==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN/INHIBITOR 01-APR-11 3RDH . COMPND 2 MOLECULE: 14-3-3 PROTEIN ZETA/DELTA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.R.HORTON,A.K.UPADHYAY,H.FU,X.CHENG . 932 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 43289.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 793 85.1 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 . 0 0.0 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 . 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 . 15 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 91 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 660 70.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 23 2.5 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 3 0 0 0 0 0 0 0 2 6 0 1 7 2 1 2 1 2 1 0 0 3 0 0 0 1 7 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 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 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 -2 A G 0 0 49 0, 0.0 613,-0.0 0, 0.0 596,-0.0 0.000 360.0 360.0 360.0 -24.7 -88.3 35.8 28.1 2 -1 A S + 0 0 50 612,-0.0 610,-0.3 610,-0.0 609,-0.1 0.120 360.0 80.9-175.1 -3.1 -85.9 36.4 31.0 3 0 A H S S+ 0 0 39 608,-0.1 2,-0.4 609,-0.1 563,-0.1 0.701 86.4 60.9 -89.5 -21.3 -82.7 36.1 29.1 4 1 A M - 0 0 38 562,-0.0 2,-0.8 31,-0.0 3,-0.1 -0.908 60.0-161.8-113.2 134.3 -82.8 39.7 27.8 5 2 A D >> - 0 0 80 -2,-0.4 4,-1.7 1,-0.1 3,-1.2 -0.790 9.2-171.3-109.9 84.0 -82.8 42.9 29.9 6 3 A K H 3> S+ 0 0 51 -2,-0.8 4,-0.9 1,-0.3 -1,-0.1 0.721 82.3 55.6 -50.5 -22.6 -84.1 45.4 27.3 7 4 A N H 3> S+ 0 0 98 2,-0.2 4,-1.4 1,-0.2 -1,-0.3 0.845 103.9 49.8 -82.1 -33.6 -83.3 48.2 29.8 8 5 A E H <> S+ 0 0 68 -3,-1.2 4,-3.1 1,-0.2 5,-0.2 0.856 105.4 60.1 -71.0 -34.4 -79.7 47.4 30.3 9 6 A L H X S+ 0 0 27 -4,-1.7 4,-2.7 1,-0.2 -1,-0.2 0.882 104.8 48.8 -58.4 -40.8 -79.2 47.2 26.5 10 7 A V H X S+ 0 0 12 -4,-0.9 4,-2.7 2,-0.2 -1,-0.2 0.883 111.5 48.4 -68.0 -40.2 -80.3 50.9 26.3 11 8 A Q H X S+ 0 0 69 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.947 115.1 45.3 -63.6 -49.1 -77.9 52.0 29.0 12 9 A K H X S+ 0 0 82 -4,-3.1 4,-3.2 2,-0.2 -2,-0.2 0.882 111.7 52.1 -63.0 -39.3 -75.1 50.1 27.4 13 10 A A H X S+ 0 0 0 -4,-2.7 4,-1.8 -5,-0.2 -1,-0.2 0.939 112.1 46.8 -61.4 -43.0 -76.2 51.5 24.0 14 11 A K H X S+ 0 0 74 -4,-2.7 4,-1.7 1,-0.2 -2,-0.2 0.819 112.3 50.7 -66.0 -32.2 -76.0 55.0 25.7 15 12 A L H X S+ 0 0 9 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.906 106.9 52.5 -71.7 -45.0 -72.6 54.0 27.2 16 13 A A H <>S+ 0 0 0 -4,-3.2 5,-2.6 1,-0.2 -2,-0.2 0.901 107.8 54.3 -58.8 -37.2 -71.3 53.0 23.8 17 14 A E H ><5S+ 0 0 48 -4,-1.8 3,-2.4 -5,-0.2 -2,-0.2 0.958 106.2 48.7 -62.6 -50.8 -72.3 56.3 22.4 18 15 A Q H 3<5S+ 0 0 100 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.913 111.9 51.5 -53.7 -44.1 -70.5 58.4 25.0 19 16 A A T 3<5S- 0 0 2 -4,-2.2 -1,-0.3 2,-0.1 -2,-0.2 0.382 113.2-122.7 -74.8 4.6 -67.4 56.2 24.3 20 17 A E T < 5 + 0 0 138 -3,-2.4 2,-0.5 1,-0.2 -3,-0.2 0.874 69.1 135.1 52.9 41.9 -67.8 56.9 20.5 21 18 A R >< + 0 0 32 -5,-2.6 4,-2.1 1,-0.1 -1,-0.2 -0.766 22.2 168.2-119.3 80.2 -68.1 53.2 19.8 22 19 A Y H > + 0 0 50 -2,-0.5 4,-3.8 2,-0.2 5,-0.3 0.792 69.5 61.9 -69.0 -31.0 -71.0 53.1 17.4 23 20 A D H > S+ 0 0 89 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.952 111.4 42.8 -60.0 -44.5 -70.7 49.6 16.1 24 21 A D H > S+ 0 0 33 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.916 113.6 52.3 -63.4 -44.8 -71.3 48.6 19.7 25 22 A M H X S+ 0 0 0 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.923 111.1 46.0 -59.1 -44.1 -74.0 51.2 20.0 26 23 A A H X S+ 0 0 5 -4,-3.8 4,-2.6 1,-0.2 5,-0.3 0.914 108.4 56.7 -65.9 -41.5 -75.7 49.8 16.9 27 24 A A H X S+ 0 0 58 -4,-2.5 4,-1.6 -5,-0.3 -1,-0.2 0.881 108.2 48.7 -57.4 -37.3 -75.4 46.2 18.1 28 25 A C H X S+ 0 0 11 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.904 112.5 45.4 -71.5 -41.4 -77.3 47.2 21.3 29 26 A M H X S+ 0 0 0 -4,-1.8 4,-3.3 2,-0.2 5,-0.2 0.877 108.9 55.3 -70.9 -36.3 -80.2 49.0 