==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 24-JAN-07 2E93 . COMPND 2 MOLECULE: GERANYLGERANYL PYROPHOSPHATE SYNTHETASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR R.T.GUO,R.CAO,T.P.KO,C.K.-M.CHEN,W.Y.JENG,T.H.CHANG, . 613 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26976.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 489 79.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 1.0 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 . 2 0.3 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 . 13 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 63 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 388 63.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 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 1 3 0 0 0 1 3 1 3 5 0 4 0 2 1 1 0 1 0 0 1 1 1 0 0 0 2 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 0 2 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 . 2 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 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 4 A N > 0 0 123 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 166.5 41.9 13.8 51.4 2 5 A K H > + 0 0 180 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.762 360.0 57.0 -66.6 -31.5 43.6 14.8 48.2 3 6 A M H > S+ 0 0 28 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.926 110.0 44.5 -66.8 -45.8 40.4 15.4 46.1 4 7 A E H > S+ 0 0 82 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.869 113.5 51.8 -65.1 -39.5 39.0 17.9 48.6 5 8 A A H X S+ 0 0 56 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.909 112.5 45.3 -65.8 -41.3 42.5 19.5 48.8 6 9 A K H X S+ 0 0 74 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.889 114.0 48.2 -70.0 -38.5 42.6 19.8 45.0 7 10 A I H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 5,-0.2 0.925 110.8 53.3 -66.8 -38.1 39.0 21.1 44.9 8 11 A D H X S+ 0 0 35 -4,-2.8 4,-1.0 1,-0.2 -2,-0.2 0.904 108.8 48.4 -63.3 -38.2 39.9 23.5 47.6 9 12 A E H < S+ 0 0 137 -4,-2.0 3,-0.4 2,-0.2 4,-0.2 0.924 109.7 53.4 -67.6 -41.5 42.9 24.8 45.6 10 13 A L H >< S+ 0 0 30 -4,-2.1 3,-1.2 1,-0.2 -2,-0.2 0.942 110.9 43.4 -58.7 -50.8 40.7 25.2 42.5 11 14 A I H 3< S+ 0 0 2 -4,-2.3 -1,-0.2 1,-0.3 490,-0.2 0.604 109.6 57.9 -75.3 -11.2 38.0 27.3 44.1 12 15 A N T 3< S+ 0 0 72 -4,-1.0 2,-0.3 -3,-0.4 -1,-0.3 0.324 103.3 61.7 -99.2 6.2 40.5 29.5 45.9 13 16 A N S < S- 0 0 97 -3,-1.2 3,-0.1 -4,-0.2 0, 0.0 -0.835 93.9 -89.4-126.0 165.4 42.3 30.6 42.7 14 17 A D - 0 0 142 -2,-0.3 459,-0.1 1,-0.1 -2,-0.1 -0.380 64.2 -79.2 -66.7 152.6 41.4 32.5 39.6 15 18 A P - 0 0 21 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.242 51.5-113.0 -54.0 138.2 40.1 30.3 36.7 16 19 A V + 0 0 77 -3,-0.1 2,-0.4 -6,-0.0 457,-0.2 -0.577 44.2 168.9 -76.6 130.7 42.9 28.5 34.9 17 20 A W - 0 0 44 -2,-0.3 2,-0.2 -3,-0.1 -3,-0.0 -0.968 14.1-156.8-144.1 128.5 43.4 29.8 31.3 18 21 A S > - 0 0 35 -2,-0.4 4,-2.7 1,-0.1 5,-0.1 -0.683 30.2-118.0-111.0 165.8 46.3 29.1 29.0 19 22 A S H > S+ 0 0 92 -2,-0.2 4,-2.2 2,-0.2 5,-0.1 0.839 118.3 52.9 -59.1 -41.4 48.0 30.5 26.0 20 23 A Q H > S+ 0 0 136 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.949 109.3 49.8 -63.1 -46.9 47.1 27.4 24.0 21 24 A N H > S+ 0 0 28 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.908 108.1 54.1 -56.1 -46.2 43.4 27.9 25.1 22 25 A E H X S+ 0 0 37 -4,-2.7 4,-0.9 1,-0.2 -1,-0.2 0.924 110.0 47.7 -56.9 -44.5 43.6 31.6 24.0 23 26 A S H X S+ 0 0 71 -4,-2.2 4,-0.6 2,-0.2 3,-0.4 0.905 107.9 54.1 -63.5 -46.5 44.8 30.4 20.6 24 27 A L H >< S+ 0 0 35 -4,-2.2 3,-1.1 1,-0.2 -2,-0.2 0.943 113.0 41.7 -55.8 -48.0 42.1 27.7 20.1 25 28 A I H 3< S+ 0 0 5 -4,-2.1 4,-0.3 1,-0.2 -1,-0.2 0.661 106.4 64.1 -80.0 -9.3 39.2 30.0 20.7 26 29 A S H >X S+ 0 0 11 -4,-0.9 4,-2.8 -3,-0.4 3,-0.9 0.600 71.7 101.3 -87.7 -5.0 40.8 32.9 18.7 27 30 A K H S+ 0 0 2 0, 0.0 4,-1.0 0, 0.0 -1,-0.2 0.891 