==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 31-MAY-07 2Q50 . COMPND 2 MOLECULE: GLYOXYLATE REDUCTASE/HYDROXYPYRUVATE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR E.J.LEVIN,D.A.KONDRASHOV,G.E.WESENBERG,G.N.PHILLIPS JR.,CENT . 1284 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 52272.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 911 71.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 209 16.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.5 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 . 121 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 142 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 338 26.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 27 2.1 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 2 6 10 2 4 9 0 0 0 0 0 4 0 1 2 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 11 3 15 16 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 PARALLEL BRIDGES PER LADDER . 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 1 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 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 6 A L 0 0 146 0, 0.0 23,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 112.6 -1.5 -31.8 -95.7 2 7 A X B -a 24 0A 44 21,-1.0 23,-1.2 1,-0.1 2,-0.2 -0.404 360.0-110.2 -71.7 148.3 -0.8 -32.7 -92.1 3 8 A K - 0 0 46 43,-0.3 45,-2.6 21,-0.1 46,-1.7 -0.579 33.1-173.5 -83.5 144.4 -3.9 -33.0 -89.8 4 9 A V E -b 49 0B 0 21,-0.5 23,-3.2 -2,-0.2 2,-0.5 -0.985 7.2-159.1-139.3 125.2 -4.4 -30.4 -87.0 5 10 A F E -bc 50 27B 9 44,-2.9 46,-3.0 -2,-0.4 2,-0.6 -0.915 2.7-167.6-111.9 124.7 -7.1 -30.6 -84.4 6 11 A V E -bc 51 28B 2 21,-2.4 23,-2.2 -2,-0.5 46,-0.2 -0.946 11.7-152.9-109.1 120.2 -8.3 -27.5 -82.5 7 12 A T + 0 0 1 44,-2.1 28,-0.4 -2,-0.6 2,-0.3 0.278 69.5 10.0 -75.8 9.2 -10.5 -28.4 -79.4 8 13 A R S S- 0 0 0 43,-0.2 2,-0.4 26,-0.1 24,-0.2 -0.987 88.2 -75.6-175.5 165.3 -12.5 -25.2 -79.3 9 14 A R - 0 0 82 22,-1.8 452,-0.1 -2,-0.3 21,-0.1 -0.626 56.1-169.7 -74.4 130.6 -13.4 -21.9 -81.0 10 15 A I - 0 0 2 -2,-0.4 5,-0.2 1,-0.1 288,-0.1 -0.803 31.7 -65.9-123.5 164.0 -10.5 -19.5 -80.6 11 16 A P >> - 0 0 2 0, 0.0 3,-2.0 0, 0.0 4,-1.1 -0.207 53.4-114.3 -50.8 127.9 -9.8 -15.8 -81.2 12 17 A A H >> S+ 0 0 52 1,-0.3 4,-2.2 2,-0.2 3,-1.2 0.774 109.1 56.8 -28.2 -70.4 -9.9 -14.8 -84.9 13 18 A E H 3> S+ 0 0 112 1,-0.3 4,-1.5 2,-0.2 -1,-0.3 0.798 111.0 48.3 -40.7 -35.2 -6.3 -13.8 -85.6 14 19 A G H <> S+ 0 0 0 -3,-2.0 4,-1.5 2,-0.2 -1,-0.3 0.861 110.4 49.4 -76.7 -36.1 -5.3 -17.3 -84.4 15 20 A R H X S+ 0 0 24 -4,-1.5 4,-2.1 -5,-0.3 3,-1.0 0.910 110.0 43.6 -42.7 -54.6 -3.3 -17.9 -89.4 18 23 A L H 3< S+ 0 0 2 -4,-1.5 8,-0.3 1,-0.3 -1,-0.3 0.908 112.8 52.6 -58.4 -40.9 -4.0 -21.6 -89.2 19 24 A A H 3< S+ 0 0 80 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.3 0.674 108.1 54.5 -68.0 -15.7 -6.4 -21.1 -92.2 20 25 A R H << S+ 0 0 191 -4,-1.7 2,-0.9 -3,-1.0 -2,-0.2 0.871 79.6 96.1 -84.0 -41.8 -3.5 -19.3 -93.9 21 26 A A >< - 0 0 8 -4,-2.1 3,-2.9 -5,-0.2 5,-0.2 -0.309 59.8-164.9 -53.9 94.6 -1.0 -22.2 -93.5 22 27 A A T 3 S+ 0 0 89 -2,-0.9 -1,-0.2 1,-0.3 -4,-0.0 0.892 87.7 62.5 -50.1 -42.9 -1.5 -23.7 -97.0 23 28 A D T 3 S+ 0 0 48 -22,-0.1 -21,-1.0 -3,-0.1 2,-0.4 0.485 96.2 86.9 -63.5 -0.3 0.3 -26.8 -95.7 24 29 A C B < -a 2 0A 14 -3,-2.9 -21,-0.1 -6,-0.2 285,-0.0 -0.834 51.7-173.1-111.8 144.8 -2.6 -27.2 -93.2 25 30 A E - 0 0 128 -23,-1.2 -21,-0.5 -2,-0.4 -6,-0.1 -0.496 33.9-158.8-123.3 53.9 -6.0 -28.8 -93.4 26 31 A V - 0 0 49 -8,-0.3 2,-0.4 -5,-0.2 -21,-0.2 -0.021 7.7-161.0 -41.6 128.5 -7.1 -27.5 -90.0 27 32 A E E -c 5 0B 86 -23,-3.2 -21,-2.4 16,-0.0 2,-0.3 -0.947 13.2-170.3-115.8 136.4 -9.9 -29.3 -88.3 28 33 A Q E -c 6 0B 74 -2,-0.4 2,-0.9 -23,-0.2 -21,-0.2 -0.965 29.7-122.3-136.7 149.0 -11.9 -27.6 -85.5 29 34 A W - 0 0 70 -23,-2.2 2,-1.7 -2,-0.3 6,-0.0 -0.756 32.4-139.6 -85.2 105.9 -14.5 -28.2 -82.8 30 35 A D + 0 0 131 -2,-0.9 2,-0.2 -22,-0.1 -1,-0.1 -0.502 65.2 68.8 -71.6 85.2 -17.4 -25.8 -83.6 31 36 A S - 0 0 30 -2,-1.7 -22,-1.8 1,-0.1 4,-0.1 -0.886 68.7-132.7 171.8 156.8 -18.4 -24.6 -80.2 32 37 A D S S+ 0 0 47 -2,-0.2 429,-0.1 -24,-0.2 430,-0.1 0.481 84.3 93.2 -98.9 -8.1 -17.5 -22.6 -77.1 33 38 A E S S- 0 0 81 1,-0.1 2,-0.1 -3,-0.1 -24,-0.1 -0.543 92.4 -94.0 -83.6 151.3 -18.5 -25.4 -74.8 34 39 A P - 0 0 42 0, 0.0 -1,-0.1 0, 0.0 -26,-0.1 -0.432 41.4-116.9 -68.1 138.4 -15.8 -27.9 -73.7 35 40 A I - 0 0 13 -28,-0.4 5,-0.1 -2,-0.1 -28,-0.0 -0.623 29.2-115.9 -80.6 126.0 -15.6 -31.0 -75.8 36 41 A P > - 0 0 73 0, 0.0 4,-1.4 0, 0.0 5,-0.1 -0.023 27.4-108.5 -51.7 163.0 -16.5 -34.3 -74.1 37 42 A A H > S+ 0 0 70 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.856 115.1 58.9 -64.6 -36.1 -13.7 -36.9 -73.8 38 43 A K H > S+ 0 0 141 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.971 107.7 41.5 -57.8 -60.6 -15.3 -39.1 -76.4 39 44 A E H 4 S+ 0 0 57 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.822 112.8 57.5 -59.3 -31.8 -15.3 -36.7 -79.3 40 45 A L H >X S+ 0 0 6 -4,-1.4 4,-2.8 2,-0.3 3,-1.6 0.971 111.4 39.3 -63.4 -53.6 -11.8 -35.6 -78.3 41 46 A E H 3< S+ 0 0 76 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.762 119.0 50.1 -66.6 -22.8 -10.4 -39.1 -78.6 42 47 A R T 3< S+ 0 0 178 -4,-1.9 -1,-0.3 -5,-0.3 -2,-0.3 0.431 115.6 45.7 -90.4 -1.8 -12.7 -39.3 -81.7 43 48 A G T <4 S+ 0 0 4 -3,-1.6 -2,-0.2 -5,-0.2 4,-0.2 0.736 103.3 55.0-110.5 -33.4 -11.2 -36.0 -82.8 44 49 A V S < S+ 0 0 0 -4,-2.8 2,-0.4 2,-0.1 26,-0.1 0.218 74.4 136.4 -87.2 15.9 -7.4 -36.3 -82.4 45 50 A A S S- 0 0 49 1,-0.2 2,-0.6 -5,-0.2 21,-0.2 -0.498 84.4 -14.1 -67.8 121.6 -7.3 -39.5 -84.5 46 51 A G S S+ 0 0 28 20,-1.5 -43,-0.3 19,-0.5 -1,-0.2 -0.014 95.7 145.7 78.9 -33.9 -4.4 -39.3 -86.9 47 52 A A - 0 0 0 -2,-0.6 23,-0.2 -4,-0.2 -1,-0.2 0.061 39.4-158.9 -37.5 143.0 -3.9 -35.5 -86.3 48 53 A H S S+ 0 0 45 -45,-2.6 23,-2.7 1,-0.3 24,-1.4 0.631 79.1 36.6 -99.5 -22.8 -0.2 -34.5 -86.4 49 54 A G E -bd 4 72B 0 -46,-1.7 -44,-2.9 21,-0.2 2,-0.4 -0.997 64.8-165.8-136.4 137.8 -0.9 -31.3 -84.4 50 55 A L E -bd 5 73B 1 22,-2.1 24,-2.8 -2,-0.4 2,-0.6 -0.985 4.1-166.0-125.0 127.4 -3.2 -30.6 -81.5 51 56 A L E +bd 6 74B 0 -46,-3.0 -44,-2.1 -2,-0.4 24,-0.2 -0.941 28.6 168.9-112.3 108.6 -4.2 -27.1 -80.2 52 57 A C E - d 0 75B 0 22,-2.6 24,-1.4 -2,-0.6 2,-0.3 -0.183 23.9-139.9-107.1-162.4 -5.8 -27.5 -76.8 53 58 A L > - 0 0 0 22,-0.2 3,-1.2 3,-0.1 24,-0.1 -0.972 40.8 -86.2-157.9 159.3 -7.0 -25.6 -73.8 54 59 A L T 3 S+ 0 0 33 22,-0.3 23,-0.0 -2,-0.3 -1,-0.0 0.791 123.7 54.3 -36.5 -46.8 -7.1 -25.8 -70.0 55 60 A S T 3 S+ 0 0 43 403,-0.2 2,-0.6 2,-0.1 -1,-0.3 0.894 87.9 88.6 -59.9 -43.9 -10.3 -27.8 -70.0 56 61 A D S < S- 0 0 4 -3,-1.2 2,-1.2 1,-0.1 -3,-0.1 -0.445 73.3-147.4 -63.5 108.3 -9.0 -30.5 -72.4 57 62 A H - 0 0 117 -2,-0.6 2,-1.6 1,-0.1 5,-0.3 -0.659 12.2-166.8 -78.8 99.5 -7.3 -33.1 -70.2 58 63 A V B +g 83 0C 0 24,-2.2 26,-1.8 -2,-1.2 -1,-0.1 -0.552 31.5 146.3 -91.0 74.6 -4.5 -34.2 -72.5 59 64 A D S > S- 0 0 28 -2,-1.6 4,-1.2 24,-0.2 3,-0.2 -0.070 70.0 -69.4 -92.8-166.0 -3.6 -37.4 -70.6 60 65 A K H > S+ 0 0 117 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.764 126.5 65.2 -59.2 -27.2 -2.2 -40.8 -71.8 61 66 A R H >> S+ 0 0 163 2,-0.2 4,-2.3 1,-0.2 3,-0.5 0.964 100.1 43.8 -62.5 -58.2 -5.7 -41.4 -73.3 62 67 A I H 3> S+ 0 0 5 -5,-0.3 4,-2.8 1,-0.3 -1,-0.2 0.811 111.0 60.8 -58.9 -27.6 -5.7 -38.7 -76.0 63 68 A L H 3X S+ 0 0 0 -4,-1.2 4,-2.2 2,-0.2 -1,-0.3 0.898 106.4 42.7 -66.4 -42.6 -2.2 -39.8 -76.7 64 69 A D H << S+ 0 0 97 -4,-1.6 -2,-0.2 -3,-0.5 -1,-0.2 0.861 117.0 48.1 -72.5 -34.4 -3.2 -43.3 -77.6 65 70 A A H < S+ 0 0 31 -4,-2.3 -19,-0.5 1,-0.2 -2,-0.2 0.875 111.6 50.7 -71.7 -38.2 -6.2 -42.0 -79.6 66 71 A A H < S- 0 0 3 -4,-2.8 -20,-1.5 -5,-0.2 3,-0.3 0.954 97.6-168.1 -63.9 -51.7 -4.0 -39.5 -81.4 67 72 A G >< - 0 0 24 -4,-2.2 3,-1.1 1,-0.2 -1,-0.1 -0.241 39.4 -36.3 91.2-179.9 -1.4 -42.1 -82.4 68 73 A A T 3 S+ 0 0 107 1,-0.2 -1,-0.2 -4,-0.1 -2,-0.1 0.772 123.5 66.7 -48.9 -39.5 2.1 -42.0 -83.8 69 74 A N T 3 S+ 0 0 81 -3,-0.3 -1,-0.2 2,-0.0 -2,-0.1 0.877 71.9 107.3 -54.8 -41.1 1.6 -39.0 -86.1 70 75 A L < + 0 0 8 -3,-1.1 -21,-0.2 -23,-0.2 -22,-0.2 -0.162 33.6 154.6 -45.5 112.8 1.1 -36.6 -83.2 71 76 A K + 0 0 84 -23,-2.7 23,-3.0 1,-0.3 2,-0.4 0.663 58.1 29.8-115.1 -29.0 4.3 -34.5 -83.1 72 77 A V E -de 49 94B 0 -24,-1.4 -22,-2.1 21,-0.2 2,-0.6 -0.965 51.5-167.8-145.5 129.0 3.3 -31.2 -81.3 73 78 A I E -de 50 95B 0 21,-2.8 23,-1.9 -2,-0.4 2,-0.4 -0.951 15.9-175.6-113.3 115.7 0.7 -30.2 -78.7 74 79 A S E -de 51 96B 