==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 07-APR-11 3RFV . COMPND 2 MOLECULE: URONATE DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: AGROBACTERIUM TUMEFACIENS; . AUTHOR T.PARKKINEN,J.ROUVINEN . 795 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32075.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 547 68.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 117 14.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.8 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 . 66 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 103 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 205 25.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.5 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 5 1 0 2 6 3 0 0 3 3 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 0 0 9 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 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 0 0 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 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 2 A A 0 0 110 0, 0.0 25,-0.2 0, 0.0 24,-0.1 0.000 360.0 360.0 360.0-107.9 49.4 50.7 6.4 2 3 A M E -a 26 0A 37 23,-1.1 25,-2.1 1,-0.1 26,-0.3 -0.232 360.0-124.0 -71.4 163.2 51.3 48.3 4.2 3 4 A K E S+ 0 0 108 1,-0.3 25,-2.8 23,-0.2 2,-0.4 0.958 87.5 14.7 -76.3 -51.1 50.4 44.7 4.0 4 5 A R E -a 28 0A 26 23,-0.2 61,-2.9 22,-0.1 62,-0.8 -0.954 59.8-171.8-135.8 116.6 53.7 42.9 4.9 5 6 A L E -ab 29 66A 0 23,-2.3 25,-2.9 -2,-0.4 2,-0.5 -0.913 16.1-146.6-104.2 126.3 56.8 44.4 6.5 6 7 A L E -ab 30 67A 0 60,-2.9 62,-2.9 -2,-0.5 2,-0.5 -0.798 11.5-170.9 -89.7 131.8 59.9 42.3 6.7 7 8 A V E -ab 31 68A 0 23,-2.9 25,-2.4 -2,-0.5 3,-0.5 -0.957 9.3-163.8-117.8 110.3 62.2 42.7 9.8 8 9 A T E S+ b 0 69A 2 60,-2.0 62,-0.5 -2,-0.5 25,-0.2 -0.427 73.3 34.2 -83.8 169.2 65.5 40.8 9.4 9 10 A G S > S+ 0 0 12 61,-0.2 3,-1.8 23,-0.2 6,-0.5 0.819 75.6 157.5 55.6 32.9 67.7 40.1 12.4 10 11 A A T 3 + 0 0 1 22,-3.0 23,-0.2 -3,-0.5 9,-0.2 0.579 62.2 56.9 -72.2 -8.9 64.5 39.8 14.3 11 12 A A T 3 S+ 0 0 22 21,-0.3 -1,-0.3 4,-0.1 22,-0.1 0.545 94.8 86.3 -94.0 -8.5 66.0 37.7 17.1 12 13 A G S <> S- 0 0 28 -3,-1.8 4,-2.6 23,-0.1 5,-0.2 -0.109 97.7 -84.5 -85.6-175.2 68.7 40.3 17.9 