117.0 43.2 -58.7 -34.4 37.5 32.7 13.9 29 32 A Y H <> S+ 0 0 19 -3,-0.9 4,-1.2 -4,-0.3 3,-0.5 0.934 109.8 52.9 -76.8 -48.3 39.1 36.0 14.7 30 33 A N H X S+ 0 0 81 -4,-2.8 4,-0.8 1,-0.2 3,-0.4 0.883 103.8 61.9 -56.5 -35.4 42.6 35.2 13.4 31 34 A H H >< S+ 0 0 27 -4,-2.4 3,-0.9 -5,-0.3 4,-0.3 0.893 100.1 50.0 -58.6 -45.5 41.1 34.1 10.1 32 35 A I H >< S+ 0 0 3 -4,-1.0 3,-1.2 -3,-0.5 -1,-0.2 0.835 103.3 61.9 -69.9 -22.7 39.6 37.5 9.2 33 36 A L H 3< S+ 0 0 75 -4,-1.2 -1,-0.2 -3,-0.4 -2,-0.2 0.751 83.5 81.2 -70.2 -18.8 43.1 39.1 10.0 34 37 A L T << S+ 0 0 122 -3,-0.9 -1,-0.2 -4,-0.8 -2,-0.2 0.726 94.6 48.9 -57.6 -21.3 44.6 37.0 7.1 35 38 A K S < S- 0 0 79 -3,-1.2 2,-0.1 -4,-0.3 53,-0.1 -0.966 94.0-117.9-120.7 140.3 43.2 39.5 4.7 36 39 A P - 0 0 114 0, 0.0 2,-0.1 0, 0.0 3,-0.1 -0.462 25.2-148.6 -76.0 148.7 43.8 43.2 5.1 37 40 A G - 0 0 26 1,-0.2 2,-0.5 -2,-0.1 4,-0.1 -0.393 56.5 -47.6 -99.7-175.7 40.7 45.4 5.6 38 41 A K > - 0 0 141 1,-0.2 3,-0.6 -2,-0.1 -1,-0.2 -0.438 57.7-168.3 -57.8 109.2 40.4 49.1 4.5 39 42 A N T >> S+ 0 0 113 -2,-0.5 4,-0.8 1,-0.3 3,-0.8 0.560 76.6 84.8 -74.2 -15.6 43.8 50.1 5.9 40 43 A F H 3> S+ 0 0 118 1,-0.2 4,-1.0 2,-0.2 -1,-0.3 0.216 71.7 81.0 -74.8 12.4 42.6 53.5 5.2 41 44 A R H <> S+ 0 0 74 -3,-0.6 4,-2.3 2,-0.3 3,-0.4 0.909 91.4 41.6 -86.0 -49.8 40.9 53.2 8.6 42 45 A L H <> S+ 0 0 91 -3,-0.8 4,-2.1 1,-0.2 -2,-0.2 0.802 112.5 64.1 -63.6 -22.7 43.9 54.0 10.8 43 46 A N H X S+ 0 0 66 -4,-0.8 4,-1.6 2,-0.2 -2,-0.3 0.896 102.8 43.5 -59.5 -49.4 44.1 56.5 7.9 44 47 A L H X S+ 0 0 16 -4,-1.0 4,-2.5 -3,-0.4 5,-0.2 0.853 114.3 50.4 -64.0 -43.7 40.7 58.2 9.0 45 48 A I H X S+ 0 0 8 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.880 108.7 52.2 -65.2 -35.6 41.8 58.1 12.6 46 49 A V H < S+ 0 0 71 -4,-2.1 4,-0.5 -5,-0.2 -2,-0.2 0.901 109.9 49.9 -69.3 -36.1 45.1 59.7 11.7 47 50 A Q H >X S+ 0 0 52 -4,-1.6 3,-2.5 1,-0.2 4,-0.5 0.980 108.6 49.3 -63.9 -57.7 43.2 62.5 9.9 48 51 A I H >X S+ 0 0 5 -4,-2.5 4,-2.1 1,-0.3 3,-1.5 0.845 103.0 65.2 -52.3 -31.2 40.8 63.3 12.7 49 52 A N H 3X S+ 0 0 24 -4,-1.5 4,-2.7 1,-0.3 -1,-0.3 0.725 82.0 74.3 -69.4 -15.4 43.8 63.4 15.0 50 53 A R H <4 S+ 0 0 191 -3,-2.5 -1,-0.3 -4,-0.5 -2,-0.2 0.879 111.1 31.6 -59.1 -34.2 45.1 66.4 13.1 51 54 A V H << S+ 0 0 97 -3,-1.5 -2,-0.2 -4,-0.5 -1,-0.2 0.863 124.1 42.3 -89.0 -46.5 42.3 68.2 15.0 52 55 A M H < S- 0 0 9 -4,-2.1 -3,-0.2 135,-0.0 -2,-0.2 0.847 85.8-158.3 -70.7 -36.1 42.2 66.2 18.2 53 56 A N < + 0 0 115 -4,-2.7 -3,-0.1 -5,-0.2 -4,-0.1 0.878 18.5 177.7 59.2 43.9 45.9 66.0 18.5 54 57 A L - 0 0 6 1,-0.1 -1,-0.1 -5,-0.1 2,-0.1 -0.439 39.2 -95.5 -73.4 152.6 46.1 63.0 20.8 55 58 A P >> - 0 0 74 0, 0.0 4,-2.5 0, 0.0 3,-0.7 -0.434 39.0-111.3 -67.7 146.0 49.6 61.8 21.8 56 59 A K H 3> S+ 0 0 185 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.804 113.8 50.4 -48.7 -42.9 50.7 58.9 19.5 57 60 A D H 3> S+ 0 0 135 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.881 112.6 46.0 -72.7 -31.4 50.6 56.2 22.1 58 61 A Q H <> S+ 0 0 44 -3,-0.7 4,-1.9 2,-0.2 -2,-0.2 0.901 110.6 54.1 -74.9 -37.7 47.0 57.0 23.2 59 62 A L H X S+ 0 0 18 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.917 103.4 57.6 -60.3 -41.4 45.9 57.3 19.6 60 63 A A H X S+ 0 0 55 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.863 106.1 48.6 -56.3 -44.2 47.3 53.8 19.0 61 64 A I H X S+ 0 0 25 -4,-1.3 4,-2.5 2,-0.2 -1,-0.2 0.891 108.8 51.9 -65.8 -39.9 45.1 52.4 21.7 62 65 A V H X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 5,-0.2 0.927 111.5 49.7 -60.5 -42.2 42.0 54.1 20.4 63 66 A S H X S+ 0 0 6 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.888 109.0 50.2 -64.3 -39.1 42.9 52.6 17.0 64 67 A Q H X S+ 0 0 91 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.895 110.4 50.9 -65.5 -42.4 43.3 49.1 18.5 65 68 A I H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.939 114.2 42.2 -60.4 -50.0 40.0 49.3 20.3 66 69 A V H X S+ 0 0 15 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.862 114.2 51.8 -69.1 -38.4 38.0 50.3 17.1 67 70 A E H X S+ 0 0 97 -4,-2.4 4,-2.8 -5,-0.2 5,-0.3 0.905 111.2 47.7 -63.3 -44.4 39.9 47.8 14.9 68 71 A L H X S+ 0 0 22 -4,-2.4 4,-2.2 2,-0.2 5,-0.3 0.946 114.2 45.0 -64.1 -48.8 39.1 45.0 17.3 69 72 A L H X S+ 0 0 10 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.895 116.2 49.1 -60.8 -42.8 35.4 45.9 17.6 70 73 A H H X S+ 0 0 63 -4,-2.6 4,-1.3 -5,-0.2 -2,-0.2 0.952 112.0 44.4 -63.2 -53.4 35.2 46.4 13.9 71 74 A N H X S+ 0 0 6 -4,-2.8 4,-1.0 1,-0.2 -2,-0.2 0.910 117.7 45.0 -59.6 -44.4 36.9 43.1 12.8 72 75 A S H X S+ 0 0 0 -4,-2.2 4,-1.3 -5,-0.3 3,-0.3 0.862 107.2 57.5 -71.1 -32.3 34.9 41.0 15.3 73 76 A S H X S+ 0 0 40 -4,-2.0 4,-2.8 -5,-0.3 -1,-0.2 0.824 101.4 59.5 -67.4 -25.7 31.6 42.7 14.5 74 77 A L H X S+ 0 0 14 -4,-1.3 4,-2.5 2,-0.2 -1,-0.2 0.866 98.5 57.0 -70.8 -33.2 32.2 41.6 10.9 75 78 A L H X S+ 0 0 4 -4,-1.0 4,-1.1 -3,-0.3 -1,-0.2 0.931 113.7 39.7 -58.4 -44.8 32.3 38.0 12.1 76 79 A I H X S+ 0 0 5 -4,-1.3 4,-2.9 2,-0.2 -2,-0.2 0.867 111.9 55.7 -71.5 -42.7 28.8 38.5 13.5 77 80 A D H X S+ 0 0 27 -4,-2.8 4,-1.6 1,-0.2 -2,-0.2 0.912 107.7 50.0 -58.8 -43.5 27.5 40.6 10.6 78 81 A D H X>S+ 0 0 7 -4,-2.5 5,-2.3 2,-0.2 4,-0.5 0.843 110.7 49.1 -69.1 -31.0 28.4 37.8 8.2 79 82 A I H ><5S+ 0 0 10 -4,-1.1 3,-1.2 3,-0.2 -2,-0.2 0.960 112.1 49.0 -68.5 -47.3 26.6 35.2 10.3 80 83 A E H 3<5S+ 0 0 5 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.746 119.9 36.6 -61.4 -27.3 23.5 37.5 10.5 81 84 A D H 3<5S- 0 0 21 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.341 105.1-129.9-101.8 -1.6 23.6 38.0 6.6 82 85 A N T <<5 - 0 0 112 -3,-1.2 -3,-0.2 -4,-0.5 -4,-0.1 0.891 42.5-176.6 43.9 49.3 24.7 34.3 6.1 83 86 A A < - 0 0 4 -5,-2.3 -1,-0.2 -6,-0.2 11,-0.2 -0.486 28.5-157.1 -76.6 138.9 27.5 35.8 3.9 84 87 A P S S+ 0 0 46 0, 0.0 7,-1.3 0, 0.0 2,-0.3 0.713 74.2 37.2 -84.2 -20.9 29.8 33.4 2.0 85 88 A L E +A 90 0A 52 132,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.976 50.5 174.2-139.3 147.5 32.8 35.8 1.5 86 89 A R E > S-A 89 0A 32 3,-2.2 3,-1.9 -2,-0.3 131,-0.1 -0.949 82.2 -4.8-152.9 123.8 34.5 38.6 3.4 87 90 A R T 3 S- 0 0 45 -2,-0.3 130,-0.1 1,-0.3 3,-0.1 0.858 130.5 -59.0 57.6 36.3 37.7 40.3 2.2 88 91 A G T 3 S+ 0 0 38 128,-2.4 -1,-0.3 1,-0.2 2,-0.3 0.451 119.3 91.2 75.7 2.1 37.7 37.8 -0.7 89 92 A Q E < S-A 86 0A 23 -3,-1.9 -3,-2.2 127,-0.2 -1,-0.2 -0.815 88.2 -75.2-125.1 166.6 37.9 34.7 1.4 90 93 A T E -A 85 0A 67 -2,-0.3 -5,-0.2 -5,-0.2 -1,-0.1 -0.276 57.9-104.1 -57.0 140.7 35.4 32.2 3.0 91 94 A T >> - 0 0 2 -7,-1.3 3,-0.9 -8,-0.2 4,-0.6 -0.383 25.7-118.6 -67.1 148.0 33.6 33.7 6.0 92 95 A S H >>>S+ 0 0 5 1,-0.2 4,-3.1 2,-0.2 3,-1.1 0.841 109.7 59.8 -55.2 -42.7 34.8 32.4 9.4 93 96 A H H 3>5S+ 0 0 8 1,-0.3 4,-0.9 2,-0.2 -1,-0.2 0.796 101.7 53.7 -63.0 -27.5 31.4 30.9 10.4 94 97 A L H <45S+ 0 0 96 -3,-0.9 -1,-0.3 -11,-0.2 -2,-0.2 0.698 118.4 38.0 -77.5 -14.8 31.4 28.6 7.3 95 98 A I H <<5S+ 0 0 81 -3,-1.1 -2,-0.2 -4,-0.6 -3,-0.1 0.901 132.3 20.2 -97.8 -50.7 34.9 27.3 8.4 96 99 A F H <5S- 0 0 42 -4,-3.1 4,-0.4 1,-0.2 -3,-0.2 0.472 113.8-109.1 -98.9 -7.7 34.8 27.1 12.2 97 100 A G X< - 0 0 23 -4,-0.9 4,-1.8 -5,-0.5 -1,-0.2 0.122 26.6 -84.3 93.1 151.5 31.0 27.0 12.5 98 101 A V H > S+ 0 0 46 1,-0.2 4,-2.6 -5,-0.2 5,-0.3 0.907 120.1 58.5 -54.0 -46.4 28.4 29.5 13.7 99 102 A P H > S+ 0 0 24 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.934 110.6 39.2 -55.1 -50.5 28.8 28.6 17.4 100 103 A S H > S+ 0 0 11 -4,-0.4 4,-2.7 2,-0.2 5,-0.2 0.858 114.4 54.6 -65.4 -40.1 32.5 29.3 17.8 101 104 A T H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 5,-0.2 0.908 108.9 47.5 -65.5 -39.9 32.3 32.4 15.6 102 105 A I H X S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 5,-0.3 0.970 115.0 46.1 -63.2 -50.1 29.5 34.0 