19.6 30 27 A K H X S+ 0 0 42 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.960 112.2 45.5 -57.1 -48.5 -80.6 46.2 17.0 31 28 A S H < S+ 0 0 30 -4,-1.6 4,-0.3 -5,-0.3 -2,-0.2 0.849 111.6 51.3 -63.4 -37.0 -80.9 43.9 20.0 32 29 A V H >< S+ 0 0 0 -4,-1.9 3,-1.2 1,-0.2 5,-0.4 0.930 111.1 49.5 -66.3 -42.2 -83.3 46.3 21.8 33 30 A T H >< S+ 0 0 2 -4,-3.3 3,-2.1 1,-0.3 -2,-0.2 0.908 101.3 61.1 -62.9 -44.4 -85.5 46.4 18.7 34 31 A E T 3< S+ 0 0 17 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.596 83.3 80.7 -64.1 -5.2 -85.6 42.7 18.2 35 32 A Q T < S- 0 0 58 -3,-1.2 -1,-0.3 -4,-0.3 -2,-0.2 0.509 104.9-126.0 -76.3 -1.8 -87.4 42.5 21.6 36 33 A G < + 0 0 22 -3,-2.1 2,-0.3 1,-0.2 -2,-0.1 0.258 64.7 135.0 79.4 -12.8 -90.4 43.5 19.7 37 34 A A - 0 0 46 -5,-0.4 -1,-0.2 1,-0.1 -2,-0.1 -0.538 65.4-109.0 -75.5 131.4 -91.3 46.4 21.9 38 35 A E - 0 0 82 -2,-0.3 -1,-0.1 1,-0.1 2,-0.1 -0.329 45.3-111.9 -55.3 133.9 -92.3 49.6 20.0 39 36 A L - 0 0 13 1,-0.1 2,-0.1 4,-0.1 -1,-0.1 -0.386 19.9-128.5 -76.0 150.8 -89.4 52.0 20.5 40 37 A S > - 0 0 52 -2,-0.1 4,-2.7 1,-0.1 5,-0.2 -0.465 35.4-100.4 -87.2 165.6 -89.5 55.2 22.6 41 38 A N H > S+ 0 0 93 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.873 124.5 50.9 -58.1 -35.9 -88.4 58.4 21.0 42 39 A E H > S+ 0 0 101 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.934 112.1 46.0 -67.4 -43.1 -85.1 58.2 22.8 43 40 A E H > S+ 0 0 22 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.872 110.7 52.8 -66.2 -37.2 -84.5 54.6 21.7 44 41 A R H X S+ 0 0 26 -4,-2.7 4,-2.9 1,-0.2 -1,-0.2 0.912 110.8 48.6 -63.3 -40.6 -85.5 55.5 18.1 45 42 A N H X S+ 0 0 88 -4,-2.0 4,-2.4 -5,-0.2 5,-0.2 0.877 110.4 50.3 -66.8 -39.2 -82.9 58.3 18.3 46 43 A L H X S+ 0 0 3 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.883 113.1 46.5 -67.1 -37.7 -80.3 55.9 19.7 47 44 A L H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 5,-0.3 0.967 114.0 47.1 -66.5 -54.9 -81.0 53.5 16.8 48 45 A S H X S+ 0 0 31 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.917 115.2 45.5 -53.4 -50.1 -80.9 56.1 14.1 49 46 A V H X S+ 0 0 35 -4,-2.4 4,-2.5 -5,-0.2 5,-0.2 0.938 111.2 51.6 -62.6 -49.0 -77.7 57.7 15.3 50 47 A A H X S+ 0 0 0 -4,-2.0 4,-2.7 -5,-0.2 3,-0.4 0.976 117.1 38.1 -52.5 -61.4 -75.8 54.5 15.9 51 48 A Y H X S+ 0 0 11 -4,-2.2 4,-3.0 1,-0.2 5,-0.5 0.820 110.9 60.5 -61.7 -31.8 -76.5 53.2 12.4 52 49 A K H X S+ 0 0 121 -4,-2.3 4,-1.9 -5,-0.3 -1,-0.2 0.919 112.2 40.5 -60.3 -43.1 -76.2 56.7 10.9 53 50 A N H X S+ 0 0 49 -4,-2.5 4,-2.1 -3,-0.4 -2,-0.2 0.928 116.3 48.3 -69.2 -49.6 -72.6 56.6 12.2 54 51 A V H X S+ 0 0 8 -4,-2.7 4,-0.8 -5,-0.2 -2,-0.2 0.924 121.0 34.6 -59.6 -48.8 -71.9 53.0 11.3 55 52 A V H X S+ 0 0 2 -4,-3.0 4,-2.4 1,-0.2 3,-0.3 0.884 114.9 59.3 -74.8 -38.3 -73.2 53.2 7.7 56 53 A G H X S+ 0 0 13 -4,-1.9 4,-1.8 -5,-0.5 -2,-0.2 0.846 99.1 55.4 -59.4 -40.2 -72.0 56.8 7.3 57 54 A A H X S+ 0 0 55 -4,-2.1 4,-1.4 1,-0.2 -1,-0.2 0.884 111.7 45.3 -62.1 -38.9 -68.3 56.1 7.9 58 55 A R H X S+ 0 0 43 -4,-0.8 4,-3.3 -3,-0.3 5,-0.2 0.922 108.5 54.3 -69.8 -46.6 -68.4 53.4 5.2 59 56 A R H X S+ 0 0 44 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.867 111.9 47.3 -55.1 -35.1 -70.2 55.6 2.7 60 57 A S H X S+ 0 0 59 -4,-1.8 4,-1.7 -5,-0.2 -1,-0.2 0.819 112.3 47.7 -77.1 -31.7 -67.5 58.2 3.2 61 58 A S H X S+ 0 0 5 -4,-1.4 4,-2.5 2,-0.2 5,-0.2 0.885 109.3 55.1 -73.7 -39.2 -64.7 55.7 2.9 62 59 A W H X S+ 0 0 49 -4,-3.3 4,-3.7 2,-0.2 5,-0.2 0.938 107.6 48.7 -57.4 -50.7 -66.3 54.3 -0.3 63 60 A R H X S+ 0 0 112 -4,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.924 110.7 49.9 -57.0 -49.5 -66.4 57.7 -1.9 64 61 A V H X S+ 0 0 43 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.918 118.4 39.2 -56.6 -46.7 -62.7 58.4 -1.0 65 62 A V H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.857 109.9 59.7 -73.0 -36.0 -61.7 55.1 -2.5 66 63 A S H X S+ 0 0 19 -4,-3.7 4,-1.0 -5,-0.2 -1,-0.2 0.807 111.6 43.5 -60.6 -30.1 -64.1 55.3 -5.4 67 64 A S H >X S+ 0 0 47 -4,-1.7 4,-1.6 -5,-0.2 3,-1.2 0.973 109.5 