13 14 A Q H > S+ 0 0 158 1,-0.2 4,-1.2 2,-0.2 -1,-0.0 0.946 127.5 31.9 -56.5 -60.1 68.7 43.3 20.2 14 15 A L H > S+ 0 0 37 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.859 116.0 61.6 -68.7 -35.4 67.1 45.9 17.9 15 16 A G H > S+ 0 0 1 -6,-0.5 4,-2.6 1,-0.2 -2,-0.2 0.914 102.3 48.8 -55.1 -48.6 65.1 43.2 16.1 16 17 A R H X S+ 0 0 146 -4,-2.6 4,-1.1 1,-0.2 -1,-0.2 0.867 112.1 50.9 -63.4 -35.1 63.2 42.2 19.3 17 18 A V H X S+ 0 0 28 -4,-1.2 4,-3.0 -5,-0.2 -2,-0.2 0.928 113.1 43.9 -64.1 -45.8 62.5 45.9 19.9 18 19 A M H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 5,-0.3 0.815 101.6 66.6 -74.4 -30.6 61.2 46.4 16.3 19 20 A R H < S+ 0 0 33 -4,-2.6 -1,-0.2 -5,-0.2 4,-0.2 0.930 116.0 31.0 -52.8 -43.4 59.1 43.2 16.4 20 21 A E H >< S+ 0 0 144 -4,-1.1 3,-0.8 -3,-0.2 -2,-0.2 0.939 123.8 45.1 -77.4 -51.3 57.1 45.0 19.0 21 22 A R H 3< S+ 0 0 73 -4,-3.0 -3,-0.2 1,-0.2 -2,-0.2 0.796 113.8 46.0 -70.0 -31.4 57.4 48.7 17.9 22 23 A L T >< S+ 0 0 0 -4,-2.8 3,-1.9 1,-0.2 4,-0.5 0.455 81.1 100.3 -93.4 -0.9 56.8 48.3 14.2 23 24 A A G X S+ 0 0 45 -3,-0.8 3,-1.4 1,-0.3 -1,-0.2 0.902 78.4 55.7 -50.9 -46.7 53.8 46.0 14.5 24 25 A P G 3 S+ 0 0 109 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.627 94.7 70.4 -64.6 -12.5 51.3 48.9 13.9 25 26 A M G < S+ 0 0 19 -3,-1.9 -23,-1.1 -24,-0.1 2,-0.3 0.723 105.0 29.0 -78.1 -21.6 53.0 49.8 10.6 26 27 A A E < -a 2 0A 11 -3,-1.4 -23,-0.2 -4,-0.5 3,-0.1 -0.964 67.6-129.0-141.0 154.2 51.8 46.7 8.7 27 28 A E E S+ 0 0 120 -25,-2.1 2,-0.4 -2,-0.3 -23,-0.2 0.905 105.3 29.1 -65.7 -40.5 48.9 44.2 8.6 28 29 A I E S-a 4 0A 31 -25,-2.8 -23,-2.3 -26,-0.3 2,-0.6 -0.981 70.7-158.2-124.2 132.1 51.5 41.4 8.7 29 30 A L E -ac 5 44A 4 14,-2.3 16,-2.3 -2,-0.4 2,-0.6 -0.943 8.5-161.2-105.8 121.4 54.9 41.5 10.3 30 31 A R E -ac 6 45A 27 -25,-2.9 -23,-2.9 -2,-0.6 2,-0.4 -0.924 7.5-163.5-104.7 118.5 57.3 38.9 9.0 31 32 A L E -ac 7 46A 0 14,-3.0 16,-2.8 -2,-0.6 2,-0.3 -0.812 10.1-179.1-101.9 138.2 60.3 38.3 11.3 32 33 A A E + c 0 47A 1 -25,-2.4 -22,-3.0 -2,-0.4 -21,-0.3 -0.982 11.8 144.3-138.7 151.5 63.4 36.6 10.1 33 34 A D E - c 0 48A 28 14,-1.5 16,-1.5 -2,-0.3 4,-0.1 -0.946 53.3-118.9-172.8 156.9 66.7 35.5 11.5 34 35 A L S S+ 0 0 101 -2,-0.3 16,-0.1 14,-0.2 -1,-0.1 