17.7 103 106 A N H X S+ 0 0 4 -4,-2.0 4,-2.1 -5,-0.3 -2,-0.2 0.897 114.2 46.8 -62.8 -41.7 31.4 33.2 20.9 104 107 A T H X S+ 0 0 2 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.903 112.6 49.4 -66.5 -45.8 34.7 34.5 19.7 105 108 A A H X S+ 0 0 0 -4,-2.5 4,-1.5 -5,-0.2 -2,-0.2 0.953 113.3 46.9 -56.0 -51.1 33.3 37.7 18.2 106 109 A N H X S+ 0 0 0 -4,-2.9 4,-1.4 -5,-0.2 3,-0.3 0.889 109.2 55.9 -60.4 -37.2 31.4 38.4 21.5 107 110 A Y H X S+ 0 0 0 -4,-2.1 4,-1.7 -5,-0.3 -1,-0.2 0.926 105.5 51.4 -58.5 -44.9 34.7 37.6 23.4 108 111 A M H X S+ 0 0 13 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.795 99.9 62.8 -65.6 -29.1 36.5 40.2 21.4 109 112 A Y H X S+ 0 0 10 -4,-1.5 4,-2.3 -3,-0.3 -1,-0.2 0.927 109.6 41.9 -59.2 -46.9 33.8 42.9 22.2 110 113 A F H X S+ 0 0 0 -4,-1.4 4,-1.6 2,-0.2 -2,-0.2 0.812 111.3 54.1 -71.7 -27.6 34.8 42.5 25.9 111 114 A R H X S+ 0 0 68 -4,-1.7 4,-1.3 2,-0.2 -2,-0.2 0.893 109.5 49.9 -69.3 -40.6 38.6 42.4 25.1 112 115 A A H >X S+ 0 0 0 -4,-2.4 4,-0.9 1,-0.2 3,-0.8 0.952 108.3 52.0 -59.3 -50.9 38.0 45.7 23.3 113 116 A M H >< S+ 0 0 0 -4,-2.3 3,-0.8 1,-0.2 4,-0.4 0.868 104.5 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257 A E H > S+ 0 0 142 -3,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.936 114.1 44.5 -57.1 -49.4 3.5 44.4 -10.3 247 258 A Q H > S+ 0 0 58 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.886 110.7 54.9 -64.2 -39.9 7.1 45.8 -10.0 248 259 A H H X S+ 0 0 29 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.951 112.3 43.4 -58.6 -47.3 6.7 46.4 -6.3 249 260 A N H X S+ 0 0 86 -4,-2.4 4,-2.5 -5,-0.2 -2,-0.2 0.850 111.5 52.5 -68.9 -32.8 5.7 42.8 -5.8 250 261 A E H X S+ 0 0 25 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.886 107.2 53.3 -72.5 -36.0 8.4 41.4 -8.1 251 262 A I H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.979 112.2 45.2 -60.9 -47.9 11.1 43.4 -6.1 252 263 A L H X S+ 0 0 18 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.910 112.3 51.8 -57.1 -46.4 9.7 41.8 -2.9 253 264 A R H X S+ 0 0 120 -4,-2.5 4,-1.3 2,-0.2 -1,-0.2 0.935 110.0 48.1 -59.0 -48.6 9.6 38.3 -4.5 254 265 A I H >X>S+ 0 0 0 -4,-2.7 3,-0.9 1,-0.2 4,-0.7 0.957 111.5 49.6 -63.0 -44.4 13.2 38.5 -5.7 255 266 A L H ><5S+ 0 0 1 -4,-2.4 3,-1.1 1,-0.3 -1,-0.2 0.911 109.5 52.9 -55.9 -44.8 14.4 39.7 -2.2 256 267 A L H 3<5S+ 0 0 79 -4,-2.7 -1,-0.3 1,-0.2 -2,-0.2 0.662 96.2 67.8 -66.0 -21.0 12.5 36.8 -0.6 257 268 A L H <<5S- 0 0 78 -4,-1.3 -1,-0.2 -3,-0.9 -2,-0.2 0.782 85.4-150.5 -68.6 -25.2 14.1 34.2 -2.8 258 269 A R T <<5 - 0 0 81 -3,-1.1 2,-0.2 -4,-0.7 -34,-0.2 0.961 36.9-179.4 51.0 51.4 17.6 34.8 -1.2 259 270 A T < - 0 0 24 -5,-0.5 -1,-0.2 -36,-0.2 -33,-0.1 -0.573 44.1-165.3 -93.0 149.2 18.9 33.7 -4.6 260 271 A S + 0 0 88 -2,-0.2 2,-0.6 -3,-0.1 -1,-0.1 0.241 52.3 128.0-103.9 6.1 22.4 33.3 -6.0 261 272 A D > - 0 0 69 1,-0.2 4,-2.5 2,-0.1 3,-0.3 -0.538 52.0-152.8 -68.4 117.4 21.1 33.2 -9.5 262 273 A K H > S+ 0 0 127 -2,-0.6 4,-2.1 1,-0.2 -1,-0.2 0.815 91.0 50.2 -63.8 -31.0 23.1 35.8 -11.4 263 274 A D H > S+ 0 0 97 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.859 109.3 50.7 -76.7 -32.6 20.4 36.5 -14.0 264 275 A I H > S+ 0 0 48 -3,-0.3 4,-2.2 2,-0.2 -2,-0.2 0.927 112.6 47.5 -69.0 -42.1 17.7 37.0 -11.4 265 276 A K H X S+ 0 0 6 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.910 111.8 50.7 -63.1 -38.8 20.0 39.4 -9.5 266 277 A L 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Q H 3X S+ 0 0 73 -4,-2.6 4,-0.5 2,-0.2 -1,-0.2 0.818 108.5 47.5 -65.5 -37.4 24.3 65.9 -2.7 289 300 A L H X S+ 0 0 23 -4,-2.2 4,-2.6 1,-0.2 3,-1.1 0.886 106.7 55.5 -64.6 -39.5 29.1 65.1 -0.3 291 302 A N H 3X S+ 0 0 78 -4,-2.5 4,-2.2 1,-0.3 -1,-0.2 0.715 97.1 66.0 -66.5 -19.4 28.4 68.6 -1.6 292 303 A M H 3< S+ 0 0 33 -4,-0.5 -1,-0.3 -3,-0.4 -2,-0.2 0.827 111.9 33.5 -69.7 -30.6 27.1 69.4 1.9 293 304 A I H X< S+ 0 0 28 -3,-1.1 3,-1.1 -4,-0.7 -2,-0.2 0.941 122.6 45.4 -82.6 -64.9 30.6 68.9 3.1 294 305 A K H 3< S+ 0 0 115 -4,-2.6 2,-0.8 1,-0.3 -3,-0.2 0.878 115.5 46.1 -42.1 -56.2 32.5 70.3 0.1 295 306 A N T 3< 0 0 132 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.1 -0.277 360.0 360.0 -92.2 50.4 30.3 73.4 -0.4 296 307 A D < 0 0 173 -3,-1.1 -4,-0.0 -2,-0.8 -3,-0.0 -0.972 360.0 360.0-122.0 360.0 30.2 74.5 3.2 297 ! 