==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 22-SEP-05 2C1Z . COMPND 2 MOLECULE: UDP-GLUCOSE FLAVONOID 3-O GLYCOSYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: VITIS VINIFERA; . AUTHOR W.OFFEN,C.MARTINEZ-FLEITES,E.KIAT-LIM,M.YANG,B.G.DAVIS, . 439 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19399.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 303 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 55 12.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 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 . 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 . 22 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 155 35.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.6 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 0 3 0 1 3 0 3 0 1 1 3 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 4 2 3 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 . 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 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 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 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 T 0 0 113 0, 0.0 439,-0.3 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 168.9 -8.4 -9.0 59.9 2 7 A N - 0 0 83 1,-0.2 438,-0.1 437,-0.1 31,-0.1 -0.270 360.0 -58.3 -69.0 170.5 -8.3 -6.2 57.3 3 8 A P - 0 0 0 0, 0.0 31,-2.0 0, 0.0 2,-0.4 -0.127 42.3-171.4 -64.2 148.8 -7.6 -7.3 53.7 4 9 A H E -a 34 0A 0 29,-0.2 104,-2.9 102,-0.2 105,-1.1 -0.932 13.9-160.7-134.2 107.0 -4.6 -9.2 52.5 5 10 A V E -ab 35 109A 0 29,-3.1 31,-2.5 -2,-0.4 2,-0.4 -0.824 3.1-153.8 -98.7 116.1 -4.6 -9.4 48.7 6 11 A A E -ab 36 110A 0 103,-2.3 105,-2.8 -2,-0.6 2,-0.5 -0.756 9.4-158.8 -87.0 133.0 -2.4 -12.1 47.2 7 12 A V E -ab 37 111A 1 29,-2.7 31,-3.2 -2,-0.4 2,-0.8 -0.958 3.5-162.3-120.3 115.6 -1.2 -11.3 43.6 8 13 A L E -ab 38 112A 0 103,-2.5 105,-2.6 -2,-0.5 108,-0.2 -0.844 12.6-163.2-105.5 105.7 -0.1 -14.1 41.3 9 14 A A - 0 0 0 29,-2.6 7,-0.1 -2,-0.8 34,-0.0 -0.486 22.5-130.3 -84.4 152.4 1.9 -12.9 38.3 10 15 A F - 0 0 6 -2,-0.2 6,-0.5 2,-0.1 5,-0.3 -0.947 25.1-151.3 -95.3 115.1 2.7 -14.8 35.1 11 16 A P + 0 0 18 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.081 61.3 89.6 -84.7 25.6 6.5 -14.2 35.0 12 17 A F S S- 0 0 43 -2,-0.0 4,-0.2 69,-0.0 -2,-0.1 -0.927 89.5 -24.2-125.8 149.5 7.0 -14.3 31.2 13 18 A S S S- 0 0 61 -2,-0.3 2,-1.2 1,-0.2 3,-0.4 -0.124 117.9 -23.2 45.0-142.0 6.8 -11.5 28.5 14 19 A T S S+ 0 0 50 1,-0.2 -1,-0.2 2,-0.1 326,-0.1 -0.672 108.0 95.6-103.0 78.1 4.8 -8.4 29.4 15 20 A H S > S+ 0 0 17 -2,-1.2 4,-1.3 -5,-0.3 -1,-0.2 0.584 76.3 50.4-125.7 -47.3 2.4 -9.8 32.0 16 21 A A H > S+ 0 0 3 -6,-0.5 4,-2.7 -3,-0.4 