0 -24,-2.8 -22,-2.6 -2,-0.6 2,-0.4 -0.904 3.7-165.1-113.7 141.1 0.1 -26.5 -78.3 75 80 A T E -d 52 0B 0 21,-0.8 2,-2.9 -2,-0.4 23,-0.5 -0.982 28.2-127.3-132.3 130.7 -2.1 -24.8 -75.7 76 81 A X S S+ 0 0 0 -24,-1.4 -22,-0.3 -2,-0.4 2,-0.3 -0.419 85.9 69.9 -71.1 74.9 -3.5 -21.3 -75.4 77 82 A S S S- 0 0 4 -2,-2.9 21,-1.8 223,-0.2 -2,-0.2 -0.921 76.3-129.0-180.0 157.6 -2.2 -21.0 -71.8 78 83 A V S S+ 0 0 52 -2,-0.3 2,-0.1 20,-0.2 -1,-0.1 0.817 89.8 80.6 -85.9 -33.9 1.0 -20.6 -69.7 79 84 A G + 0 0 10 1,-0.1 19,-0.1 19,-0.1 3,-0.0 -0.437 51.1 177.8 -73.7 147.1 -0.0 -23.5 -67.4 80 85 A I > + 0 0 41 -2,-0.1 3,-2.2 3,-0.1 5,-0.2 0.282 46.3 111.6-133.3 9.2 0.6 -27.1 -68.6 81 86 A D T 3 S+ 0 0 76 1,-0.3 -1,-0.1 3,-0.1 -2,-0.0 0.530 70.6 72.4 -64.5 -2.8 -0.6 -29.3 -65.8 82 87 A H T 3 S+ 0 0 12 -25,-0.1 -24,-2.2 2,-0.0 -1,-0.3 0.401 88.0 81.5 -90.5 2.4 -3.4 -30.4 -68.1 83 88 A L B < S-g 58 0C 16 -3,-2.2 2,-1.1 -26,-0.2 -24,-0.2 -0.765 80.1-130.3-109.3 154.5 -0.9 -32.4 -70.1 84 89 A A > + 0 0 26 -26,-1.8 4,-2.1 -2,-0.3 5,-0.2 -0.638 34.7 177.1-100.3 70.9 0.7 -35.8 -69.6 85 90 A L H > S+ 0 0 72 -2,-1.1 4,-3.4 -5,-0.2 5,-0.2 0.827 70.0 53.8 -42.6 -51.1 4.2 -34.6 -70.1 86 91 A D H > S+ 0 0 132 2,-0.2 4,-3.2 1,-0.2 5,-0.3 0.973 111.5 42.8 -54.2 -63.1 6.0 -37.9 -69.4 87 92 A E H > S+ 0 0 58 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.851 116.4 53.7 -51.0 -34.6 4.0 -40.0 -71.9 88 93 A I H <>S+ 0 0 2 -4,-2.1 5,-3.5 2,-0.2 4,-0.4 0.923 112.1 40.6 -67.2 -47.0 4.5 -37.0 -74.2 89 94 A K H ><5S+ 0 0 161 -4,-3.4 3,-2.0 3,-0.2 -2,-0.2 0.950 109.2 58.9 -67.1 -49.5 8.3 -36.9 -73.8 90 95 A K H 3<5S+ 0 0 175 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.786 111.8 42.8 -49.9 -31.2 8.7 -40.7 -73.9 91 96 A R T 3<5S- 0 0 92 -4,-1.0 -1,-0.3 -5,-0.3 -2,-0.2 0.553 118.2-117.4 -91.6 -10.9 7.1 -40.5 -77.4 92 97 A G T < 5 + 0 0 59 -3,-2.0 2,-0.5 -4,-0.4 -3,-0.2 0.866 53.3 167.0 76.3 38.7 9.2 -37.4 -78.2 93 98 A I < - 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0 0 41 -2,-0.7 2,-0.3 1,-0.4 -1,-0.2 0.630 64.7 -34.2-115.3 -25.8 -30.4 3.8 -46.9 135 140 A S S S- 0 0 10 474,-0.1 -1,-0.4 