51.1 -77.7 -64.9 -62.3 58.5 -6.4 68 65 A I H 3< S+ 0 0 57 -4,-2.2 -2,-0.2 1,-0.3 4,-0.2 0.794 106.8 60.5 -42.6 -32.5 -58.7 57.4 -5.9 69 66 A E H >< S+ 0 0 24 -4,-2.0 3,-0.5 -5,-0.2 -1,-0.3 0.946 111.8 35.6 -63.6 -48.2 -59.7 54.4 -8.0 70 67 A Q H X< S+ 0 0 115 -3,-1.2 3,-1.8 -4,-1.0 4,-0.2 0.995 113.7 53.3 -67.9 -64.8 -60.6 56.6 -11.0 71 68 A K T 3< S+ 0 0 181 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.449 113.5 49.4 -53.3 2.2 -57.9 59.3 -10.7 72 69 A T T < S+ 0 0 34 -3,-0.5 7,-0.5 -5,-0.4 -1,-0.3 -0.266 75.6 118.0-135.2 42.4 -55.5 56.4 -10.7 73 70 A E < + 0 0 63 -3,-1.8 -2,-0.1 1,-0.1 7,-0.1 0.907 58.1 71.5 -77.3 -46.8 -56.9 54.6 -13.7 74 71 A G S S+ 0 0 83 -4,-0.2 -1,-0.1 5,-0.1 -2,-0.1 0.862 94.3 60.8 -35.0 -57.0 -53.8 54.9 -15.9 75 72 A A S S- 0 0 57 1,-0.1 4,-0.2 2,-0.0 5,-0.1 -0.363 70.6-156.2 -74.3 156.2 -51.9 52.3 -13.8 76 73 A E S > S+ 0 0 163 3,-0.1 4,-4.3 2,-0.1 5,-0.3 0.890 85.6 42.6 -95.3 -71.4 -53.3 48.8 -13.4 77 74 A K H > S+ 0 0 65 2,-0.2 4,-2.1 3,-0.2 5,-0.1 0.901 119.2 47.1 -43.1 -54.1 -52.1 47.2 -10.1 78 75 A K H >> S+ 0 0 47 2,-0.2 4,-2.3 1,-0.2 3,-1.3 0.985 118.0 38.0 -54.2 -70.6 -52.7 50.5 -8.3 79 76 A Q H 3> S+ 0 0 14 -7,-0.5 4,-2.0 1,-0.3 -2,-0.2 0.919 117.0 54.4 -46.2 -48.1 -56.2 51.2 -9.5 80 77 A Q H 3X S+ 0 0 67 -4,-4.3 4,-1.1 1,-0.2 -1,-0.3 0.813 107.0 51.7 -56.4 -32.7 -56.8 47.4 -9.3 81 78 A M H XX S+ 0 0 28 -4,-2.1 4,-2.0 -3,-1.3 3,-0.5 0.945 108.5 49.0 -69.9 -49.4 -55.7 47.6 -5.7 82 79 A A H 3X S+ 0 0 3 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.808 106.0 60.0 -60.0 -31.2 -58.1 50.4 -4.9 83 80 A R H 3X S+ 0 0 91 -4,-2.0 4,-1.6 -5,-0.3 -1,-0.2 0.858 105.6 45.8 -67.1 -37.6 -60.9 48.5 -6.5 84 81 A E H S+ 0 0 2 -4,-2.3 5,-2.2 2,-0.2 4,-2.2 0.884 114.4 53.5 -66.1 -39.4 -85.3 45.5 11.6 104 101 A L H <>S+ 0 0 0 -4,-2.5 5,-1.8 -5,-0.3 -2,-0.2 0.921 116.0 35.6 -61.8 -47.0 -87.1 48.2 9.8 105 102 A E H <5S+ 0 0 50 -4,-2.6 -2,-0.2 4,-0.1 -1,-0.2 0.723 126.7 35.3 -83.1 -23.3 -89.4 45.8 7.8 106 103 A K H <5S+ 0 0 75 -4,-2.1 -3,-0.2 -5,-0.2 -2,-0.2 0.743 132.7 11.0-104.4 -25.4 -89.9 43.2 10.5 107 104 A F T X5S+ 0 0 12 -4,-2.2 4,-1.0 -5,-0.4 -3,-0.2 0.787 123.3 37.7-117.1 -59.1 -90.0 45.1 13.8 108 105 A L T >44 S- 0 0 136 1,-0.1 4,-1.1 4,-0.0 5,-0.1 -0.466 79.1-128.5 -89.9 162.0 -98.0 57.0 15.7 115 112 A A H > S+ 0 0 33 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.829 105.8 63.2 -78.3 -32.4 -97.8 58.5 12.2 116 113 A E H > S+ 0 0 63 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.887 109.5 37.5 -59.3 -42.4 -94.7 60.6 13.2 117 114 A S H > S+ 0 0 8 2,-0.2 4,-1.8 1,-0.1 -1,-0.2 0.785 112.2 58.7 -82.9 -26.1 -92.6 57.5 13.8 118 115 A K H X S+ 0 0 73 -4,-1.1 4,-2.7 2,-0.2 3,-0.3 0.961 107.5 46.2 -65.5 -47.9 -94.0 55.5 10.9 119 116 A V H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.914 110.6 56.4 -58.1 -41.3 -92.9 58.2 8.5 120 117 A F H X S+ 0 0 25 -4,-1.2 4,-1.5 -5,-0.3 -1,-0.2 0.852 110.5 41.0 -59.6 -39.4 -89.5 58.2 10.2 121 118 A Y H X S+ 0 0 3 -4,-1.8 4,-2.8 -3,-0.3 -1,-0.2 0.899 112.5 54.9 -76.5 -41.7 -88.9 54.5 9.7 122 119 A L H X S+ 0 0 1 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.866 108.6 50.5 -58.7 -33.6 -90.3 54.6 6.2 123 120 A K H X S+ 0 0 35 -4,-2.2 4,-3.0 -5,-0.2 -1,-0.2 0.916 108.1 51.0 -70.2 -42.4 -87.7 57.4 5.6 124 121 A M H X S+ 0 0 7 -4,-1.5 4,-3.0 1,-0.2 5,-0.2 0.895 107.8 54.0 -59.1 -41.5 -84.9 55.2 7.0 125 122 A K H X S+ 0 0 37 -4,-2.8 4,-1.9 1,-0.2 5,-0.3 0.927 109.0 48.6 -60.7 -42.6 -86.0 52.5 4.7 126 123 A G H X S+ 0 0 0 -4,-1.9 4,-1.8 -5,-0.2 -2,-0.2 0.947 112.1 48.7 -62.3 -48.1 -85.7 54.9 1.8 127 124 A D H X S+ 0 0 12 -4,-3.0 4,-1.6 1,-0.2 -2,-0.2 0.899 112.1 47.1 -58.6 -45.2 -82.2 56.0 3.0 128 125 A Y H X S+ 0 0 9 -4,-3.0 4,-1.6 2,-0.2 -1,-0.2 0.842 110.7 49.4 -72.4 -30.8 -80.8 52.5 3.4 129 126 A Y H X S+ 0 0 0 -4,-1.9 4,-3.2 -5,-0.2 -1,-0.2 0.883 109.2 56.3 -70.5 -33.4 -82.1 51.1 0.1 130 127 A R H X S+ 0 0 10 -4,-1.8 4,-2.4 -5,-0.3 -2,-0.2 0.880 104.7 51.3 -63.0 -37.5 -80.5 54.2 -1.4 131 128 