5,-0.2 0.902 106.5 56.3 -68.3 -39.1 3.9 -9.0 35.5 17 22 A A H > S+ 0 0 46 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.933 108.2 43.8 -62.9 -51.0 4.6 -5.3 34.8 18 23 A P H > S+ 0 0 12 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.878 114.3 53.0 -60.9 -35.2 1.0 -4.3 33.9 19 24 A L H X S+ 0 0 0 -4,-1.3 4,-2.3 2,-0.2 -2,-0.2 0.920 108.7 48.3 -65.7 -44.7 -0.3 -6.4 36.8 20 25 A L H X S+ 0 0 10 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.904 107.2 58.1 -57.6 -41.2 2.1 -4.5 39.2 21 26 A A H X S+ 0 0 43 -4,-2.4 4,-1.5 1,-0.2 -2,-0.2 0.903 109.3 42.9 -57.0 -40.9 0.8 -1.3 37.7 22 27 A V H X S+ 0 0 0 -4,-1.7 4,-2.8 2,-0.2 -1,-0.2 0.890 111.3 55.2 -70.1 -41.7 -2.8 -2.1 38.7 23 28 A V H X S+ 0 0 2 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.887 104.7 54.1 -59.5 -40.8 -1.7 -3.3 42.1 24 29 A R H X S+ 0 0 64 -4,-2.5 4,-1.6 2,-0.2 -1,-0.2 0.923 110.7 45.5 -57.8 -46.1 0.0 0.1 42.6 25 30 A R H X S+ 0 0 41 -4,-1.5 4,-1.8 1,-0.2 -2,-0.2 0.885 114.0 49.6 -64.3 -40.8 -3.3 1.9 41.8 26 31 A L H X S+ 0 0 1 -4,-2.8 4,-2.0 2,-0.2 -2,-0.2 0.894 107.7 53.2 -64.3 -42.3 -5.2 -0.5 44.1 27 32 A A H < S+ 0 0 2 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.850 111.3 46.8 -63.0 -36.3 -2.7 -0.1 47.0 28 33 A A H < S+ 0 0 67 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.860 115.3 45.8 -72.0 -35.8 -3.2 3.7 46.8 29 34 A A H < S+ 0 0 50 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.750 122.6 35.7 -77.6 -24.0 -7.0 3.3 46.6 30 35 A A >< + 0 0 0 -4,-2.0 3,-1.9 -5,-0.1 -1,-0.2 -0.611 67.9 164.4-129.1 70.2 -7.1 0.8 49.5 31 36 A P T 3 S+ 0 0 98 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.669 73.4 61.2 -69.4 -17.3 -4.4 1.9 51.9 32 37 A H T 3 S+ 0 0 83 -3,-0.1 2,-0.3 2,-0.1 -30,-0.1 0.540 92.6 82.7 -81.4 -12.1 -5.8 -0.2 54.7 33 38 A A S < S- 0 0 0 -3,-1.9 2,-0.4 -6,-0.2 -29,-0.2 -0.657 72.2-140.0 -94.5 147.0 -5.2 -3.4 52.6 34 39 A V E -a 4 0A 34 -31,-2.0 -29,-3.1 -2,-0.3 2,-0.4 -0.882 14.7-154.5-105.7 145.2 -1.8 -5.2 52.4 35 40 A F E -ac 5 58A 3 22,-3.0 24,-1.9 -2,-0.4 2,-0.5 -0.965 7.4-164.3-124.4 131.3 -0.7 -6.6 49.0 36 41 A S E -ac 6 59A 2 -31,-2.5 -29,-2.7 -2,-0.4 2,-0.6 -0.982 11.9-155.6-119.3 120.1 1.7 -9.5 48.5 37 42 A F E -ac 7 60A 0 22,-2.4 24,-3.0 -2,-0.5 2,-0.5 -0.849 7.9-162.5-105.2 113.7 3.1 -9.8 44.9 38 43 A F E +ac 8 61A 0 -31,-3.2 -29,-2.6 -2,-0.6 2,-0.3 -0.849 30.3 121.2-105.1 121.6 4.3 -13.2 43.8 39 44 A S E - c 0 62A 0 22,-1.8 24,-3.0 -2,-0.5 -29,-0.1 -0.898 63.5 -69.5-153.3-179.4 6.6 -13.8 40.8 40 45 A T E > - c 0 63A 13 -2,-0.3 4,-2.5 22,-0.3 5,-0.3 -0.313 48.3-108.6 -70.2 162.9 10.0 -15.4 40.1 41 46 A S H > S+ 0 0 67 22,-0.5 4,-2.5 1,-0.2 5,-0.2 0.916 120.1 50.7 -62.2 -40.0 13.1 -13.7 41.4 42 47 A Q H > S+ 0 0 156 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.907 111.8 47.2 -63.0 -41.9 14.1 -12.6 37.8 43 48 A S H > S+ 0 0 13 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.947 114.3 45.5 -64.9 -50.5 10.7 -11.2 37.1 44 49 A N H X S+ 0 0 4 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.919 110.2 54.5 -59.5 -44.8 10.5 -9.2 40.4 45 50 A A H < S+ 0 0 72 -4,-2.5 -1,-0.2 -5,-0.3 4,-0.2 0.908 113.2 44.2 -56.6 -42.6 14.1 -7.9 40.0 46 51 A S H >< S+ 0 0 80 -4,-1.9 3,-1.0 -5,-0.2 -2,-0.2 0.965 119.7 37.5 -66.1 -53.5 13.1 -6.6 36.5 47 52 A I H 3< S+ 0 0 28 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.2 0.736 116.9 49.8 -78.8 -22.2 9.7 -5.0 37.4 48 53 A F T 3< S+ 0 0 39 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.300 73.6 149.1 -98.2 7.8 10.6 -3.7 40.9 49 54 A H < 0 0 133 -3,-1.0 -3,-0.1 -4,-0.2 -4,-0.0 -0.214 360.0 360.0 -43.2 120.0 13.8 -2.0 39.5 50 55 A D 0 0 146 2,-0.0 3,-0.3 3,-0.0 -1,-0.2 0.981 360.0 360.0 66.6 360.0 14.1 1.0 41.9 51 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 52 58 A H 0 0 196 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -12.6 11.6 4.9 47.0 53 59 A T + 0 0 77 -3,-0.3 3,-0.1 2,-0.1 2,-0.1 0.571 360.0 114.4-111.6 -18.6 8.3 5.3 45.1 54 60 A M S S- 0 0 49 -4,-0.1 -6,-0.0 1,-0.1 -4,-0.0 -0.311 77.5-104.4 -63.4 131.4 6.7 2.0 45.9 55 61 A Q > - 0 0 52 1,-0.1 3,-1.7 2,-0.1 -1,-0.1 -0.300 26.3-130.5 -55.0 136.0 3.5 2.0 48.0 56 62 A C T 3 S+ 0 0 137 1,-0.3 -1,-0.1 -3,-0.1 -2,-0.1 0.751 102.7 65.1 -67.1 -24.3 4.4 0.9 51.5 57 63 A N T 3 S+ 0 0 32 -30,-0.1 -22,-3.0 -23,-0.1 2,-0.4 0.398 89.3 82.5 -81.6 4.7 1.6 -1.6 51.6 58 64 A I E < +c 35 0A 14 -3,-1.7 2,-0.4 -24,-0.2 -22,-0.2 -0.923 51.4 173.3-107.8 132.0 3.1 -3.7 48.8 59 65 A K E -c 36 0A 108 -24,-1.9 -22,-2.4 -2,-0.4 2,-0.2 -0.999 21.9-138.2-132.0 137.0 5.8 -6.4 49.3 60 66 A S E -c 37 0A 43 -2,-0.4 2,-0.4 -24,-0.2 -22,-0.2 -0.608 12.3-160.2 -90.7 150.1 7.1 -8.7 46.6 61 67 A Y E -c 38 0A 13 -24,-3.0 -22,-1.8 -2,-0.2 2,-0.5 -0.999 15.3-132.3-131.2 130.9 7.9 -12.4 47.2 62 68 A D E -c 39 0A 98 -2,-0.4 -22,-0.3 -24,-0.2 2,-0.2 -0.702 27.2-171.6 -85.3 121.9 10.1 -14.6 45.0 63 69 A I E -c 40 0A 15 -24,-3.0 -22,-0.5 -2,-0.5 29,-0.1 -0.712 33.6 -76.2-110.7 167.2 8.6 -17.9 44.1 64 70 A S - 0 0 61 -2,-0.2 -1,-0.1 1,-0.1 27,-0.1 -0.274 22.1-147.1 -66.6 141.3 10.1 -21.0 42.3 65 71 A D - 0 0 71 2,-0.2 -1,-0.1 -26,-0.0 22,-0.1 0.415 43.4-119.8 -80.1 0.8 10.7 -20.9 38.5 66 72 A G + 0 0 14 1,-0.2 -2,-0.1 21,-0.1 20,-0.0 0.477 68.2 137.7 76.1 4.3 10.0 -24.6 38.6 67 73 A V - 0 0 44 2,-0.0 -1,-0.2 4,-0.0 -2,-0.2 -0.742 54.4-127.8 -89.5 118.1 13.4 -25.6 37.2 68 74 A P > - 0 0 71 0, 0.0 3,-1.9 0, 0.0 -1,-0.0 -0.273 28.3-105.5 -63.6 151.6 14.9 -28.6 39.1 69 75 A E T 3 S+ 0 0 213 1,-0.3 -2,-0.0 0, 0.0 0, 0.0 0.857 115.0 30.5 -52.3 -48.8 18.4 -28.1 40.4 70 76 A G T 3 S+ 0 0 78 2,-0.1 -1,-0.3 0, 0.0 2,-0.1 0.086 88.3 150.3 -98.1 27.7 20.4 -30.2 37.9 71 77 A Y < - 0 0 74 -3,-1.9 2,-0.6 1,-0.1 -4,-0.0 -0.328 32.6-157.9 -70.3 135.0 18.0 -29.7 34.9 72 78 A V - 0 0 126 -2,-0.1 2,-0.1 2,-0.0 -1,-0.1 -0.959 23.7-124.6-109.8 118.7 19.3 -29.8 31.4 73 79 A F - 0 0 103 -2,-0.6 7,-0.0 1,-0.1 6,-0.0 -0.339 8.1-153.4 -64.1 135.3 17.1 -28.0 28.9 74 80 A A - 0 0 73 -2,-0.1 -1,-0.1 2,-0.0 -2,-0.0 0.754 41.2-121.4 -73.2 -29.1 15.8 -29.9 25.9 75 81 A G + 0 0 64 1,-0.2 -2,-0.1 0, 0.0 3,-0.0 0.758 56.4 154.4 89.2 28.1 15.5 -26.6 24.1 76 82 A R > - 0 0 115 1,-0.1 3,-1.0 2,-0.0 2,-0.3 -0.473 52.1-102.1 -74.3 154.1 11.8 -26.8 23.3 77 83 A P T 3 S+ 0 0 113 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.649 109.9 18.1 -73.8 141.1 9.8 -23.7 22.7 78 84 A Q T 3> S+ 0 0 76 -2,-0.3 4,-2.6 3,-0.0 5,-0.2 0.559 85.5 130.2 72.9 10.9 7.7 -22.9 25.8 79 85 A E H <> S+ 0 0 3 -3,-1.0 4,-2.3 2,-0.2 5,-0.2 0.895 73.3 47.7 -59.7 -43.4 10.0 -25.2 28.0 80 86 A D H > S+ 0 0 78 -4,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.908 112.6 49.7 -63.3 -42.0 10.5 -22.5 30.6 81 87 A I H > S+ 0 0 25 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.904 110.6 50.0 -61.2 -45.2 6.7 -21.8 30.6 82 88 A E H X S+ 0 0 22 -4,-2.6 4,-2.5 2,-0.2 5,-0.2 0.917 111.9 47.2 -60.5 -44.7 6.0 -25.6 31.0 83 89 A L H X S+ 0 0 26 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.950 115.4 44.8 -65.2 -49.7 8.4 -25.9 33.9 84 90 A F H X S+ 0 0 1 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.930 114.4 49.7 -54.6 -50.1 7.1 -22.9 35.7 85 91 A T H < S+ 0 0 11 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.873 107.4 52.4 -63.1 -41.3 3.4 -23.9 35.1 86 92 A R H < S+ 0 0 169 -4,-2.5 4,-0.2 1,-0.2 -1,-0.2 0.878 119.4 35.7 -63.5 -36.1 3.8 -27.5 36.3 87 93 A A H >X S+ 0 0 29 -4,-1.6 4,-2.5 -5,-0.2 3,-0.7 0.680 94.2 93.6 -85.7 -19.4 5.3 -26.3 39.7 88 94 A A H 3X S+ 0 0 0 -4,-1.8 4,-3.0 1,-0.2 5,-0.4 0.774 75.9 57.5 -55.5 -40.7 3.2 -23.1 40.0 89 95 A P H 3> S+ 0 0 53 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.945 117.8 35.9 -54.4 -46.2 0.3 -24.4 42.2 90 96 A E H <> S+ 0 0 88 -3,-0.7 4,-2.7 -4,-0.2 5,-0.2 0.914 116.0 54.6 -69.5 -45.4 2.9 -25.5 44.8 91 97 A S H X S+ 0 0 10 -4,-2.5 4,-2.0 1,-0.2 -3,-0.2 0.904 112.6 42.3 -55.3 -47.4 5.2 -22.5 44.2 92 98 A F H X S+ 0 0 0 -4,-3.0 4,-2.9 2,-0.2 5,-0.2 0.900 112.1 55.1 -69.6 -38.9 2.4 -19.9 44.8 93 99 A R H X S+ 0 0 114 -4,-1.6 4,-2.3 -5,-0.4 -2,-0.2 0.939 109.8 46.5 -59.1 -47.7 1.0 -21.8 47.8 94 100 A Q H X S+ 0 0 111 