220,-0.0 2,-0.3 -0.942 83.2 -53.6-173.1-171.0 -27.7 6.5 -46.5 136 141 A W - 0 0 11 -2,-0.3 474,-0.1 455,-0.1 475,-0.1 -0.642 58.9-162.0 -78.6 147.4 -24.0 6.9 -46.1 137 142 A K - 0 0 23 473,-0.3 3,-0.4 -2,-0.3 195,-0.1 -0.951 23.6-157.0-142.3 121.7 -22.9 4.9 -43.0 138 143 A P S S+ 0 0 6 0, 0.0 -1,-0.1 0, 0.0 485,-0.1 0.727 98.9 33.7 -63.4 -27.3 -19.7 5.2 -40.9 139 144 A L S S+ 0 0 82 192,-0.2 3,-0.5 215,-0.1 2,-0.3 0.477 98.8 100.2-108.6 -6.3 -19.9 1.6 -39.6 140 145 A W S S- 0 0 54 -3,-0.4 -3,-0.2 1,-0.2 0, 0.0 -0.637 89.6 -5.3 -92.4 139.3 -21.4 -0.2 -42.6 141 146 A L S S+ 0 0 6 -2,-0.3 2,-0.3 1,-0.2 -1,-0.2 0.812 84.5 158.0 52.7 39.4 -19.6 -2.3 -45.3 142 147 A C + 0 0 5 -3,-0.5 473,-0.3 473,-0.1 -1,-0.2 -0.704 11.7 169.9 -93.4 143.0 -16.2 -1.5 -43.9 143 148 A G B -h 615 0D 4 471,-3.3 473,-1.8 -2,-0.3 2,-0.4 -0.459 35.4 -72.9-130.5-156.3 -13.2 -3.8 -44.7 144 149 A Y - 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0 0 39 -31,-0.2 3,-0.6 25,-0.1 -1,-0.3 -0.903 45.9-111.9-140.9 167.5 25.7 -13.9 -22.7 1207 246 D G G > S+ 0 0 5 25,-0.5 3,-1.8 -2,-0.3 26,-0.3 0.906 108.0 58.8 -72.0 -43.4 23.5 -12.5 -20.0 1208 247 D D G 3 S+ 0 0 92 1,-0.3 -1,-0.2 24,-0.2 -25,-0.0 0.518 88.4 76.4 -67.3 -4.4 22.0 -9.5 -21.7 1209 248 D V G < S+ 0 0 0 -3,-0.6 -22,-0.4 -25,-0.3 2,-0.3 0.801 96.1 57.9 -72.7 -27.7 20.5 -11.8 -24.4 1210 249 D V S < S- 0 0 9 -3,-1.8 2,-1.0 -4,-0.3 -22,-0.2 -0.787 81.1-132.6-108.1 145.7 17.9 -12.7 -21.9 1211 250 D N > - 0 0 59 -24,-2.1 4,-1.6 -2,-0.3 5,-0.2 -0.838 22.3-165.5 -96.4 99.6 15.4 -10.5 -20.0 1212 251 D Q H >> S+ 0 0 17 -2,-1.0 3,-1.1 2,-0.2 4,-0.9 0.953 86.0 43.7 -49.0 -65.2 15.9 -11.8 -16.4 1213 252 D D H >> S+ 0 0 126 1,-0.3 4,-1.4 2,-0.2 3,-1.2 0.894 115.4 50.0 -50.0 -45.3 12.7 -10.2 -14.9 1214 253 D D H 3> S+ 0 0 55 1,-0.3 4,-1.3 2,-0.2 -1,-0.3 0.754 106.0 57.4 -66.6 -23.4 10.8 -11.2 -18.0 1215 254 D L H S+ 0 0 119 -4,-1.4 4,-2.3 1,-0.3 5,-0.6 0.911 112.9 53.8 -43.3 -50.2 7.1 -14.2 -14.8 1218 257 D A H X>S+ 0 0 6 -4,-1.3 5,-2.3 1,-0.3 4,-1.5 0.920 114.7 39.4 -51.3 -47.1 7.5 -16.9 -17.5 1219 258 D L H <5S+ 0 0 8 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.3 