A Y H X S+ 0 0 25 -4,-1.6 4,-0.5 2,-0.2 -1,-0.2 0.882 111.4 46.4 -67.6 -38.2 -77.2 53.2 0.2 132 129 A L H >< S+ 0 0 6 -4,-1.6 3,-1.3 1,-0.2 4,-0.2 0.928 110.6 56.0 -67.1 -41.2 -77.5 49.8 -1.3 133 130 A A H >< S+ 0 0 0 -4,-3.2 3,-1.6 1,-0.3 -2,-0.2 0.905 98.3 59.2 -56.0 -47.4 -78.4 51.5 -4.6 134 131 A E H 3< S+ 0 0 37 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.697 119.4 29.9 -57.7 -20.3 -75.3 53.6 -4.7 135 132 A V T << S+ 0 0 12 -3,-1.3 -1,-0.3 -4,-0.5 2,-0.2 0.138 91.2 123.6-126.7 19.2 -73.2 50.4 -4.7 136 133 A A < - 0 0 17 -3,-1.6 2,-0.3 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-1,-0.2 -0.767 23.3 169.1-121.2 76.8 -68.1 26.0 8.0 490 19 C Y H > S+ 0 0 56 -2,-0.5 4,-4.0 2,-0.2 5,-0.2 0.805 70.5 62.1 -64.6 -34.7 -71.2 25.9 10.1 491 20 C D H > S+ 0 0 89 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.977 111.0 42.8 -55.2 -51.5 -70.9 29.5 11.5 492 21 C D H > S+ 0 0 37 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.920 113.0 52.1 -58.1 -45.4 -71.2 30.5 7.9 493 22 C M H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.947 110.9 48.5 -56.5 -46.9 -74.0 28.0 7.3 494 23 C A H X S+ 0 0 5 -4,-4.0 4,-2.2 24,-0.2 -2,-0.2 0.888 107.2 54.3 -59.7 -44.1 -75.8 29.5 10.4 495 24 C A H X S+ 0 0 54 -4,-2.6 4,-1.7 -5,-0.2 -1,-0.2 0.900 111.9 46.5 -60.2 -36.6 -75.4 33.1 9.2 496 25 C C H X S+ 0 0 20 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.949 112.2 46.6 -71.5 -47.9 -77.0 32.0 5.9 497 26 C M H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.809 108.7 59.1 -65.4 -25.4 -79.9 30.1 7.4 498 27 C K H X S+ 0 0 29 -4,-2.2 4,-2.1 -5,-0.2 -1,-0.2 0.945 106.7 44.9 -66.1 -48.7 -80.4 33.0 9.8 499 28 C S H < S+ 0 0 36 -4,-1.7 4,-0.5 1,-0.2 -2,-0.2 0.828 109.7 57.3 -64.3 -31.4 -81.0 35.5 6.9 500 29 C V H >< S+ 0 0 0 -4,-1.8 3,-1.1 1,-0.2 5,-0.3 0.933 108.0 46.1 -65.5 -44.5 -83.3 32.9 5.3 501 30 C T H >< S+ 0 0 2 -4,-1.9 3,-1.9 1,-0.3 -2,-0.2 0.890 106.0 60.0 -64.4 -39.3 -85.5 32.8 8.3 502 31 C E T 3< S+ 0 0 12 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.610 85.2 78.7 -66.9 -9.2 -85.5 36.6 8.5 503 32 C Q T < S- 0 0 55 -3,-1.1 -1,-0.3 -4,-0.5 -2,-0.2 0.732 101.1-131.4 -70.6 -18.2 -87.0 36.7 5.1 504 33 C G < + 0 0 20 -3,-1.9 2,-0.3 1,-0.3 -2,-0.1 0.094 65.1 124.4 94.7 -26.0 -90.3 35.9 6.8 505 34 C A S S- 0 0 53 -5,-0.3 -1,-0.3 1,-0.1 -2,-0.1 -0.537 73.9-101.1 -71.9 131.2 -91.5 33.1 4.5 506 35 C E - 0 0 72 -2,-0.3 2,-0.1 1,-0.1 -1,-0.1 -0.198 47.5-102.9 -51.2 141.5 -92.2 29.9 6.5 507 36 C L - 0 0 14 1,-0.1 -1,-0.1 -3,-0.1 2,-0.0 -0.393 26.3-125.2 -72.7 142.0 -89.3 27.4 6.1 508 37 C S > - 0 0 49 -2,-0.1 4,-2.5 1,-0.1 5,-0.2 -0.333 34.4-103.2 -74.5 166.9 -89.4 24.5 3.8 509 38 C N H > S+ 0 0 101 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.898 124.9 49.5 -59.7 -38.5 -88.7 21.1 5.5 510 39 C E H > S+ 0 0 92 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.909 109.5 49.4 -67.2 -43.5 -85.2 21.2 3.9 511 40 C E H > S+ 0 0 12 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.918 108.9 54.2 -62.6 -41.5 -84.5 24.8 5.0 512 41 C R H X S+ 0 0 20 -4,-2.5 4,-2.9 1,-0.2 5,-0.3 0.930 108.1 49.1 -56.7 -47.3 -85.5 23.8 8.6 513 42 C N H X S+ 0 0 82 -4,-1.9 4,-2.6 1,-0.2 5,-0.3 0.915 111.0 50.8 -59.4 -43.1 -83.1 20.9 8.5 514 43 C L H X S+ 0 0 12 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.931 112.8 45.7 -60.3 -46.9 -80.4 23.3 7.3 515 44 C L H X S+ 0 0 1 -4,-2.9 4,-2.7 2,-0.2 5,-0.3 0.984 115.1 45.4 -58.8 -61.5 -81.2 25.8 10.1 516 45 C S H X S+ 0 0 27 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.851 116.0 46.4 -51.6 -43.7 -81.3 23.1 12.9 517 46 C V H X S+ 0 0 53 -4,-2.6 4,-1.8 -5,-0.3 -1,-0.2 0.896 111.3 51.4 -69.4 -41.5 -78.1 21.4 11.7 518 47 C A H X S+ 0 0 0 -4,-2.4 4,-2.0 -5,-0.3 -24,-0.2 0.967 117.5 38.4 -60.3 -51.0 -76.2 24.6 11.3 519 48 C Y H X>S+ 0 0 10 -4,-2.7 4,-2.6 2,-0.2 5,-0.6 0.836 108.9 60.7 -70.2 -32.5 -77.1 25.8 14.8 520 49 C K H X5S+ 0 0 83 -4,-2.2 4,-1.4 -5,-0.3 -1,-0.2 0.906 111.2 43.8 -59.3 -40.9 -76.7 22.3 16.3 521 50 C N H