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 0.0 298 332 A Y > 0 0 230 0, 0.0 3,-1.5 0, 0.0 4,-0.2 0.000 360.0 360.0 360.0 129.5 40.8 66.2 3.6 299 333 A I G > + 0 0 51 1,-0.3 3,-2.2 2,-0.1 2,-0.4 0.940 360.0 69.0 -45.8 -68.7 39.0 63.1 4.9 300 334 A I G 3 S+ 0 0 25 1,-0.3 -1,-0.3 -10,-0.0 -6,-0.1 0.450 81.9 78.9 -35.2 -7.8 35.9 63.3 2.8 301 335 A D G < 0 0 101 -3,-1.5 -1,-0.3 -2,-0.4 -2,-0.1 0.713 360.0 360.0 -81.2 -18.1 37.9 62.5 -0.3 302 336 A H < 0 0 146 -3,-2.2 -1,-0.1 -4,-0.2 0, 0.0 -0.076 360.0 360.0 47.8 360.0 38.0 58.7 0.4 303 !* 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 0.0 304 4 B N > 0 0 181 0, 0.0 4,-1.9 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 -87.6 16.9 72.9 -0.4 305 5 B K H > + 0 0 150 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.771 360.0 48.5 -42.2 -50.2 14.5 70.5 1.4 306 6 B M H > S+ 0 0 39 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.947 111.5 50.7 -61.9 -49.1 16.7 67.3 1.4 307 7 B E H > S+ 0 0 109 -3,-0.3 4,-2.7 1,-0.2 -2,-0.2 0.888 109.8 51.2 -57.2 -38.4 19.7 69.2 2.7 308 8 B A H X S+ 0 0 56 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.863 109.6 49.5 -70.1 -34.1 17.5 70.7 5.5 309 9 B K H X S+ 0 0 140 -4,-2.0 4,-2.0 -5,-0.2 -2,-0.2 0.893 111.8 48.7 -70.5 -38.0 16.3 67.2 6.5 310 10 B I H X S+ 0 0 3 -4,-2.6 4,-2.6 2,-0.2 5,-0.3 0.933 107.7 55.2 -66.2 -44.3 19.9 65.9 6.5 311 11 B D H X S+ 0 0 92 -4,-2.7 4,-1.0 1,-0.2 -2,-0.2 0.925 110.8 45.5 -53.8 -47.0 21.1 68.9 8.7 312 12 B E H X S+ 0 0 126 -4,-1.7 4,-0.5 1,-0.2 3,-0.4 0.923 111.9 52.0 -62.5 -45.8 18.5 68.1 11.3 313 13 B L H >< S+ 0 0 25 -4,-2.0 3,-1.1 1,-0.2 -2,-0.2 0.944 111.8 44.1 -55.4 -54.7 19.2 64.3 11.2 314 14 B I H 3< S+ 0 0 13 -4,-2.6 -1,-0.2 1,-0.2 -117,-0.2 0.602 111.1 55.3 -73.0 -10.4 23.0 64.7 11.8 315 15 B N H 3< S+ 0 0 80 -4,-1.0 2,-0.2 -3,-0.4 -1,-0.2 0.466 102.2 65.8 -99.9 -3.7 22.6 67.3 14.5 316 16 B N S << S- 0 0 93 -3,-1.1 3,-0.1 -4,-0.5 0, 0.0 -0.714 94.3 -92.7-111.8 165.9 20.4 65.2 16.7 317 17 B D - 0 0 146 -2,-0.2 -1,-0.1 1,-0.2 -2,-0.1 -0.302 65.3 -75.0 -65.3 163.7 20.9 62.0 18.6 318 18 B P - 0 0 23 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.347 54.1-114.9 -63.0 135.6 20.0 58.8 16.6 319 19 B V + 0 0 73 -3,-0.1 2,-0.3 -153,-0.1 -149,-0.1 -0.610 44.8 163.9 -75.7 135.3 16.2 58.5 16.4 320 20 B W - 0 0 44 -2,-0.3 2,-0.2 -150,-0.0 -177,-0.0 -0.944 16.1-157.3-151.4 131.5 14.8 55.4 18.3 321 21 B S > - 0 0 47 -2,-0.3 4,-2.2 1,-0.1 5,-0.1 -0.576 32.7-113.1-112.8 174.5 11.3 54.6 19.3 322 22 B S H > S+ 0 0 103 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.878 121.5 52.0 -65.5 -38.3 9.3 52.6 21.8 323 23 B Q H > S+ 0 0 164 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.887 107.2 51.8 -64.8 -43.2 8.0 50.6 18.8 324 24 B N H > S+ 0 0 32 1,-0.2 4,-2.2 2,-0.2 5,-0.3 0.947 109.7 51.7 -59.8 -42.3 11.6 50.0 17.6 325 25 B E H X S+ 0 0 38 -4,-2.2 4,-1.3 1,-0.2 -2,-0.2 0.884 108.1 49.7 -62.0 -41.6 12.5 48.8 21.1 326 26 B S H X S+ 0 0 73 -4,-2.1 4,-0.8 1,-0.2 -1,-0.2 0.928 108.5 54.9 -65.9 -43.2 9.6 46.3 21.2 327 27 B L H >< S+ 0 0 26 -4,-2.4 3,-0.8 1,-0.2 -2,-0.2 0.925 112.4 39.6 -56.5 -47.3 10.6 45.0 17.7 328 28 B I H 3< S+ 0 0 5 -4,-2.2 4,-0.3 1,-0.2 -1,-0.2 0.703 110.1 61.5 -81.3 -11.2 14.2 44.1 18.7 329 29 B S H >X S+ 0 0 12 -4,-1.3 4,-2.5 -5,-0.3 3,-0.8 0.620 75.6 97.2 -84.4 -6.6 13.1 42.9 22.1 330 30 B K H S+ 0 0 3 0, 0.0 4,-0.8 0, 0.0 -1,-0.3 0.882 115.5 46.5 -61.5 -32.2 13.5 37.2 21.0 332 32 