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.866 111.7 51.4 -63.7 -41.6 4.4 -21.7 49.5 95 101 A G H X S+ 0 0 8 -4,-2.0 4,-2.4 -5,-0.2 -2,-0.2 0.942 110.3 48.6 -54.7 -49.2 4.8 -18.0 48.7 96 102 A M H X S+ 0 0 9 -4,-2.9 4,-2.8 1,-0.2 5,-0.2 0.879 106.6 56.7 -65.9 -36.6 1.4 -17.3 50.2 97 103 A V H X S+ 0 0 84 -4,-2.3 4,-2.0 -5,-0.2 -1,-0.2 0.938 109.3 46.7 -55.8 -46.8 2.3 -19.3 53.3 98 104 A M H X S+ 0 0 110 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.933 113.2 48.1 -61.8 -45.9 5.3 -17.0 53.8 99 105 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 6,-0.3 0.886 109.7 51.6 -66.3 -39.8 3.3 -13.8 53.2 100 106 A V H X>S+ 0 0 46 -4,-2.8 4,-2.3 2,-0.2 5,-0.5 0.915 112.5 47.0 -61.2 -43.0 0.5 -14.9 55.7 101 107 A A H <5S+ 0 0 82 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.890 113.8 47.5 -66.7 -40.9 3.1 -15.6 58.4 102 108 A E H <5S+ 0 0 86 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.913 122.8 32.6 -64.9 -45.0 4.9 -12.3 57.8 103 109 A T H <5S- 0 0 51 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.734 94.2-136.2 -84.6 -26.2 1.8 -10.2 57.8 104 110 A G T <5S+ 0 0 56 -4,-2.3 -3,-0.2 -5,-0.3 -4,-0.1 0.679 70.0 113.6 70.4 20.1 -0.2 -12.2 60.3 105 111 A R < - 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0 0 6 -24,-0.8 3,-2.4 -2,-0.2 2,-0.1 -0.866 42.1-100.1 -90.8 129.1 2.2 -5.7 5.2 379 393 A E G > S+ 0 0 110 -2,-0.5 3,-0.6 1,-0.3 8,-0.1 -0.314 106.7 3.2 -47.3 114.4 1.5 -7.5 1.8 380 394 A G G 3 S- 0 0 74 1,-0.2 -1,-0.3 -2,-0.1 3,-0.1 0.453 111.8 -92.5 85.6 -1.3 1.5 -11.2 2.5 381 395 A G G < S+ 0 0 34 -3,-2.4 2,-0.3 1,-0.2 -1,-0.2 0.520 101.6 93.3 74.5 4.4 2.1 -10.9 6.3 382 396 A V S < S- 0 0 65 -3,-0.6 2,-0.3 -4,-0.0 -1,-0.2 -0.954 82.7 -99.2-127.3 148.7 5.9 -11.0 5.9 383 397 A F + 0 0 8 -2,-0.3 2,-0.3 -3,-0.1 -106,-0.2 -0.510 43.9 166.8 -64.9 127.3 8.5 -8.3 5.5 384 398 A T > - 0 0 60 -2,-0.3 4,-2.2 -107,-0.1 5,-0.3 -0.943 43.9-117.8-131.5 157.0 9.8 -7.6 2.0 385 399 A K H > S+ 0 0 94 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.948 113.7 41.8 -58.7 -50.1 11.9 -4.7 0.9 386 400 A S H > S+ 0 0 91 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.908 113.5 51.3 -68.6 -41.2 9.2 -3.3 -1.5 387 401 A G H > S+ 0 0 8 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.910 112.9 46.4 -61.1 -42.5 6.2 -3.9 0.8 388 402 A L H X S+ 0 0 1 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.932 109.9 52.8 -69.3 -44.8 7.9 -2.1 3.6 389 403 A M H X S+ 0 0 61 -4,-2.3 4,-1.9 -5,-0.3 -1,-0.2 0.874 109.6 50.2 -55.4 -39.0 9.0 0.8 1.4 390 404 A S H X S+ 0 0 58 -4,-2.1 4,-2.8 2,-0.2 -1,-0.2 0.920 110.0 49.6 -64.1 -45.7 5.3 1.2 0.3 391 405 A C H X S+ 0 0 4 -4,-2.0 4,-2.2 2,-0.2 5,-0.2 0.917 109.9 