X5S+ 0 0 68 -4,-1.8 4,-1.8 3,-0.2 -2,-0.2 0.893 115.2 46.3 -71.4 -43.4 -73.1 22.5 15.2 522 51 C V H X5S+ 0 0 6 -4,-2.0 4,-1.4 2,-0.2 -2,-0.2 0.974 121.1 34.3 -67.4 -56.5 -72.4 26.1 16.2 523 52 C V H X5S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 5,-0.3 0.930 114.2 61.3 -65.0 -41.0 -73.9 26.0 19.7 524 53 C G H XX S+ 0 0 0 -4,-2.2 3,-0.7 2,-0.2 4,-0.6 0.938 110.4 55.1 -63.4 -47.9 -63.1 24.4 30.5 534 63 C S H >X S+ 0 0 19 -4,-3.0 4,-1.8 1,-0.3 3,-1.7 0.922 107.6 50.4 -49.7 -51.1 -65.5 24.3 33.5 535 64 C S H 3X S+ 0 0 82 -4,-2.4 4,-2.1 1,-0.3 -1,-0.3 0.801 109.3 50.8 -58.3 -32.4 -64.1 20.9 34.6 536 65 C I H << S+ 0 0 56 -4,-1.2 -1,-0.3 -3,-0.7 -2,-0.2 0.494 111.2 50.4 -84.1 -3.4 -60.5 22.3 34.4 537 66 C E H << S+ 0 0 28 -3,-1.7 3,-0.4 -4,-0.6 -2,-0.2 0.682 112.5 44.6-101.7 -27.8 -61.7 25.2 36.5 538 67 C Q H >< S+ 0 0 72 -4,-1.8 2,-2.4 1,-0.2 3,-1.1 0.899 102.7 64.5 -81.4 -45.6 -63.3 23.0 39.2 539 68 C K T 3< S+ 0 0 86 -4,-2.1 -1,-0.2 1,-0.3 -4,-0.1 -0.097 110.8 41.1 -72.0 42.8 -60.4 20.6 39.3 540 69 C T T 3 + 0 0 35 -2,-2.4 7,-0.3 -3,-0.4 -1,-0.3 0.107 59.2 146.5 179.5 43.5 -58.4 23.5 40.6 541 70 C E S < S+ 0 0 95 -3,-1.1 -2,-0.1 1,-0.1 3,-0.1 0.553 77.0 54.6 -68.2 -5.1 -60.4 25.5 43.1 542 71 C G S S+ 0 0 61 1,-0.1 2,-1.0 2,-0.0 -1,-0.1 0.929 80.0 75.5 -90.8 -76.5 -57.1 26.2 44.9 543 72 C A S > S- 0 0 61 1,-0.2 4,-2.3 2,-0.1 5,-0.4 -0.148 73.2-152.8 -44.4 86.1 -54.4 27.7 42.7 544 73 C E H > S+ 0 0 155 -2,-1.0 4,-0.9 1,-0.2 -1,-0.2 0.802 85.0 32.0 -29.2 -76.3 -55.9 31.2 42.6 545 74 C K H > S+ 0 0 134 2,-0.2 4,-2.5 1,-0.2 3,-0.5 0.915 115.5 56.2 -59.7 -47.3 -54.6 32.4 39.2 546 75 C K H > S+ 0 0 57 1,-0.3 4,-1.4 2,-0.2 -2,-0.2 0.964 112.9 41.6 -49.5 -60.0 -54.5 29.1 37.4 547 76 C Q H X S+ 0 0 5 -4,-2.3 4,-0.9 -7,-0.3 -1,-0.3 0.700 111.3 61.9 -61.7 -18.4 -58.2 28.5 38.1 548 77 C Q H >X S+ 0 0 61 -4,-0.9 4,-2.4 -3,-0.5 3,-1.6 0.982 97.9 52.3 -70.2 -58.9 -58.7 32.2 37.2 549 78 C M H 3X S+ 0 0 17 -4,-2.5 4,-1.7 1,-0.3 5,-0.2 0.881 109.8 51.1 -41.5 -49.1 -57.5 32.0 33.7 550 79 C A H 3X S+ 0 0 4 -4,-1.4 4,-2.4 -5,-0.2 -1,-0.3 0.794 108.9 51.4 -61.8 -30.5 -59.9 29.1 33.1 551 80 C R H S+ 0 0 4 -4,-2.5 4,-2.3 1,-0.2 5,-2.1 0.936 113.7 52.0 -55.7 -43.8 -85.6 33.6 15.1 572 101 C L H <>S+ 0 0 0 -4,-2.8 5,-2.4 3,-0.2 -2,-0.2 0.904 113.5 40.4 -59.9 -47.2 -87.9 31.2 16.9 573 102 C E H <5S+ 0 0 51 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.835 125.1 33.4 -75.9 -32.4 -90.1 33.8 18.5 574 103 C K H <5S+ 0 0 74 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.871 135.5 6.9 -92.8 -38.5 -90.4 36.2 15.6 575 104 C F T X5S+ 0 0 16 -4,-2.3 4,-0.8 -5,-0.5 -3,-0.2 0.852 123.3 42.5-110.9 -53.4 -90.3 34.0 12.5 576 105 C L H >> S- 0 0 118 1,-0.1 4,-1.1 -3,-0.0 5,-0.1 -0.821 78.4-131.2-121.5 161.8 -98.2 22.4 10.7 583 112 C A H > S+ 0 0 31 -2,-0.3 4,-1.7 2,-0.2 5,-0.2 0.890 106.4 52.9 -77.6 -41.0 -98.4 20.6 14.0 584 113 C E H > S+ 0 0 71 1,-0.2 4,-1.6 2,-0.2 -1,-0.1 0.933 111.9 43.5 -60.7 -48.6 -95.2 18.6 13.5 585 114 C S H > S+ 0 0 10 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.814 111.1 55.1 -69.6 -29.8 -93.1 21.7 12.7 586 115 C K H X S+ 0 0 75 -4,-1.1 4,-1.8 2,-0.2 -1,-0.2 0.841 107.5 49.0 -72.7 -31.5 -94.5 23.8 15.5 587 116 C V H X S+ 0 0 0 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.883 109.1 56.8 -71.2 -36.2 -93.7 21.1 18.1 588 117 C F H X S+ 0 0 32 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.950 110.4 39.7 -56.9 -57.7 -90.2 21.0 16.6 589 118 C Y H X S+ 0 0 4 -4,-2.0 4,-3.9 2,-0.2 -1,-0.2 0.888 113.6 54.1 -62.7 -42.7 -89.4 24.8 17.1 590 119 C L H X S+ 0 0 1 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.889 110.4 48.6 -59.4 -37.1 -91.1 24.8 20.5 591 120 C K H X S+ 0 0 37 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.914 111.7 49.3 -66.6 -40.6 -88.7 22.0 21.3 592 121 C M H X S+ 0 0 9 -4,-2.2 4,-2.4 1,-0.2 5,-0.3 0.915 107.2 54.6 -62.4 -44.6 -86.0 24.1 19.9 593 122 C K H X S+ 0 0 38 -4,-3.9 4,-1.9 1,-0.2 5,-0.2 0.920 108.8 49.2 -56.1 -43.6 -87.1 27.0 