0.679 116.0 57.2 -77.5 -16.8 8.9 -19.2 -14.8 1220 259 D A H <5S+ 0 0 51 -4,-2.4 -2,-0.2 -3,-0.3 -3,-0.2 0.985 116.7 26.5 -74.8 -72.8 6.3 -17.9 -12.4 1221 260 D S H <5S- 0 0 64 -4,-2.3 -3,-0.2 1,-0.1 -2,-0.2 0.868 114.6-111.1 -59.3 -39.7 3.0 -18.6 -14.2 1222 261 D G T << + 0 0 30 -4,-1.5 -3,-0.2 -5,-0.6 -4,-0.1 0.825 60.4 153.3 106.8 51.8 4.6 -21.5 -16.1 1223 262 D K S - 0 0 62 0, 0.0 3,-2.2 0, 0.0 2,-1.2 0.023 29.5-118.1 -33.0 127.9 23.6 -11.4 -6.4 1239 278 D T T 3 S+ 0 0 81 1,-0.3 -466,-0.0 -466,-0.1 -467,-0.0 0.156 109.2 70.7 -63.3 25.8 22.2 -14.3 -4.4 1240 279 D N T 3 + 0 0 117 -2,-1.2 -1,-0.3 5,-0.0 5,-0.1 0.307 56.1 132.9-123.2 3.5 18.9 -12.4 -4.5 1241 280 D H X - 0 0 17 -3,-2.2 3,-5.1 -4,-0.2 4,-0.3 -0.469 64.3-129.3 -61.7 109.8 18.0 -12.8 -8.2 1242 281 D P G > S+ 0 0 63 0, 0.0 3,-1.7 0, 0.0 4,-0.3 0.707 107.1 68.2 -29.4 -35.7 14.3 -13.8 -7.8 1243 282 D L G > S+ 0 0 0 1,-0.3 3,-0.8 2,-0.2 6,-0.2 0.713 86.8 66.9 -63.1 -21.7 15.2 -16.7 -10.1 1244 283 D L G < S+ 0 0 27 -3,-5.1 -1,-0.3 1,-0.2 -3,-0.1 0.595 96.9 53.4 -76.4 -12.0 17.3 -18.2 -7.4 1245 284 D T G < S+ 0 0 107 -3,-1.7 2,-0.6 -4,-0.3 -1,-0.2 0.486 89.4 94.9 -97.8 -5.9 14.3 -18.8 -5.2 1246 285 D L X - 0 0 29 -3,-0.8 3,-1.2 -4,-0.3 -26,-0.0 -0.774 68.1-149.5 -90.1 121.5 12.6 -20.7 -8.1 1247 286 D K T 3 S+ 0 0 168 -2,-0.6 -158,-0.2 1,-0.3 -1,-0.1 0.444 94.0 56.2 -70.4 3.1 13.1 -24.5 -7.9 1248 287 D N T 3 S+ 0 0 42 -5,-0.1 -21,-1.6 1,-0.1 2,-0.3 -0.071 86.6 83.5-125.3 34.9 13.0 -24.7 -11.7 1249 288 D C E < -b 1227 0S 13 -3,-1.2 2,-0.2 -23,-0.2 -21,-0.2 -0.776 59.3-165.6-139.6 92.1 15.7 -22.3 -12.7 1250 289 D V E -b 1228 0S 14 -23,-2.0 -21,-2.6 -2,-0.3 2,-0.4 -0.562 6.4-170.2 -78.6 138.5 19.2 -23.7 -12.7 1251 290 D I E -b 1229 0S 5 -2,-0.2 -479,-0.2 -23,-0.2 -21,-0.2 -0.978 5.2-167.1-136.0 123.8 22.1 -21.3 -12.8 1252 291 D L - 0 0 0 -23,-3.4 2,-1.3 -2,-0.4 -483,-0.1 -0.770 32.0-116.7-106.2 154.1 25.8 -22.0 -13.3 1253 292 D P - 0 0 1 0, 0.0 -22,-0.1 0, 0.0 -23,-0.1 -0.317 68.5 -79.7 -85.2 51.1 28.7 -19.6 -12.8 1254 293 D H S S+ 0 0 17 -2,-1.3 3,-0.2 -24,-0.8 -473,-0.2 0.947 76.6 