0.766 101.5 71.3 -71.8 -25.9 69.3 32.8 11.3 35 36 A S S S- 0 0 61 1,-0.1 14,-0.1 14,-0.1 -2,-0.1 -0.491 103.4 -84.9 -87.7 158.5 68.5 32.2 15.0 36 37 A P - 0 0 102 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.335 45.3-146.6 -60.3 143.6 65.3 30.7 16.4 37 38 A L - 0 0 34 -4,-0.1 3,-0.1 -6,-0.1 -26,-0.1 -0.863 26.1 -96.3-111.7 147.1 62.4 33.2 16.9 38 39 A D - 0 0 119 -2,-0.3 3,-0.2 1,-0.1 -1,-0.0 -0.424 67.8 -83.1 -52.8 134.9 59.7 33.2 19.5 39 40 A P - 0 0 111 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 0.014 54.7 -88.6 -47.9 147.2 56.7 31.6 17.7 40 41 A A - 0 0 51 -3,-0.1 3,-0.1 6,-0.1 6,-0.1 -0.372 42.8-159.7 -61.3 127.5 54.6 33.7 15.4 41 42 A G > - 0 0 29 1,-0.2 3,-1.6 -3,-0.2 -1,-0.1 -0.256 47.6 -51.8 -87.7-172.7 51.7 35.4 17.2 42 43 A P T 3 S+ 0 0 121 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.357 131.2 17.4 -60.6 143.3 48.6 36.7 15.4 43 44 A N T 3 S+ 0 0 125 1,-0.2 -14,-2.3 -3,-0.1 2,-0.3 0.708 109.3 106.0 65.9 20.4 49.5 39.0 12.5 44 45 A E E < -c 29 0A 45 -3,-1.6 2,-0.4 -16,-0.2 -14,-0.2 -0.967 48.7-167.6-126.6 147.4 53.1 37.6 12.5 45 46 A E E -c 30 0A 54 -16,-2.3 -14,-3.0 -2,-0.3 2,-0.4 -0.984 14.5-154.5-122.8 141.9 55.0 35.2 10.2 46 47 A C E -c 31 0A 47 -2,-0.4 2,-0.4 -16,-0.2 -14,-0.2 -0.969 10.2-173.1-122.2 135.2 58.4 33.9 11.4 47 48 A V E -c 32 0A 41 -16,-2.8 -14,-1.5 -2,-0.4 2,-0.6 -0.972 14.5-154.7-129.7 135.8 61.2 32.7 9.1 48 49 A Q E +c 33 0A 130 -2,-0.4 2,-0.3 -16,-0.2 -14,-0.2 -0.946 37.7 138.5-107.6 117.4 64.5 31.0 9.8 49 50 A C - 0 0 12 -16,-1.5 2,-0.5 -2,-0.6 -14,-0.1 -0.973 51.3-119.6-160.2 147.3 67.1 31.6 7.1 50 51 A D > - 0 0 60 -2,-0.3 3,-2.6 1,-0.1 7,-0.3 -0.743 21.4-140.4 -83.3 124.7 70.7 32.3 6.6 51 52 A L T 3 S+ 0 0 19 -2,-0.5 41,-0.2 1,-0.3 -1,-0.1 0.726 103.6 64.8 -55.0 -20.5 71.2 35.6 4.7 52 53 A A T 3 S+ 0 0 22 1,-0.1 2,-0.9 40,-0.1 -1,-0.3 0.576 82.0 87.5 -80.8 -9.3 74.0 33.8 2.9 53 54 A D <> - 0 0 78 -3,-2.6 4,-2.9 1,-0.2 5,-0.2 -0.797 63.9-163.8 -96.8 100.6 71.4 31.4 1.3 54 55 A A H > S+ 0 0 51 -2,-0.9 4,-2.8 1,-0.2 -1,-0.2 0.882 86.8 45.6 -54.6 -48.9 70.2 33.1 -1.9 55 56 A N H > S+ 0 0 135 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.910 113.3 49.3 -62.7 -44.5 67.1 31.0 -2.4 56 57 A A H > S+ 