22.0 594 123 C G H X S+ 0 0 0 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.848 109.4 50.8 -66.1 -35.3 -86.8 24.8 25.1 595 124 C D H X S+ 0 0 6 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.928 111.8 46.1 -68.8 -46.4 -83.3 23.5 24.3 596 125 C Y H X S+ 0 0 2 -4,-2.4 4,-1.7 2,-0.3 -2,-0.2 0.840 113.3 47.8 -69.4 -31.4 -81.9 27.0 23.7 597 126 C Y H X S+ 0 0 0 -4,-1.9 4,-2.6 -5,-0.3 -1,-0.2 0.895 112.2 53.2 -71.6 -35.5 -83.4 28.4 26.8 598 127 C R H X S+ 0 0 11 -4,-1.7 4,-1.7 -5,-0.2 -2,-0.3 0.882 105.6 52.3 -62.1 -41.0 -82.1 25.3 28.5 599 128 C Y H X S+ 0 0 7 -4,-2.3 4,-0.6 1,-0.2 -1,-0.2 0.892 111.3 46.3 -64.9 -38.7 -78.6 26.1 27.1 600 129 C L H >X S+ 0 0 3 -4,-1.7 3,-1.2 1,-0.2 4,-0.7 0.897 108.2 57.0 -68.9 -38.1 -78.8 29.6 28.6 601 130 C A H >< S+ 0 0 9 -4,-2.6 3,-0.5 1,-0.3 -2,-0.2 0.837 100.0 60.2 -60.9 -31.9 -80.1 28.1 31.8 602 131 C E H 3< S+ 0 0 44 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.723 117.0 29.1 -69.4 -21.2 -76.9 25.9 32.0 603 132 C V H << S+ 0 0 11 -3,-1.2 -1,-0.2 -4,-0.6 -2,-0.2 0.253 93.8 122.4-123.3 12.3 -74.6 29.0 32.1 604 133 C A << - 0 0 25 -4,-0.7 2,-0.1 -3,-0.5 5,-0.1 -0.436 63.2-113.9 -78.7 148.4 -76.9 31.6 33.8 605 134 C A >> - 0 0 56 -2,-0.1 4,-1.1 1,-0.1 3,-0.9 -0.437 34.9-105.5 -75.4 153.6 -76.1 33.4 37.0 606 135 C G H >> S+ 0 0 66 1,-0.2 3,-1.3 2,-0.2 4,-0.6 0.900 114.2 64.1 -44.9 -53.8 -78.2 32.7 40.0 607 136 C D H 34 S+ 0 0 154 1,-0.3 4,-0.2 2,-0.1 -1,-0.2 0.803 117.3 24.2 -41.3 -46.6 -80.2 35.9 39.8 608 137 C D H <> S+ 0 0 94 -3,-0.9 4,-2.0 1,-0.1 -1,-0.3 0.379 94.9 99.7-106.2 4.3 -81.8 35.2 36.5 609 138 C K H S+ 0 0 22 -4,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.919 117.6 42.9 -48.9 -48.4 -86.8 33.0 34.9 612 141 C I H X S+ 0 0 12 -4,-2.0 4,-1.9 -610,-0.3 3,-0.5 0.977 113.1 50.9 -61.2 -56.8 -84.7 31.4 32.2 613 142 C V H X S+ 0 0 8 -4,-3.7 4,-1.9 1,-0.3 -1,-0.2 0.797 109.9 54.1 -49.8 -31.8 -85.3 27.9 33.6 614 143 C D H X S+ 0 0 55 -4,-2.7 4,-2.4 -5,-0.3 -1,-0.3 0.907 102.4 54.6 -71.5 -45.0 -89.0 28.9 33.5 615 144 C Q H X S+ 0 0 38 -4,-2.0 4,-1.6 -3,-0.5 -2,-0.2 0.879 109.7 48.8 -56.6 -40.1 -88.9 29.9 29.8 616 145 C S H X S+ 0 0 0 -4,-1.9 4,-2.7 2,-0.2 5,-0.2 0.958 109.6 50.2 -65.5 -52.3 -87.5 26.5 28.9 617 146 C Q H X S+ 0 0 49 -4,-1.9 4,-3.0 1,-0.2 -2,-0.2 0.909 110.2 49.2 -53.0 -49.1 -90.0 24.5 30.9 618 147 C Q H X S+ 0 0 110 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.881 111.5 50.0 -62.1 -37.2 -93.0 26.3 29.4 619 148 C A H X S+ 0 0 3 -4,-1.6 4,-1.9 -5,-0.2 -2,-0.2 0.929 113.7 44.5 -66.9 -44.8 -91.6 25.8 25.9 620 149 C Y H X S+ 0 0 0 -4,-2.7 4,-1.5 2,-0.2 -2,-0.2 0.937 113.2 52.7 -63.8 -45.4 -91.0 22.1 26.4 621 150 C Q H X S+ 0 0 63 -4,-3.0 4,-2.2 -5,-0.2 3,-0.4 0.937 110.1 45.3 -55.4 -53.6 -94.4 21.7 28.1 622 151 C E H X S+ 0 0 84 -4,-2.3 4,-2.1 1,-0.3 -1,-0.2 0.887 112.8 51.2 -59.8 -40.3 -96.4 23.3 25.3 623 152 C A H X S+ 0 0 0 -4,-1.9 4,-1.4 1,-0.2 -1,-0.3 0.774 108.9 54.0 -67.0 -26.1 -94.5 21.3 22.7 624 153 C F H X S+ 0 0 52 -4,-1.5 4,-2.0 -3,-0.4 -2,-0.2 0.911 106.9 49.8 -73.2 -44.7 -95.4 18.3 24.8 625 154 C E H < S+ 0 0 95 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.1 0.922 111.7 47.3 -61.2 -47.5 -99.1 19.0 24.7 626 155 C I H >X S+ 0 0 38 -4,-2.1 4,-0.8 1,-0.2 3,-0.8 0.842 115.0 45.2 -65.9 -34.2 -99.3 19.5 21.0 627 156 C S H 3X S+ 0 0 0 -4,-1.4 4,-1.4 1,-0.2 -1,-0.2 0.795 105.5 61.6 -80.2 -27.0 -97.3 16.3 20.2 628 157 C K H 3< S+ 0 0 85 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.234 117.8 30.5 -80.8 14.6 -99.3 14.3 22.7 629 158 C K H <4 S+ 0 0 169 -3,-0.8 -2,-0.2 -5,-0.1 -1,-0.2 0.405 127.4 35.3-147.3 -9.7 -102.4 15.1 20.6 630 159 C E H < S+ 0 0 127 -4,-0.8 2,-0.3 1,-0.1 -3,-0.2 0.428 111.7 53.5-127.8 -6.5 -101.2 15.4 17.0 631 160 C M S < S- 0 0 20 -4,-1.4 -1,-0.1 -5,-0.2 0, 0.0 -0.940 78.1-113.7-133.2 154.2 -98.4 12.8 16.8 632 161 C Q > - 0 0 114 -2,-0.3 3,-2.7 1,-0.1 6,-0.2 -0.562 35.1-111.4 -83.1 150.8 -98.1 9.1 17.6 633 162 C P T 3 S+ 0 0 20 0, 0.0 37,-0.2 0, 0.0 -1,-0.1 