B Y H X> S+ 0 0 18 -3,-0.8 4,-1.1 -4,-0.3 3,-0.6 0.917 109.8 50.5 -73.0 -47.6 14.1 38.3 24.6 333 33 B N H 3X S+ 0 0 77 -4,-2.5 4,-0.8 1,-0.2 3,-0.3 0.859 102.1 64.8 -61.4 -33.9 10.5 38.6 25.7 334 34 B H H >< S+ 0 0 20 -4,-1.8 3,-0.6 -5,-0.3 4,-0.2 0.868 102.0 46.6 -56.2 -41.0 9.8 35.2 24.3 335 35 B I H X< S+ 0 0 4 -4,-0.8 3,-0.9 -3,-0.6 -1,-0.3 0.757 106.6 59.1 -75.9 -21.7 12.1 33.6 26.8 336 36 B L H 3< S+ 0 0 70 -4,-1.1 -1,-0.2 -3,-0.3 -2,-0.2 0.694 82.3 85.8 -77.7 -13.3 10.4 35.7 29.5 337 37 B L T << S+ 0 0 109 -4,-0.8 -1,-0.2 -3,-0.6 -2,-0.2 0.786 99.0 36.3 -56.3 -25.2 7.1 34.0 28.4 338 38 B K S < S- 0 0 107 -3,-0.9 -1,-0.1 -4,-0.2 54,-0.0 -0.998 75.7-152.3-125.9 128.0 8.1 31.2 30.9 339 39 B P - 0 0 69 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 0.830 29.2-168.7 -69.7 -26.9 9.9 32.2 34.1 340 40 B G - 0 0 29 1,-0.2 2,-0.9 50,-0.1 -4,-0.0 -0.423 60.1 -20.4 71.9-153.2 11.6 28.9 34.4 341 41 B K S 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5,-0.2 0.912 114.8 44.0 -58.3 -49.8 19.3 40.2 32.1 372 72 B L H X S+ 0 0 9 -4,-2.7 4,-2.1 -5,-0.2 -2,-0.2 0.927 116.5 47.1 -64.8 -40.7 22.7 38.4 31.6 373 73 B H H X S+ 0 0 45 -4,-2.4 4,-1.5 -5,-0.2 -2,-0.2 0.971 114.4 44.8 -67.7 -50.4 21.3 35.0 32.4 374 74 B N H X S+ 0 0 0 -4,-2.8 4,-1.0 -5,-0.2 3,-0.3 0.918 117.3 43.9 -59.7 -46.8 18.2 35.3 30.2 375 75 B S H X S+ 0 0 0 -4,-2.2 4,-1.4 -5,-0.3 3,-0.3 0.845 107.4 60.4 -70.5 -29.3 20.0 36.6 27.2 376 76 B S H X S+ 0 0 44 -4,-2.1 4,-2.7 -5,-0.2 -1,-0.2 0.839 101.0 55.1 -66.2 -31.7 22.9 34.1 27.7 377 77 B L H X S+ 0 0 14 -4,-1.5 4,-2.6 -3,-0.3 -1,-0.2 0.856 101.9 57.6 -68.5 -30.9 20.4 31.2 27.2 378 78 B L H X S+ 0 0 3 -4,-1.0 4,-1.3 -3,-0.3 -2,-0.2 0.929 114.7 37.1 -61.6 -44.7 19.4 32.7 23.9 379 79 B I H X S+ 0 0 5 -4,-1.4 4,-3.0 2,-0.2 -2,-0.2 0.880 113.7 56.6 -73.0 -43.0 23.0 32.5 22.6 380 80 B D H X S+ 0 0 28 -4,-2.7 4,-1.5 1,-0.2 -2,-0.2 0.917 107.4 50.0 -57.0 -43.1 23.6 29.2 24.4 381 81 B D H <>S+ 0 0 7 -4,-2.6 5,-2.1 2,-0.2 4,-0.3 0.891 110.3 48.1 -68.8 -34.8 20.7 27.6 22.5 382 82 B I H ><5S+ 0 0 12 -4,-1.3 3,-1.3 1,-0.2 -2,-0.2 0.947 111.6 51.8 -67.3 -40.9 21.9 28.9 19.2 383 83 B E H 3<5S+ 0 0 4 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.769 119.1 35.2 -67.9 -26.2 25.4 27.6 20.0 384 84 B D T 3<5S- 0 0 23 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.267 105.3-127.7-105.2 7.8 24.0 24.1 20.8 385 85 B N T < 5 - 0 0 115 -3,-1.3 -3,-0.2 -4,-0.3 -4,-0.1 0.886 44.0-178.6 42.2 48.8 21.3 24.3 18.2 386 86 B A < - 0 0 6 -5,-2.1 -1,-0.2 -6,-0.1 8,-0.1 -0.554 27.1-158.9 -80.8 137.7 18.8 23.4 20.9 387 87 B P S S+ 0 0 49 0, 0.0 7,-1.6 0, 0.0 2,-0.3 0.750 72.6 38.9 -86.5 -24.9 15.1 23.0 20.0 388 88 B L E +B 393 0B 75 5,-0.2 2,-0.3 -7,-0.0 5,-0.2 -0.967 51.9 172.6-133.2 145.4 13.6 23.5 23.5 389 89 B R E > S-B 392 0B 63 3,-2.6 3,-2.1 -2,-0.3 -49,-0.0 -0.967 78.9 -5.9-151.3 129.9 14.2 25.8 26.4 390 90 B R T 3 S- 0 0 49 -2,-0.3 -50,-0.1 1,-0.3 3,-0.1 0.864 130.2 -57.8 52.8 37.3 12.0 26.1 29.5 391 91 B G T 3 S+ 0 0 76 1,-0.2 2,-0.3 -53,-0.0 -1,-0.3 0.535 119.3 90.5 74.9 4.2 9.5 23.8 27.8 392 92 B Q E < S-B 389 0B 32 -3,-2.1 -3,-2.6 -54,-0.0 -1,-0.2 -0.864 88.4 -77.7-129.4 166.6 9.0 25.9 24.7 393 93 B T E -B 388 0B 68 -2,-0.3 -5,-0.2 -5,-0.2 5,-0.1 -0.331 59.9-104.1 -58.8 134.0 10.5 26.3 21.2 394 94 B T >> - 0 0 5 -7,-1.6 3,-1.1 -8,-0.1 4,-0.6 -0.304 25.9-116.6 -62.4 150.2 13.8 28.3 21.4 395 95 B S H >>>S+ 0 0 5 1,-0.2 4,-3.5 2,-0.2 3,-1.2 0.840 110.3 60.0 -56.3 -39.2 13.7 31.9 20.3 396 96 B H H 3>5S+ 0 0 8 1,-0.3 4,-0.7 2,-0.2 -1,-0.2 0.744 101.9 54.3 -66.6 -21.4 16.1 31.5 17.4 397 97 B L H <45S+ 0 0 92 -3,-1.1 -1,-0.3 3,-0.2 -2,-0.2 0.656 118.3 34.6 -83.6 -17.2 13.8 28.9 15.8 398 98 B I H <<5S+ 0 0 82 -3,-1.2 -2,-0.2 -4,-0.6 -3,-0.1 0.820 132.8 25.8 -99.8 -48.1 10.9 31.4 15.9 399 99 B F H <5S- 0 0 35 -4,-3.5 4,-0.4 1,-0.2 -3,-0.2 0.576 