0 0 28 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.924 111.7 50.0 -61.3 -43.3 66.1 31.3 1.3 57 58 A V H X S+ 0 0 0 -4,-2.9 4,-2.3 -7,-0.3 5,-0.3 0.938 107.6 53.8 -60.4 -46.0 66.5 35.0 1.1 58 59 A N H X S+ 0 0 59 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.950 112.7 43.5 -50.9 -51.1 64.4 35.2 -2.1 59 60 A A H < S+ 0 0 64 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.859 110.0 57.2 -65.4 -35.1 61.6 33.4 -0.3 60 61 A M H < S+ 0 0 5 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.902 115.1 36.8 -60.4 -40.3 62.1 35.5 2.8 61 62 A V H >< S+ 0 0 0 -4,-2.3 3,-2.3 -5,-0.1 -2,-0.2 0.830 88.5 107.8 -85.0 -35.0 61.5 38.7 0.8 62 63 A A T 3< S+ 0 0 28 -4,-2.5 3,-0.1 1,-0.3 35,-0.1 -0.177 87.5 18.8 -49.6 127.1 58.8 37.6 -1.6 63 64 A G T 3 S+ 0 0 44 1,-0.3 2,-0.4 37,-0.2 -1,-0.3 0.431 94.7 124.8 91.3 -0.1 55.5 39.1 -0.7 64 65 A C < - 0 0 5 -3,-2.3 -1,-0.3 1,-0.1 -59,-0.2 -0.789 45.4-163.3 -99.6 139.3 56.9 41.9 1.5 65 66 A D S S+ 0 0 80 -61,-2.9 39,-0.7 -2,-0.4 2,-0.3 0.452 77.2 12.7 -93.5 -5.7 56.1 45.6 0.8 66 67 A G E -bd 5 104A 0 -62,-0.8 -60,-2.9 37,-0.2 2,-0.4 -0.974 63.4-145.8-166.6 154.1 59.0 46.9 2.9 67 68 A I E -bd 6 105A 0 37,-2.6 39,-3.2 -2,-0.3 2,-0.7 -0.987 8.4-168.6-134.3 126.9 62.2 45.8 4.6 68 69 A V E -bd 7 106A 0 -62,-2.9 -60,-2.0 -2,-0.4 2,-1.2 -0.942 24.8-155.7-104.0 105.0 63.9 46.8 7.8 69 70 A H E +bd 8 107A 1 37,-2.9 39,-2.0 -2,-0.7 -60,-0.1 -0.688 39.8 141.0 -92.5 93.8 67.2 45.1 7.4 70 71 A L + 0 0 27 -2,-1.2 -61,-0.2 -62,-0.5 -1,-0.2 0.533 39.5 110.2-103.2 -13.5 68.8 44.6 10.9 71 72 A G + 0 0 4 -3,-0.2 2,-0.3 -59,-0.0 37,-0.1 -0.381 47.9 63.7 -72.9 141.2 70.2 41.1 10.2 72 73 A G S S- 0 0 35 -2,-0.1 2,-0.4 17,-0.0 14,-0.1 -0.869 92.2 -33.0 143.4-175.8 73.9 40.5 10.0 73 74 A I - 0 0 32 -2,-0.3 4,-0.1 9,-0.2 3,-0.0 -0.660 50.5-171.8 -76.3 128.8 77.1 40.6 12.0 74 75 A S + 0 0 84 -2,-0.4 2,-0.3 2,-0.1 -1,-0.1 0.471 60.1 34.5-106.4 -5.6 76.8 43.5 14.4 75 76 A V S S- 0 0 60 60,-0.0 2,-0.2 182,-0.0 182,-0.0 -0.860 102.2 -64.9-139.2 174.6 80.3 43.8 15.9 76 77 A E + 0 0 10 -2,-0.3 -2,-0.1 58,-0.1 3,-0.0 -0.445 67.3 153.8 -65.0 130.4 83.9 43.3 14.8 77 78 A K - 0 0 76 -2,-0.2 186,-0.2 186,-0.1 57,-0.1 -0.894 49.5 -61.8-147.9 172.6 84.5 