0.641 118.5 58.9 -55.5 -12.9 -95.8 8.0 20.5 634 163 C T T 3 S+ 0 0 12 35,-0.1 55,-0.1 36,-0.1 36,-0.1 0.566 73.5 116.4 -94.4 -9.7 -93.5 6.6 17.8 635 164 C H <> - 0 0 42 -3,-2.7 4,-2.8 1,-0.1 3,-0.4 -0.433 66.8-136.7 -62.2 121.2 -92.9 9.9 15.9 636 165 C P H > S+ 0 0 30 0, 0.0 4,-3.8 0, 0.0 5,-0.2 0.885 101.6 52.7 -45.0 -50.2 -89.2 10.7 16.2 637 166 C I H > S+ 0 0 23 2,-0.2 4,-2.6 1,-0.2 5,-0.1 0.904 111.3 45.5 -57.8 -43.2 -89.8 14.4 17.0 638 167 C R H > S+ 0 0 17 -3,-0.4 4,-2.5 2,-0.2 -1,-0.2 0.937 115.8 46.3 -66.3 -43.7 -92.2 13.6 19.8 639 168 C L H X S+ 0 0 2 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.914 112.2 52.2 -62.5 -39.3 -89.8 11.0 21.1 640 169 C G H X S+ 0 0 4 -4,-3.8 4,-2.1 -5,-0.3 5,-0.3 0.894 109.0 49.8 -62.6 -39.9 -87.0 13.5 20.7 641 170 C L H X S+ 0 0 0 -4,-2.6 4,-2.5 -5,-0.2 5,-0.3 0.903 110.1 50.3 -65.2 -41.1 -89.1 16.0 22.6 642 171 C A H X S+ 0 0 1 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.919 109.5 53.0 -62.2 -43.7 -89.6 13.5 25.4 643 172 C L H X S+ 0 0 21 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.982 116.3 35.3 -54.5 -65.4 -85.9 12.8 25.5 644 173 C N H X S+ 0 0 28 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.833 114.6 56.1 -61.6 -36.4 -84.7 16.4 25.9 645 174 C F H X S+ 0 0 0 -4,-2.5 4,-2.0 -5,-0.3 -1,-0.2 0.938 110.6 46.9 -62.5 -42.1 -87.7 17.4 28.1 646 175 C S H X S+ 0 0 0 -4,-2.4 4,-2.2 -5,-0.3 -2,-0.2 0.893 109.4 52.4 -66.7 -37.9 -86.7 14.6 30.4 647 176 C V H X>S+ 0 0 17 -4,-2.2 4,-3.2 -5,-0.2 5,-0.6 0.902 106.5 57.3 -63.1 -36.2 -83.0 15.6 30.3 648 177 C F H X>S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 5,-1.6 0.943 107.4 44.3 -57.0 -54.8 -84.3 19.1 31.3 649 178 C Y H <5S+ 0 0 15 -4,-2.0 6,-2.8 3,-0.2 -1,-0.2 0.906 120.0 42.9 -57.1 -45.3 -86.1 17.9 34.5 650 179 C Y H <5S+ 0 0 79 -4,-2.2 -2,-0.2 4,-0.2 -1,-0.2 0.962 125.9 27.7 -68.0 -56.7 -83.1 15.8 35.5 651 180 C E H <5S+ 0 0 83 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.2 0.863 134.2 27.7 -77.7 -37.9 -80.2 18.1 34.7 652 181 C I T < - 0 0 21 -6,-2.8 4,-1.3 1,-0.1 3,-0.2 -0.762 32.9-179.5-120.4 85.6 -85.6 16.4 39.8 656 185 C P H > S+ 0 0 46 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.690 77.0 66.0 -55.1 -22.0 -84.7 12.8 38.8 657 186 C E H > S+ 0 0 136 2,-0.2 4,-2.2 1,-0.2 3,-0.2 0.997 103.3 39.6 -65.8 -64.6 -88.3 11.7 39.6 658 187 C K H > S+ 0 0 109 1,-0.2 4,-1.5 -3,-0.2 5,-0.3 0.784 114.8 60.6 -56.1 -26.5 -90.2 13.7 36.9 659 188 C A H X S+ 0 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C E H 3> S+ 0 0 154 1,-0.3 4,-0.6 2,-0.3 5,-0.3 0.698 116.9 83.4 -50.2 -18.3 -89.7 1.9 7.8 680 209 C E H 34 S+ 0 0 82 1,-0.2 -1,-0.3 2,-0.1 -3,-0.0 0.363 119.0 7.3 -67.8 9.0 -90.3 5.7 7.7 681 210 C S H <>>S+ 0 0 21 -3,-1.6 4,-1.9 3,-0.1 5,-0.8 0.307 95.3 114.1-161.2 -20.7 -89.4 5.3 11.3 682 211 C Y H <5S+ 0 0 42 -4,-1.8 4,-0.5 1,-0.3 -3,-0.1 0.801 104.7 13.8 -28.1 -55.0 -88.3 1.6 11.7 683 212 C K T X5S+ 0 0 57 -4,-0.6 4,-2.4 2,-0.1 -1,-0.3 0.789 125.8 62.9 -95.1 -34.1 -84.8 2.9 12.5 684 213 C D H >5S+ 0 0 87 -5,-0.3 4,-1.0 2,-0.2 -2,-0.2 0.961 108.1 38.4 -55.1 -61.5 -85.7 6.5 13.1 685 214 C S H >X5S+ 0 0 5 -4,-1.9 4,-2.0 1,-0.2 3,-0.9 0.925 116.1 52.4 -58.0 -49.0 -87.9 6.1 16.1 686 215 C T H 3>X S+ 0 0 61 -4,-3.3 4,-2.2 1,-0.2 3,-0.8 0.914 112.2 43.3 -59.5 -44.1 -80.6 3.2 32.6 698 227 C L H 3< S+ 0 0 116 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.833 104.5 62.5 -72.1 -33.4 -78.0 5.8 33.8 699 228 C W T 3< S+ 0 0 27 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.106 114.2 39.5 -78.7 25.6 -80.5 7.7 35.9 700 229 C T T <4 0 0 110 -3,-0.8 -2,-0.2 -5,-0.2 -1,-0.2 0.508 360.0 360.0-133.6 -62.0 -80.8 4.5 37.8 701 230 C S < 0 0 122 -4,-2.2 -1,-0.0 0, 0.0 0, 0.0 -0.021 360.0 360.0 -55.0 360.0 -77.4 2.8 38.2 702 !