114.2-110.1 -95.1 -7.2 12.6 34.7 15.3 400 100 B G X< - 0 0 23 -4,-0.7 4,-1.7 -5,-0.5 -1,-0.2 0.045 26.9 -86.2 95.0 151.1 15.6 33.4 13.4 401 101 B V H > S+ 0 0 43 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.922 120.6 57.6 -60.5 -44.4 19.3 33.1 14.4 402 102 B P H > S+ 0 0 19 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.935 110.7 39.6 -54.1 -54.2 20.2 36.7 13.2 403 103 B S H > S+ 0 0 7 -4,-0.4 4,-2.9 1,-0.2 5,-0.2 0.876 114.0 54.7 -64.4 -37.9 17.7 38.6 15.3 404 104 B T H X S+ 0 0 0 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.915 109.4 46.4 -65.0 -42.5 18.3 36.3 18.4 405 105 B I H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.942 116.0 46.4 -62.2 -46.1 22.1 36.9 18.4 406 106 B N H X S+ 0 0 4 -4,-2.1 4,-3.0 -5,-0.3 -2,-0.2 0.940 113.4 47.6 -64.2 -44.4 21.6 40.6 17.9 407 107 B T H X S+ 0 0 2 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.925 112.7 49.1 -63.7 -44.2 19.0 40.9 20.6 408 108 B A H X S+ 0 0 0 -4,-2.5 4,-1.5 -5,-0.2 -1,-0.2 0.931 112.7 47.3 -62.0 -42.7 21.0 38.8 23.1 409 109 B N H X S+ 0 0 0 -4,-2.6 4,-1.6 1,-0.2 3,-0.2 0.909 108.7 55.5 -67.3 -40.8 24.2 41.0 22.5 410 110 B Y H X S+ 0 0 0 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.894 106.2 51.6 -54.6 -42.8 22.1 44.1 22.9 411 111 B M H X S+ 0 0 12 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.836 100.8 61.7 -67.0 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2.1 23.8 52.9 37.8 422 122 B L S < S- 0 0 5 -3,-2.0 2,-0.3 1,-0.2 -1,-0.2 0.831 107.1 -6.2 -74.3 -34.8 24.9 51.0 40.9 423 123 B T - 0 0 18 -4,-0.5 -1,-0.2 -3,-0.3 66,-0.0 -0.991 41.5-151.6-155.7 162.1 27.1 53.9 42.2 424 124 B T + 0 0 132 -2,-0.3 2,-0.9 -3,-0.1 -1,-0.1 0.336 62.7 116.7-116.2 -1.0 28.5 57.3 41.4 425 125 B K > - 0 0 128 1,-0.2 4,-2.8 2,-0.1 5,-0.2 -0.602 63.9-145.6 -70.0 106.6 31.7 56.9 43.6 426 126 B E H > S+ 0 0 69 -2,-0.9 4,-1.3 1,-0.2 -1,-0.2 0.718 92.2 47.1 -49.0 -31.2 34.2 57.1 40.6 427 127 B P H > S+ 0 0 62 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.961 113.8 44.2 -77.3 -54.1 36.6 54.6 42.2 428 128 B L H > S+ 0 0 23 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.858 111.2 59.3 -53.9 -38.5 34.1 52.0 43.2 429 129 B Y H X S+ 0 0 2 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.931 103.4 49.2 -58.5 -47.9 32.6 52.5 39.7 430 130 B H H X S+ 0 0 32 -4,-1.3 4,-2.2 1,-0.2 -1,-0.2 0.872 110.5 51.7 -62.8 -33.7 35.8 51.5 38.1 431 131 B N H X S+ 0 0 93 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.912 109.3 49.3 -67.2 -45.5 36.0 48.4 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111.7 50.8 -58.8 -43.2 28.4 11.7 20.1 560 267 B L H 3<5S+ 0 0 75 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.700 97.2 68.9 -67.0 -24.2 29.5 12.4 16.5 561 268 B L H 3<5S- 0 0 99 -4,-0.9 -1,-0.2 -3,-0.4 -2,-0.2 0.790 87.6-149.4 -63.6 -30.4 26.2 11.2 15.2 562 269 B R T <<5 - 0 0 92 -3,-1.0 2,-0.2 -4,-0.7 -34,-0.2 0.925 37.3-178.6 56.0 49.0 24.4 14.3 16.7 563 270 B T < - 0 0 19 -5,-0.7 -1,-0.2 -36,-0.3 -33,-0.1 -0.492 45.5-173.3 -88.9 146.9 21.5 11.9 16.9 564 271 B S + 0 0 91 -2,-0.2 2,-0.8 -3,-0.1 -1,-0.1 0.215 53.3 121.2-111.7 12.9 18.0 12.5 18.1 565 272 B D >> - 0 0 72 1,-0.2 4,-2.3 2,-0.1 3,-1.1 -0.635 55.1-152.7 -78.4 110.8 17.3 8.7 17.9 566 273 B K H 3> S+ 0 0 102 -2,-0.8 4,-2.5 1,-0.3 5,-0.2 0.825 90.8 57.3 -55.3 -33.2 16.3 7.7 21.4 567 274 B D H 3> S+ 0 0 110 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.854 109.4 46.2 -68.6 -29.3 17.4 4.1 21.0 568 275 B I H <> S+ 0 0 49 -3,-1.1 4,-1.6 2,-0.2 -2,-0.2 0.889 111.3 51.3 -79.0 -35.5 20.9 5.3 20.2 569 276 B K H X S+ 0 0 9 -4,-2.3 4,-2.1 1,-0.2 3,-0.3 0.923 109.3 50.8 -64.1 -41.7 20.9 7.7 23.0 570 277 B L H X S+ 0 0 57 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.866 105.3 58.3 -63.7 -36.5 19.8 4.9 25.4 571 278 B K H X S+ 0 0 100 -4,-1.4 4,-1.5 2,-0.2 -1,-0.2 0.879 105.8 47.1 -60.5 -39.8 22.7 2.8 24.1 572 279 B L H X S+ 0 0 1 -4,-1.6 4,-2.3 -3,-0.3 -2,-0.2 0.917 111.3 52.4 -67.8 -42.2 25.3 5.4 25.1 573 280 B I H X S+ 0 0 5 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.888 106.1 54.2 -61.0 -34.1 23.6 5.7 28.5 574 281 B Q H X>S+ 0 0 114 -4,-2.2 4,-3.2 2,-0.2 5,-0.6 0.878 106.9 51.6 -64.4 -39.5 23.9 1.8 28.8 575 282 B I H X>S+ 0 0 23 -4,-1.5 5,-2.1 1,-0.2 4,-1.6 0.921 111.6 46.1 -63.4 -41.3 27.6 2.1 28.1 576 283 B L H <5S+ 0 0 1 -4,-2.3 6,-1.8 3,-0.2 7,-0.6 0.856 118.9 42.2 -69.4 -33.3 27.9 4.7 30.8 577 284 B E H <5S+ 0 0 45 -4,-2.3 -2,-0.2 4,-0.2 -3,-0.2 0.978 128.4 22.1 -81.3 -52.5 25.8 2.6 33.2 578 285 B F H <5S+ 0 0 173 -4,-3.2 -3,-0.2 -5,-0.1 -2,-0.2 0.778 129.0 34.3 -90.2 -29.7 27.2 -0.9 32.6 579 286 B D T < + 0 0 83 -6,-0.4 4,-1.9 -5,-0.3 -4,-0.2 0.867 47.5 153.6 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14.0 46.9 592 299 B Q H X S+ 0 0 64 -4,-2.3 4,-1.1 2,-0.2 -1,-0.2 0.879 111.4 48.5 -62.4 -36.6 31.9 14.5 47.7 593 300 B L H >X S+ 0 0 0 -4,-1.8 4,-0.6 2,-0.2 3,-0.5 0.945 112.9 45.8 -67.6 -48.8 31.6 18.2 46.7 594 301 B V H >X S+ 0 0 0 -4,-2.8 4,-2.9 1,-0.2 3,-1.5 0.886 107.8 58.6 -60.8 -40.0 28.4 18.8 48.7 595 302 B N H 3X S+ 0 0 57 -4,-2.7 4,-3.1 1,-0.3 -1,-0.2 0.805 93.9 65.7 -61.5 -29.2 30.0 17.0 51.7 596 303 B M H << S+ 0 0 5 -4,-1.1 -1,-0.3 -3,-0.5 -2,-0.2 0.784 111.7 36.1 -60.9 -26.4 32.9 19.6 51.6 597 304 B I H X< S+ 0 0 2 -3,-1.5 3,-1.7 -4,-0.6 -2,-0.2 0.849 115.2 54.5 -90.5 -44.5 30.2 22.1 52.5 598 305 B K H 3< S+ 0 0 90 -4,-2.9 -2,-0.2 1,-0.3 -3,-0.2 0.874 114.2 41.4 -56.7 -39.3 28.2 19.8 54.8 599 306 B N T 3< S+ 0 0 109 -4,-3.1 2,-1.7 -5,-0.2 3,-0.3 0.110 77.8 118.1-100.7 24.4 31.3 19.0 56.9 600 307 B D < + 0 0 18 -3,-1.7 6,-0.2 1,-0.2 -1,-0.1 -0.543 28.0 157.6 -89.1 71.7 32.6 22.6 57.0 601 308 B N S S+ 0 0 138 -2,-1.7 -1,-0.2 1,-0.2 -2,-0.0 0.910 72.9 51.8 -59.8 -45.9 32.4 22.9 60.8 602 309 B E S S- 0 0 159 -3,-0.3 -1,-0.2 1,-0.1 -2,-0.1 0.815 108.1-127.0 -62.1 -32.9 35.0 25.6 60.8 603 310 B N + 0 0 87 -6,-0.1 -2,-0.1 -3,-0.1 -1,-0.1 0.906 52.6 155.7 79.3 47.9 33.0 27.6 58.2 604 311 B K S S+ 0 0 104 1,-0.1 -105,-0.1 3,-0.1 -7,-0.1 0.775 83.3 18.1 -73.5 -26.8 36.0 27.9 56.0 605 312 B Y S S+ 0 0 22 -9,-0.1 -106,-0.3 -8,-0.1 -1,-0.1 0.735 120.1 63.9-113.3 -37.5 33.7 28.4 53.0 606 313 B L 0 0 15 -6,-0.2 -1,-0.1 -9,-0.1 -110,-0.0 -0.694 360.0 360.0 -96.3 147.4 30.4 29.3 54.6 607 314 B P 0 0 93 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.232 360.0 360.0 -63.0 360.0 29.6 32.5 56.6 608 ! 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 0.0 609 328 B D > 0 0 166 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -42.4 22.2 27.4 56.6 610 329 B E H > + 0 0 74 2,-0.2 4,-1.2 1,-0.2 5,-0.0 0.818 360.0 47.7 -73.7 -30.0 19.8 28.7 54.0 611 330 B L H > S+ 0 0 16 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.914 108.8 50.0 -74.2 -48.4 22.8 28.1 51.8 612 331 B L H > S+ 0 0 40 1,-0.2 4,-3.4 2,-0.2 5,-0.3 0.885 106.1 58.2 -60.4 -38.8 23.7 24.6 53.1 613 332 B Y H X S+ 0 0 150 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.935 106.7 47.8 -54.5 -47.1 20.0 23.7 52.5 614 333 B I H X S+ 0 0 35 -4,-1.2 4,-2.2 2,-0.2 -2,-0.2 0.927 112.5 49.8 -58.5 -48.2 20.5 24.6 48.8 615 334 B I H X S+ 0 0 0 -4,-2.2 4,-0.6 1,-0.2 3,-0.3 0.961 110.8 46.9 -55.8 -57.3 23.7 22.6 48.7 616 335 B D H >< S+ 0 0 57 -4,-3.4 3,-1.0 1,-0.2 -1,-0.2 0.841 109.4 57.3 -56.1 -34.4 22.2 19.5 50.2 617 336 B H H 3< S+ 0 0 106 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.923 100.0 56.4 -61.6 -45.4 19.3 20.0 47.8 618 337 B L H 3< S+ 0 0 14 -4,-2.2 -1,-0.3 -3,-0.3 -2,-0.2 0.619 84.8 119.6 -63.5 -11.1 21.7 19.8 44.8 619 338 B S << 0 0 30 -3,-1.0 -32,-0.1 -4,-0.6 -28,-0.0 -0.329 360.0 360.0 -60.8 132.1 22.8 16.4 46.2 620 339 B E 0 0 58 -33,-0.4 -1,-0.1 -34,-0.1 -32,-0.1 0.735 360.0 360.0-106.7 360.0 22.3 13.5 43.8