39.6 14.0 78 79 A P >> - 0 0 13 0, 0.0 4,-1.5 0, 0.0 3,-0.8 -0.288 53.8-110.7 -59.8 152.6 86.7 37.4 11.8 79 80 A F H 3> S+ 0 0 97 184,-0.5 4,-3.4 1,-0.2 5,-0.3 0.865 111.5 63.1 -52.5 -45.0 86.3 38.1 8.0 80 81 A E H 3> S+ 0 0 95 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.846 106.6 42.7 -52.6 -42.3 84.6 34.8 7.3 81 82 A Q H <> S+ 0 0 70 -3,-0.8 4,-2.2 2,-0.2 5,-0.3 0.873 115.6 48.3 -73.9 -38.6 81.6 35.6 9.4 82 83 A I H X>S+ 0 0 1 -4,-1.5 4,-2.9 2,-0.2 5,-0.9 0.929 108.1 55.7 -68.8 -43.2 81.3 39.1 8.2 83 84 A L H X>S+ 0 0 50 -4,-3.4 5,-2.8 3,-0.2 4,-0.9 0.910 111.6 45.2 -49.5 -47.4 81.6 38.0 4.6 84 85 A Q H <>S+ 0 0 87 -4,-1.5 5,-1.0 -5,-0.3 -2,-0.2 0.950 123.6 28.8 -65.8 -52.7 78.7 35.7 5.1 85 86 A G H <5S+ 0 0 10 -4,-2.2 -2,-0.2 3,-0.2 -3,-0.2 0.813 132.3 27.3 -82.8 -30.5 76.2 37.9 6.9 86 87 A N H <5S+ 0 0 3 -4,-2.9 -3,-0.2 -5,-0.3 -2,-0.1 0.601 128.9 27.8-114.9 -18.8 77.1 41.4 5.6 87 88 A I T X S+ 0 0 3 -3,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.904 108.7 51.6 -70.2 -43.1 73.7 42.0 1.3 91 92 A Y H X S+ 0 0 114 -4,-2.1 4,-2.5 1,-0.2 5,-0.2 0.934 111.0 48.7 -57.3 -45.6 74.0 40.9 -2.3 92 93 A N H X S+ 0 0 14 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.883 110.0 51.4 -63.9 -40.6 71.3 38.2 -1.7 93 94 A L H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.925 112.5 45.0 -60.9 -46.2 69.0 40.7 -0.1 94 95 A Y H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.884 113.7 48.9 -69.9 -38.4 69.2 43.2 -3.0 95 96 A E H X S+ 0 0 46 -4,-2.5 4,-1.8 -5,-0.2 -1,-0.2 0.932 111.8 51.1 -60.7 -43.8 68.8 40.5 -5.6 96 97 A A H X S+ 0 0 3 -4,-2.4 4,-0.7 -5,-0.2 -2,-0.2 0.912 111.8 45.6 -62.4 -44.5 65.8 39.2 -3.7 97 98 A A H ><>S+ 0 0 0 -4,-2.4 5,-3.0 1,-0.2 3,-0.8 0.895 109.9 55.1 -62.7 -41.8 64.2 42.7 -3.5 98 99 A R H ><5S+ 0 0 100 -4,-2.2 3,-0.5 1,-0.3 -1,-0.2 0.844 109.4 47.8 -63.1 -32.6 65.0 43.3 -7.2 99 100 A A H 3<5S+ 0 0 64 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.624 113.9 48.6 -82.1 -13.7 63.1 40.1 -8.1 100 101 A H T <<5S- 0 0 65 -3,-0.8 -1,-0.2 -4,-0.7 -37,-0.2 -0.178 129.3 -71.8-127.9 44.6 60.1 41.0 -5.9 101 102 A G T < 5 - 0 0 74 -3,-0.5 -3,-0.2 1,-0.2 -4,-0.1 0.536 69.6 -93.5 88.6 6.2 59.0 44.5 -6.7 102 103 A Q < - 0 0 59 -5,-3.0 54,-0.4 -6,-0.2 -1,-0.2 0.928 48.5-153.2 52.8 55.5 61.9 46.4 -5.0 103 104 A P - 0 0 9 0, 0.0 -37,-0.2 0, 0.0 -1,-0.1 -0.312 30.6 -93.7 -56.7 140.9 60.3 46.9 -1.6 104 105 A R E -d 66 0A 35 -39,-0.7 -37,-2.6 88,-0.1 2,-0.4 -0.319 45.6-144.6 -59.1 138.3 61.8 50.0 0.1 105 106 A I E -de 67 157A 0 51,-2.1 53,-2.7 -39,-0.2 2,-0.7 -0.893 18.8-160.5-114.9 131.9 64.7 49.2 2.4 106 107 A V E -de 68 158A 1 -39,-3.2 -37,-2.9 -2,-0.4 2,-0.6 -0.951 25.5-158.4 -99.5 110.2 65.8 50.6 5.7 107 108 A F E -de 69 159A 1 51,-2.6 53,-2.1 -2,-0.7 2,-1.6 -0.827 14.3-136.9 -93.9 121.9 69.4 49.5 5.9 108 109 A A E + e 0 160A 8 -39,-2.0 53,-0.2 -2,-0.6 51,-0.1 -0.635 38.9 166.7 -71.9 89.4 71.0 49.4 9.4 109 110 A S E - e 0 161A 2 51,-1.9 53,-1.0 -2,-1.6 2,-0.3 -0.110 25.2-122.3 -84.0-160.1 74.4 50.8 8.5 110 111 A S E > - e 0 162A 4 51,-0.3 3,-1.9 26,-0.1 4,-0.2 -0.999 18.9-124.1-151.6 148.9 76.7 52.0 11.2 111 112 A N G > S+ 0 0 2 51,-2.2 3,-2.6 -2,-0.3 52,-0.1 0.777 105.3 79.1 -54.9 -26.6 78.7 54.9 12.7 112 113 A H G > S+ 0 0 13 1,-0.3 20,-1.8 50,-0.3 3,-0.8 0.620 72.9 75.2 -66.4 -8.2 81.6 52.5 12.3 113 114 A T G < S+ 0 0 0 -3,-1.9 17,-2.1 1,-0.2 -1,-0.3 0.741 113.2 25.9 -65.5 -24.1 81.7 53.4 8.6 114 115 A I G X S+ 0 0 0 -3,-2.6 3,-1.8 15,-0.2 139,-0.3 -0.030 85.2 130.4-126.7 27.8 83.3 56.7 9.8 115 116 A G T < + 0 0 0 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-0.172 39.3-158.4 -57.4 151.4 61.6 72.7 4.5 478 213 B W + 0 0 5 -36,-0.4 -89,-2.6 -259,-0.1 2,-0.3 0.410 62.5 80.6-108.3 -6.6 64.1 72.6 1.6 479 214 B W B -q 389 0G 20 -91,-0.2 2,-0.6 -37,-0.2 -89,-0.2 -0.838 64.4-140.2-121.2 148.5 65.7 76.0 2.0 480 215 B D + 0 0 40 -91,-2.7 3,-0.3 -2,-0.3 -11,-0.0 -0.900 21.7 169.0-111.4 109.0 68.4 77.5 4.3 481 216 B N > + 0 0 41 -2,-0.6 3,-2.0 1,-0.2 -1,-0.1 0.169 44.2 114.5 -96.7 13.1 67.8 81.0 5.6 482 217 B S G > + 0 0 72 1,-0.3 3,-1.8 2,-0.2 -1,-0.2 0.846 68.6 60.2 -59.6 -34.3 70.7 80.9 8.1 483 218 B H G 3 S+ 0 0 149 1,-0.3 3,-0.4 -3,-0.3 -1,-0.3 0.640 94.6 65.4 -70.7 -9.6 72.6 83.6 6.3 484 219 B L G X + 0 0 14 -3,-2.0 3,-2.4 1,-0.2 4,-0.4 0.330 67.5 115.7 -88.4 6.4 69.7 86.0 6.9 485 220 B G G X + 0 0 45 -3,-1.8 3,-2.1 1,-0.3 -1,-0.2 0.784 59.0 70.3 -48.8 -37.0 70.3 85.8 10.6 486 221 B