* 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 0.0 703 -2 D G 0 0 57 0, 0.0 4,-0.0 0, 0.0 -325,-0.0 0.000 360.0 360.0 360.0 -15.0 -39.9 35.9 0.0 704 -1 D S + 0 0 52 -326,-0.0 -326,-0.3 -324,-0.0 3,-0.1 0.160 360.0 83.8-171.8 -1.7 -42.3 36.3 -2.9 705 0 D H S S+ 0 0 34 1,-0.2 2,-0.3 -328,-0.1 -373,-0.1 0.685 94.9 30.4 -89.1 -21.3 -45.7 36.2 -1.0 706 1 D M - 0 0 42 -374,-0.0 2,-0.7 31,-0.0 -1,-0.2 -0.898 64.4-147.4-149.7 121.4 -45.9 39.8 0.0 707 2 D D > - 0 0 92 -2,-0.3 4,-1.5 1,-0.2 3,-0.4 -0.720 7.8-154.0 -85.8 112.4 -44.7 43.1 -1.5 708 3 D K H > S+ 0 0 56 -2,-0.7 4,-1.9 1,-0.2 3,-0.2 0.860 93.8 54.8 -51.5 -43.6 -43.7 45.7 1.1 709 4 D N H > S+ 0 0 96 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.897 105.4 51.7 -62.4 -40.9 -44.4 48.6 -1.3 710 5 D E H > S+ 0 0 93 -3,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.836 107.6 53.6 -66.3 -30.4 -48.0 47.4 -2.1 711 6 D L H X S+ 0 0 30 -4,-1.5 4,-3.5 2,-0.2 -1,-0.2 0.917 106.5 51.9 -68.4 -41.9 -48.7 47.3 1.7 712 7 D V H X S+ 0 0 4 -4,-1.9 4,-2.7 2,-0.2 5,-0.2 0.923 111.3 46.5 -59.7 -45.0 -47.5 50.9 2.1 713 8 D Q H X S+ 0 0 70 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.894 111.7 52.1 -64.7 -37.3 -49.9 52.0 -0.7 714 9 D K H X S+ 0 0 56 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.950 110.2 49.8 -61.6 -45.0 -52.5 49.8 1.0 715 10 D A H X S+ 0 0 0 -4,-3.5 4,-1.8 1,-0.2 -2,-0.2 0.890 111.7 46.0 -59.2 -44.9 -51.7 51.7 4.2 716 11 D K H X S+ 0 0 54 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.869 110.4 53.5 -69.0 -36.7 -52.0 55.2 2.6 717 12 D L H X S+ 0 0 9 -4,-2.5 4,-1.7 -5,-0.2 5,-0.2 0.987 109.1 49.7 -59.5 -54.8 -55.2 54.3 0.8 718 13 D A H <>S+ 0 0 0 -4,-2.6 5,-2.5 1,-0.2 -2,-0.2 0.847 107.9 53.9 -52.1 -39.8 -56.6 53.3 4.2 719 14 D E H ><5S+ 0 0 56 -4,-1.8 3,-2.6 1,-0.2 -1,-0.2 0.966 105.9 52.0 -61.0 -50.4 -55.5 56.5 5.8 720 15 D Q H 3<5S+ 0 0 112 -4,-2.3 -1,-0.2 1,-0.3 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0.979 112.3 45.3 -63.3 -54.3 -50.8 47.4 6.9 731 26 D M H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.803 109.2 57.3 -60.0 -28.2 -48.0 49.2 8.6 732 27 D K H X S+ 0 0 25 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.962 108.3 46.9 -65.8 -48.1 -47.6 46.2 11.0 733 28 D S H X S+ 0 0 31 -4,-2.2 4,-0.8 1,-0.2 -2,-0.2 0.900 110.6 53.2 -57.9 -41.6 -47.1 44.0 8.0 734 29 D V H >< S+ 0 0 0 -4,-2.4 3,-0.8 1,-0.2 5,-0.5 0.925 109.4 47.8 -60.6 -44.9 -44.6 46.6 6.6 735 30 D T H >< S+ 0 0 1 -4,-2.4 3,-1.8 1,-0.2 -1,-0.2 0.894 106.3 56.9 -62.5 -42.3 -42.6 46.6 9.8 736 31 D E H 3< S+ 0 0 14 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.670 84.4 82.6 -65.2 -15.3 -42.5 42.8 10.0 737 32 D Q T << S- 0 0 51 -3,-0.8 -1,-0.3 -4,-0.8 -2,-0.2 0.584 105.0-125.3 -65.5 -7.4 -40.9 42.8 6.5 738 33 D G < + 0 0 28 -3,-1.8 2,-0.3 1,-0.2 -2,-0.1 0.359 65.5 125.6 83.6 -3.7 -37.7 43.4 8.5 739 34 D A - 0 0 47 -5,-0.5 -1,-0.2 1,-0.1 -2,-0.1 -0.661 70.0-105.3 -91.9 143.8 -36.4 46.6 6.9 740 35 D E - 0 0 71 -2,-0.3 2,-0.1 1,-0.1 74,-0.1 -0.421 53.0-107.1 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0.940 108.1 48.1 -56.4 -46.8 -40.0 63.3 24.1 876 171 D A H X S+ 0 0 3 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.840 108.8 54.9 -64.1 -34.7 -39.8 65.8 26.9 877 172 D L H X S+ 0 0 17 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.971 115.5 34.0 -65.1 -55.9 -43.6 66.5 26.8 878 173 D N H X S+ 0 0 33 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.873 116.1 57.3 -69.4 -34.4 -44.8 62.9 27.2 879 174 D F H X S+ 0 0 1 -4,-2.3 4,-1.6 -5,-0.4 -1,-0.2 0.930 111.0 43.7 -60.8 -41.5 -41.9 62.1 29.5 880 175 D S H X S+ 0 0 0 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.816 110.9 54.9 -71.8 -28.5 -43.1 65.0 31.7 881 176 D V H X>S+ 0 0 15 -4,-1.8 4,-2.5 2,-0.2 5,-0.6 0.832 105.0 55.4 -71.3 -30.6 -46.7 63.7 31.3 882 177 D F H X>S+ 0 0 0 -4,-2.4 5,-1.8 3,-0.2 4,-1.7 0.932 107.4 46.8 -66.1 -48.8 -45.5 60.4 32.6 883 178 D Y H <5S+ 0 0 16 -4,-1.6 6,-1.1 3,-0.2 -2,-0.2 0.889 120.5 39.5 -61.6 -40.6 -44.0 61.8 35.8 884 179 D Y H <5S+ 0 0 80 -4,-1.7 4,-0.2 4,-0.2 -2,-0.2 0.989 127.2 28.3 -73.8 -63.0 -47.1 63.8 36.4 885 180 D E H <5S+ 0 0 90 -4,-2.5 -3,-0.2 -5,-0.2 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