,-1.1 -0.176 17.9-113.4 -56.5 149.9 -27.0 83.5 35.8 74 76 A G H 3> S+ 0 0 31 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.847 114.9 61.3 -52.5 -39.5 -28.0 83.6 32.2 75 77 A T H 3> S+ 0 0 111 1,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.891 109.5 43.3 -58.6 -34.1 -27.1 87.3 31.9 76 78 A E H <> S+ 0 0 98 -3,-1.1 4,-2.7 2,-0.2 -1,-0.2 0.871 107.9 57.2 -78.5 -37.1 -23.5 86.3 32.7 77 79 A R H X S+ 0 0 28 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.916 106.9 51.1 -58.3 -40.9 -23.5 83.2 30.5 78 80 A L H X S+ 0 0 20 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.899 107.5 52.1 -62.7 -41.8 -24.3 85.5 27.6 79 81 A A H X S+ 0 0 43 -4,-1.3 4,-2.6 -5,-0.2 5,-0.2 0.941 108.7 51.9 -60.6 -44.8 -21.4 87.8 28.6 80 82 A V H X S+ 0 0 6 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.939 111.9 45.3 -56.6 -48.5 -19.1 84.8 28.5 81 83 A L H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.893 112.4 50.7 -63.8 -40.7 -20.3 83.8 25.1 82 84 A R H X S+ 0 0 107 -4,-2.8 4,-2.0 2,-0.2 -1,-0.2 0.867 111.3 48.7 -64.8 -37.3 -20.0 87.3 23.7 83 85 A K H X S+ 0 0 88 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.932 110.0 51.7 -67.5 -44.5 -16.5 87.6 25.1 84 86 A A H X S+ 0 0 0 -4,-2.6 4,-2.5 -5,-0.2 5,-0.2 0.898 106.8 54.2 -59.8 -38.2 -15.6 84.3 23.5 85 87 A A H X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.958 107.6 50.6 -59.9 -49.2 -17.0 85.6 20.2 86 88 A D H X S+ 0 0 62 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.900 109.8 50.0 -54.1 -45.3 -14.6 88.6 20.5 87 89 A I H X S+ 0 0 13 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.945 112.4 45.6 -61.9 -48.7 -11.6 86.5 21.1 88 90 A I H < S+ 0 0 1 -4,-2.5 7,-0.3 1,-0.2 -1,-0.2 0.908 111.1 54.9 -61.9 -40.7 -12.2 84.2 18.2 89 91 A E H >< S+ 0 0 93 -4,-2.7 3,-1.2 -5,-0.2 -1,-0.2 0.882 108.3 46.2 -61.6 -40.9 -12.9 87.1 15.9 90 92 A R H 3< S+ 0 0 158 -4,-2.1 -1,-0.2 1,-0.3 3,-0.2 0.789 115.9 47.0 -74.6 -21.4 -9.6 88.8 16.7 91 93 A N T 3X S+ 0 0 36 -4,-1.5 4,-2.0 -5,-0.2 -1,-0.3 0.014 80.2 125.4-101.7 25.3 -7.8 85.5 16.2 92 94 A L H <> + 0 0 30 -3,-1.2 4,-3.4 1,-0.2 3,-0.5 0.924 65.9 50.0 -50.6 -61.2 -9.8 84.9 13.0 93 95 A D H > S+ 0 0 104 1,-0.3 4,-3.3 -3,-0.2 -1,-0.2 0.869 112.7 50.0 -48.9 -41.0 -6.9 84.3 10.5 94 96 A V H > S+ 0 0 62 2,-0.2 4,-2.0 -3,-0.2 -1,-0.3 0.882 111.5 46.4 -68.0 -39.2 -5.4 81.8 12.9 95 97 A F H X S+ 0 0 2 -4,-2.0 4,-1.7 -3,-0.5 -2,-0.2 0.940 116.7 46.4 -66.4 -45.1 -8.7 79.9 13.3 96 98 A A H X S+ 0 0 0 -4,-3.4 4,-2.9 -5,-0.2 3,-0.3 0.941 109.0 54.3 -61.3 -47.7 -9.2 80.0 9.6 97 99 A E H X S+ 0 0 112 -4,-3.3 4,-2.3 -5,-0.3 5,-0.2 0.906 109.7 47.9 -53.2 -46.0 -5.6 78.9 8.9 98 100 A V H X S+ 0 0 26 -4,-2.0 4,-2.7 2,-0.2 5,-0.4 0.822 110.8 50.6 -67.3 -32.2 -6.1 75.9 11.1 99 101 A L H X>S+ 0 0 0 -4,-1.7 4,-2.9 -3,-0.3 6,-0.9 0.961 111.0 49.1 -68.6 -49.2 -9.4 74.9 9.4 100 102 A V H X5S+ 0 0 6 -4,-2.9 4,-0.9 4,-0.2 -2,-0.2 0.910 120.6 36.2 -54.3 -47.7 -7.8 75.2 6.0 101 103 A M H <5S+ 0 0 45 -4,-2.3 -63,-0.5 -5,-0.2 -1,-0.2 0.919 124.6 37.6 -74.7 -47.6 -4.8 73.0 7.0 102 104 A N H <5S+ 0 0 0 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.873 131.6 26.0 -75.9 -35.6 -6.5 70.5 9.3 103 105 A A H <5S- 0 0 0 -4,-2.9 -3,-0.2 -5,-0.4 -2,-0.2 0.625 98.1-124.4-102.5 -18.3 -9.8 70.1 7.5 104 106 A G << + 0 0 0 -4,-0.9 -4,-0.2 -5,-0.9 231,-0.2 0.727 53.3 160.0 80.7 23.9 -8.7 70.9 3.9 105 107 A K - 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