F G 3 S+ 0 0 125 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.729 89.9 63.8 -55.7 -23.5 71.3 89.5 11.0 487 222 B L G < S- 0 0 8 -3,-2.4 -1,-0.3 2,-0.1 -2,-0.2 0.740 99.2-137.3 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2,-0.0 -20,-0.1 0.584 54.1 86.4-119.0 -17.9 95.8 79.4 -26.3 759 228 C D - 0 0 50 -47,-0.1 -20,-1.9 -19,-0.0 2,-0.4 -0.470 56.8-156.9 -86.3 163.1 96.3 83.1 -26.4 760 229 C N > - 0 0 54 -22,-0.2 3,-1.2 -2,-0.1 -20,-0.2 -0.943 15.7-157.0-146.7 114.0 97.5 85.2 -23.5 761 230 C A G > S+ 0 0 0 -2,-0.4 3,-3.0 1,-0.2 4,-0.2 0.760 84.7 83.0 -61.2 -23.6 96.9 89.0 -23.0 762 231 C E G > S+ 0 0 51 1,-0.3 3,-2.1 2,-0.2 4,-0.3 0.829 77.4 68.8 -53.6 -33.7 99.9 89.2 -20.7 763 232 C A G < S+ 0 0 89 -3,-1.2 -1,-0.3 1,-0.3 4,-0.3 0.673 97.8 53.0 -58.3 -18.0 102.2 89.4 -23.8 764 233 C F G <> S+ 0 0 51 -3,-3.0 4,-2.6 -4,-0.2 -1,-0.3 0.407 77.8 99.9 -99.0 1.3 100.7 92.9 -24.4 765 234 C R H <> S+ 0 0 66 -3,-2.1 4,-2.9 -4,-0.2 5,-0.2 0.926 83.5 46.2 -56.5 -51.9 101.3 94.4 -21.0 766 235 C R H > S+ 0 0 186 -4,-0.3 4,-2.3 1,-0.2 5,-0.3 0.943 112.4 51.9 -55.7 -49.4 104.5 96.4 -21.9 767 236 C H H > S+ 0 0 84 -4,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.917 112.6 45.1 -52.8 -48.5 102.8 97.7 -25.0 768 237 C I H X S+ 0 0 4 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.890 110.0 54.5 -64.3 -41.8 99.8 98.9 -23.0 769 238 C T H < S+ 0 0 93 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.881 117.0 37.4 -58.7 -39.3 102.0 100.4 -20.3 770 239 C E H < S+ 0 0 143 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.749 119.7 46.7 -84.4 -26.3 103.8 102.5 -22.9 771 240 C T H < S+ 0 0 86 -4,-2.0 -2,-0.2 -5,-0.3 -3,-0.2 0.572 112.5 44.1 -95.8 -13.1 100.8 103.2 -25.1 772 241 C T S < S- 0 0 48 -4,-1.6 -69,-0.1 -5,-0.2 -1,-0.0 -0.923 85.9 -96.7-137.0 157.1 98.3 104.3 -22.5 773 242 C P - 0 0 107 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.503 50.6-100.1 -71.5 138.1 98.1 106.4 -19.3 774 243 C P - 0 0 118 0, 0.0 2,-0.1 0, 0.0 -5,-0.0 -0.325 46.5-107.7 -55.8 137.1 98.4 104.6 -16.0 775 244 C P - 0 0 45 0, 0.0 -3,-0.0 0, 0.0 -72,-0.0 -0.426 24.8-117.0 -70.1 143.7 95.0 103.9 -14.5 776 245 C D > - 0 0 74 1,-0.1 3,-2.9 -2,-0.1 6,-0.3 -0.688 23.0-129.2 -73.9 126.6 93.8 105.9 -11.5 777 246 C P T 3 S+ 0 0 98 0, 0.0 -1,-0.1 0, 0.0 5,-0.0 0.675 109.1 56.3 -53.2 -20.3 93.3 103.4 -8.7 778 247 C N T 3 S+ 0 0 120 3,-0.0 2,-0.3 5,-0.0 5,-0.1 0.497 82.9 113.5 -90.5 -3.5 89.9 104.9 -8.1 779 248 C D S X> S- 0 0 67 -3,-2.9 3,-2.7 1,-0.2 4,-0.7 -0.502 72.0-134.4 -71.5 129.8 88.8 104.3 -11.7 780 249 C A H >> S+ 0 0 6 1,-0.3 4,-2.3 -2,-0.3 3,-1.1 0.833 103.4 75.5 -46.6 -32.8 86.0 101.8 -12.2 781 250 C L H 34 S+ 0 0 41 1,-0.3 -1,-0.3 2,-0.2 7,-0.1 0.768 109.0 25.8 -53.2 -30.2 88.3 100.5 -15.0 782 251 C V H <4 S+ 0 0 34 -3,-2.7 -1,-0.3 -6,-0.3 -2,-0.2 0.301 123.4 52.5-118.0 7.8 90.6 98.9 -12.3 783 252 C R H << S+ 0 0 121 -3,-1.1 -132,-1.2 -4,-0.7 2,-0.4 0.735 104.5 42.6-112.6 -34.6 88.0 98.4 -9.5 784 253 C F B >< S-Y 650 0J 39 -4,-2.3 3,-2.0 -134,-0.2 -1,-0.2 -0.904 70.8-130.5-120.2 146.6 85.0 96.5 -11.0 785 254 C Q T 3 S+ 0 0 0 -136,-2.8 -138,-0.2 -2,-0.4 -137,-0.2 0.832 112.6 53.8 -62.5 -28.0 84.9 93.6 -13.4 786 255 C G T > S- 0 0 1 -139,-2.8 3,-1.8 -137,-0.3 -1,-0.3 0.448 95.0-161.5 -84.5 0.5 82.5 95.5 -15.6 787 256 C G G X - 0 0 1 -3,-2.0 3,-1.5 -7,-0.4 4,-0.3 -0.254 66.1 -2.0 56.2-134.3 84.8 98.5 -15.7 788 257 C T G >> S+ 0 0 81 1,-0.3 3,-1.0 2,-0.2 4,-0.5 0.582 115.1 83.5 -69.7 -11.0 83.2 101.8 -16.7 789 258 C F G X4 S+ 0 0 38 -3,-1.8 3,-1.3 1,-0.2 -1,-0.3 0.844 82.8 62.9 -58.5 -32.0 79.8 100.2 -17.1 790 259 C V G <4 S+ 0 0 9 -3,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.831 100.1 54.2 -62.8 -27.8 79.2 100.5 -13.4 791 260 C D G <4 S+ 0 0 112 -3,-1.0 -1,-0.3 -4,-0.3 -2,-0.2 0.608 84.3 111.9 -80.6 -12.9 79.5 104.3 -13.9 792 261 C N << - 0 0 35 -3,-1.3 2,-0.1 -4,-0.5 -3,-0.0 -0.369 60.2-143.9 -58.6 136.8 76.7 104.2 -16.6 793 262 C P - 0 0 68 0, 0.0 2,-0.8 0, 0.0 -1,-0.1 -0.281 38.1 -81.7 -81.1-179.2 73.5 106.0 -15.5 794 263 C I - 0 0 10 -2,-0.1 2,-0.2 -129,-0.1 -129,-0.0 -0.828 54.0-140.7 -80.5 112.6 70.1 104.6 -16.5 795 264 C F - 0 0 79 -2,-0.8 -184,-0.6 -186,-0.2 2,-0.3 -0.554 14.8-151.3 -76.8 142.4 69.8 106.1 -20.1 796 265 C K 0 0 122 -2,-0.2 -1,-0.0 -186,-0.2 0, 0.0 -0.850 360.0 360.0-116.6 151.1 66.4 107.4 -21.1 797 266 C Q 0 0 148 -2,-0.3 -1,-0.1 -188,-0.1 -2,-0.0 0.977 360.0 360.0 -69.3 360.0 64.8 107.7 -24.6