153.5 53.3 61.8 29.8 -19.6 -16.5 1255 294 D I > + 0 0 3 1,-0.2 3,-1.8 2,-0.1 -1,-0.1 0.021 21.2 127.7-108.4 27.2 31.7 -22.9 -16.5 1256 295 D G T 3 S+ 0 0 6 1,-0.3 -181,-0.4 -26,-0.2 -1,-0.2 0.903 81.3 32.8 -47.6 -55.8 31.3 -23.7 -20.2 1257 296 D S T 3 S+ 0 0 9 -3,-0.2 2,-1.8 1,-0.1 6,-0.6 0.164 87.0 134.3 -91.6 21.6 34.9 -24.3 -21.0 1258 297 D A < + 0 0 0 -3,-1.8 -471,-1.7 -187,-0.1 2,-0.3 -0.399 26.5 109.3 -77.6 67.3 35.6 -25.7 -17.5 1259 298 D T B > S-i 787 0M 7 -2,-1.8 4,-1.7 -473,-0.3 5,-0.4 -0.958 71.9-118.3-131.1 153.1 37.7 -28.8 -18.0 1260 299 D H H > S+ 0 0 72 -473,-1.9 4,-1.8 -2,-0.3 5,-0.2 0.936 111.8 45.4 -55.0 -53.5 41.4 -29.2 -17.1 1261 300 D R H > S+ 0 0 205 2,-0.2 4,-2.7 3,-0.2 -1,-0.2 0.923 114.5 48.7 -58.0 -49.0 42.6 -30.0 -20.7 1262 301 D T H >> S+ 0 0 9 2,-0.2 4,-3.3 1,-0.2 3,-0.5 0.986 111.4 44.4 -56.3 -71.8 40.6 -27.2 -22.3 1263 302 D R H 3X S+ 0 0 4 -4,-1.7 4,-2.7 -6,-0.6 -1,-0.2 0.842 114.4 54.1 -43.0 -39.1 41.5 -24.2 -20.0 1264 303 D N H 3X S+ 0 0 47 -4,-1.8 4,-2.4 -5,-0.4 -1,-0.3 0.961 112.1 42.2 -61.2 -49.6 45.0 -25.5 -20.3 1265 304 D T H X>S+ 0 0 8 -4,-2.4 5,-1.2 -5,-0.4 4,-0.8 0.944 115.5 35.4 -64.1 -46.6 52.2 -14.8 -32.3 1277 316 D G H 3<5S+ 0 0 0 -4,-5.1 -2,-0.2 1,-0.2 -1,-0.2 0.583 119.5 53.7 -81.9 -9.7 50.9 -11.3 -32.4 1278 317 D L T 3<5S+ 0 0 5 -4,-1.1 -1,-0.2 -5,-0.4 -2,-0.2 -0.193 110.7 42.0-118.0 40.8 53.9 -10.1 -30.5 1279 318 D R T <45S- 0 0 90 -3,-0.7 -2,-0.2 2,-0.2 -3,-0.1 0.369 104.5-109.9-153.3 -23.2 56.7 -11.6 -32.7 1280 319 D G T <5S+ 0 0 59 -4,-0.8 -3,-0.1 1,-0.3 -4,-0.1 0.822 78.5 111.5 86.7 34.2 55.6 -11.0 -36.3 1281 320 D E S - 0 0 22 1,-0.2 3,-1.0 -7,-0.1 -10,-0.1 -0.822 2.9-143.0 -96.2 111.4 49.2 -16.4 -35.2 1284 323 D P T 3 S+ 0 0 82 0, 0.0 -1,-0.2 0, 0.0 2,-0.1 0.807 97.3 4.6 -36.2 -43.2 47.6 -19.8 -34.3 1285 324 D S T 3 S+ 0 0 10 -16,-0.2 -222,-3.5 -3,-0.1 2,-0.6 -0.514 77.5 170.1-150.8 76.6 44.4 -17.9 -33.8 1286 325 D E < 0 0 89 -3,-1.0 -224,-0.3 -224,-0.3 -246,-0.1 -0.790 360.0 360.0 -91.8 120.4 44.4 -14.2 -34.7 1287 326 D L 0 0 93 -2,-0.6 -1,-0.2 0, 0.0 -225,-0.1 0.888 360.0 360.0 -61.5 360.0 41.0 -12.5 -34.7