50.8 -59.8 -46.2 4.1 1.2 3.9 392 406 A F H X S+ 0 0 7 -4,-2.6 4,-2.8 2,-0.2 5,-0.4 0.903 113.6 45.8 -56.7 -45.9 6.6 3.9 4.9 393 407 A D H X>S+ 0 0 76 -4,-1.9 4,-2.5 -5,-0.2 5,-1.2 0.957 110.6 52.5 -62.2 -51.6 5.5 6.1 1.9 394 408 A Q H X5S+ 0 0 52 -4,-2.8 7,-1.7 3,-0.2 4,-0.6 0.903 120.6 33.5 -47.8 -50.1 1.8 5.6 2.6 395 409 A I H <5S+ 0 0 0 -4,-2.2 -2,-0.2 5,-0.2 -1,-0.2 0.912 125.7 35.7 -79.1 -46.4 2.2 6.7 6.2 396 410 A L H <5S+ 0 0 35 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.776 133.3 16.1 -83.7 -26.7 4.9 9.3 6.1 397 411 A S H <5S+ 0 0 88 -4,-2.5 -3,-0.2 -5,-0.4 2,-0.2 0.577 108.5 69.9-126.2 -14.0 4.3 11.1 2.8 398 412 A Q S >X S+ 0 0 103 1,-0.2 4,-2.0 2,-0.2 3,-0.3 0.828 113.0 68.8 -58.3 -37.9 -2.9 11.0 2.2 400 414 A K H 3> S+ 0 0 90 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.890 98.0 51.9 -48.1 -44.4 -3.4 7.5 3.9 401 415 A G H <> S+ 0 0 0 -7,-1.7 4,-2.6 -3,-0.8 -1,-0.2 0.877 105.7 54.2 -65.9 -37.6 -1.1 8.6 6.8 402 416 A K H X S+ 0 0 120 -4,-1.0 4,-1.9 -3,-0.3 -1,-0.2 0.902 110.1 47.5 -61.4 -42.1 -3.1 11.8 7.4 403 417 A K H X S+ 0 0 97 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.908 111.0 50.1 -64.9 -44.2 -6.3 9.7 7.7 404 418 A L H X S+ 0 0 5 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.926 110.1 51.4 -61.4 -43.7 -4.7 7.2 10.1 405 419 A R H X S+ 0 0 49 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.887 109.8 50.3 -60.0 -40.6 -3.4 10.1 12.2 406 420 A E H X S+ 0 0 129 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.910 110.1 48.9 -62.5 -46.1 -7.0 11.5 12.3 407 421 A N H X S+ 0 0 57 -4,-2.5 4,-2.3 -34,-0.2 -2,-0.2 0.886 110.1 52.9 -59.7 -39.4 -8.5 8.2 13.3 408 422 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.881 106.4 52.6 -64.7 -40.1 -5.8 7.9 16.1 409 423 A R H X S+ 0 0 126 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.925 112.3 44.9 -58.8 -48.0 -6.7 11.3 17.5 410 424 A A H X S+ 0 0 59 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.862 113.1 50.1 -64.0 -42.0 -10.4 10.4 17.7 411 425 A L H X S+ 0 0 19 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.929 110.8 49.6 -64.3 -44.1 -9.7 7.0 19.3 412 426 A R H X S+ 0 0 73 -4,-2.5 4,-2.9 1,-0.2 -2,-0.2 0.863 107.7 54.0 -65.2 -40.0 -7.4 8.5 21.9 413 427 A E H X S+ 0 0 85 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.923 109.9 47.5 -59.0 -46.9 -10.0 11.2 22.8 414 428 A T H X S+ 0 0 63 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.953 113.6 47.6 -57.6 -48.6 -12.6 8.4 23.4 415 429 A A H X S+ 0 0 0 -4,-2.3 4,-1.1 1,-0.2 -2,-0.2 0.884 109.2 54.3 -58.8 -45.2 -10.0 6.4 25.5 416 430 A D H >< S+ 0 0 65 -4,-2.9 3,-0.5 1,-0.2 4,-0.4 0.904 107.9 49.7 -55.2 -46.7 -9.1 9.6 27.5 417 431 A R H >< S+ 0 0 174 -4,-2.2 3,-0.8 1,-0.2 -1,-0.2 0.828 103.4 59.5 -65.8 -33.8 -12.8 10.2 28.4 418 432 A A H 3< S+ 0 0 3 -4,-1.8 8,-1.5 1,-0.2 7,-1.4 0.823 113.3 39.1 -61.1 -31.2 -13.2 6.6 29.6 419 433 A V T << S+ 0 0 26 -4,-1.1 -1,-0.2 -3,-0.5 -2,-0.2 0.326 102.5 87.9-103.0 5.4 -10.4 7.2 32.1 420 434 A G S X S- 0 0 21 -3,-0.8 3,-2.0 -4,-0.4 6,-0.3 -0.179 98.8 -52.0 -87.8-169.5 -11.4 10.8 33.1 421 435 A P T 3 S+ 0 0 130 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.396 132.1 9.0 -63.9 139.8 -13.8 11.8 35.8 422 436 A K T 3 S+ 0 0 177 1,-0.2 -3,-0.1 -3,-0.1 -5,-0.0 0.486 97.9 145.7 67.6 1.8 -17.1 10.0 35.4 423 437 A G <> - 0 0 6 -3,-2.0 4,-2.2 -7,-0.1 -5,-0.2 -0.295 62.3-115.4 -66.7 154.1 -15.4 7.8 32.7 424 438 A S H > S+ 0 0 19 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.883 116.8 47.5 -56.7 -42.8 -16.5 4.1 32.3 425 439 A S H > S+ 0 0 1 -7,-1.4 4,-2.0 2,-0.2 -6,-0.2 0.868 109.3 54.2 -68.6 -38.5 -13.0 2.8 33.3 426 440 A T H > S+ 0 0 45 -8,-1.5 4,-1.6 -6,-0.3 -2,-0.2 0.934 111.9 44.0 -54.7 -48.5 -12.9 5.2 36.3 427 441 A E H X S+ 0 0 86 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.907 113.2 51.7 -68.0 -42.2 -16.3 3.8 37.6 428 442 A N H X S+ 0 0 18 -4,-2.4 4,-2.1 -192,-0.3 -1,-0.2 0.832 106.5 54.2 -60.5 -37.2 -15.2 0.2 36.9 429 443 A F H X S+ 0 0 23 -4,-2.0 4,-3.1 2,-0.2 -1,-0.2 0.880 104.5 53.7 -67.7 -39.0 -12.0 0.7 38.9 430 444 A I H X S+ 0 0 81 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.929 108.3 51.3 -56.7 -45.8 -14.0 1.9 41.9 431 445 A T H X S+ 0 0 56 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.911 110.7 47.3 -56.4 -46.9 -15.9 -1.4 41.6 432 446 A L H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.913 109.6 53.1 -64.9 -43.8 -12.7 -3.4 41.5 433 447 A V H X S+ 0 0 16 -4,-3.1 4,-1.5 2,-0.2 -2,-0.2 0.918 108.4 51.6 -53.0 -43.4 -11.3 -1.4 44.5 434 448 A D H X S+ 0 0 99 -4,-2.4 4,-0.8 1,-0.2 -2,-0.2 0.918 110.1 49.2 -62.0 -43.3 -14.5 -2.3 46.4 435 449 A L H >< S+ 0 0 36 -4,-2.1 3,-0.6 1,-0.2 -2,-0.2 0.912 113.6 43.8 -63.2 -45.1 -14.0 -6.0 45.5 436 450 A V H 3< S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.673 109.3 60.4 -74.0 -16.6 -10.3 -6.1 46.7 437 451 A S H 3< S+ 0 0 25 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.631 78.6 104.1 -84.6 -19.5 -11.2 -4.1 49.8 438 452 A K S << S- 0 0 122 -4,-0.8 3,-0.1 -3,-0.6 -3,-0.0 -0.451 71.2-131.0 -63.2 128.9 -13.7 -6.7 51.2 439 453 A P - 0 0 74 0, 0.0 -437,-0.1 0, 0.0 -1,-0.1 -0.321 41.5 -72.3 -74.4 171.4 -12.2 -8.7 54.0 440 454 A K 0 0 97 -439,-0.3 -312,-0.1 -334,-0.2 -332,-0.1 -0.276 360.0 360.0 -60.5 143.5 -12.4 -12.5 53.9 441 455 A D 0 0 173 -314,-0.6 -1,-0.1 -333,-0.2 -3,-0.0 -0.261 360.0 360.0 -54.7 360.0 -15.8 -14.2 54.6