==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 11-SEP-12 3VXD . COMPND 2 MOLECULE: PUTATIVE UNCHARACTERIZED PROTEIN GBS1889; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS AGALACTIAE; . AUTHOR Y.NAKAMICHI,Y.MARUYAMA,B.MIKAMI,W.HASHIMOTO,K.MURATA . 1424 12 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 51546.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1032 72.5 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 . 89 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 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 . 59 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 141 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 698 49.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 31 2.2 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 8 4 0 0 4 0 4 0 0 0 0 13 3 6 10 4 0 0 4 0 0 0 0 0 0 0 0 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 . 25 3 4 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 ANTIPARALLEL BRIDGES PER LADDER . 8 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 M 0 0 133 0, 0.0 2,-0.2 0, 0.0 185,-0.0 0.000 360.0 360.0 360.0 150.9 11.1 2.5 32.6 2 3 A K - 0 0 176 227,-0.0 2,-0.5 184,-0.0 188,-0.1 -0.650 360.0-127.6-104.0 157.5 11.2 5.5 34.8 3 4 A I - 0 0 13 -2,-0.2 3,-0.1 186,-0.1 183,-0.0 -0.920 33.9-118.0 -99.9 126.4 8.7 7.4 36.9 4 5 A K - 0 0 56 -2,-0.5 -1,-0.0 1,-0.1 0, 0.0 -0.244 41.4 -89.1 -56.8 147.4 8.6 11.2 36.2 5 6 A P - 0 0 119 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.324 48.8-168.5 -58.1 142.2 9.5 13.4 39.2 6 7 A V - 0 0 25 -3,-0.1 2,-0.7 190,-0.1 190,-0.2 -0.955 27.6-107.4-129.8 153.8 6.5 14.4 41.4 7 8 A K - 0 0 118 188,-3.0 2,-0.9 -2,-0.3 0, 0.0 -0.724 28.7-157.8 -80.7 115.4 6.1 16.9 44.2 8 9 A V - 0 0 58 -2,-0.7 2,-0.1 231,-0.1 228,-0.1 -0.867 13.3-146.6 -93.6 106.8 5.9 15.1 47.5 9 10 A E - 0 0 18 -2,-0.9 2,-0.2 227,-0.3 230,-0.1 -0.476 20.2-111.2 -67.2 142.4 4.1 17.5 49.8 10 11 A S - 0 0 93 -2,-0.1 2,-0.6 1,-0.1 -1,-0.1 -0.510 39.6 -99.5 -67.7 142.8 5.2 17.3 53.5 11 12 A I - 0 0 8 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 -0.593 43.6-135.3 -70.1 114.2 2.5 15.9 55.7 12 13 A E S S- 0 0 112 -2,-0.6 4,-0.1 1,-0.2 -1,-0.1 -0.541 74.4 -7.3 -80.0 133.5 1.0 19.1 57.3 13 14 A N S > S- 0 0 111 -2,-0.3 3,-2.4 1,-0.1 -1,-0.2 0.919 72.0-172.9 47.8 59.0 0.3 19.1 61.0 14 15 A P T >> S+ 0 0 47 0, 0.0 4,-2.7 0, 0.0 3,-1.8 0.687 73.4 75.8 -57.8 -21.9 1.1 15.3 61.5 15 16 A K H 3> S+ 0 0 136 1,-0.3 4,-2.0 2,-0.2 5,-0.1 0.709 77.4 75.1 -60.9 -21.8 -0.1 15.4 65.1 16 17 A R H <4 S+ 0 0 52 -3,-2.4 -1,-0.3 1,-0.2 -3,-0.1 0.773 114.5 23.1 -59.1 -26.6 -3.7 15.4 63.7 17 18 A F H X4 S+ 0 0 0 -3,-1.8 3,-1.6 -4,-0.2 -2,-0.2 0.788 121.2 56.1-101.8 -48.0 -2.9 11.7 63.1 18 19 A L H 3< S+ 0 0 59 -4,-2.7 -3,-0.2 1,-0.3 -2,-0.2 0.771 103.0 55.4 -62.8 -29.5 -0.1 10.9 65.6 19 20 A N T 3< S+ 0 0 124 -4,-2.0 -1,-0.3 -5,-0.2 -3,-0.1 0.457 89.6 101.6 -85.2 2.4 -2.1 12.0 68.7 20 21 A S S < S- 0 0 40 -3,-1.6 2,-0.4 -5,-0.1 -3,-0.1 -0.347 78.2-103.7 -83.5 164.9 -5.0 9.7 67.9 21 22 A R - 0 0 200 -2,-0.1 -1,-0.1 278,-0.1 3,-0.1 -0.746 33.9-119.7 -88.8 131.9 -5.8 6.3 69.6 22 23 A L - 0 0 42 -2,-0.4 2,-0.2 1,-0.1 274,-0.1 -0.362 37.5 -97.8 -64.8 147.5 -5.1 3.2 67.6 23 24 A L - 0 0 6 1,-0.1 2,-0.2 -2,-0.0 -1,-0.1 -0.492 39.2-135.9 -69.5 135.3 -8.1 0.9 66.9 24 25 A T > - 0 0 64 -2,-0.2 4,-2.1 1,-0.1 5,-0.2 -0.486 20.0-111.6 -89.3 161.6 -8.6 -2.0 69.3 25 26 A K H > S+ 0 0 103 981,-0.7 4,-3.0 1,-0.2 5,-0.2 0.915 118.8 50.5 -54.3 -46.4 -9.4 -5.6 68.4 26 27 A I H > S+ 0 0 91 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.870 108.8 51.4 -64.4 -36.9 -12.9 -5.2 70.0 27 28 A E H > S+ 0 0 57 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.900 115.7 40.5 -65.2 -42.6 -13.7 -2.0 68.1 28 29 A V H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.928 114.3 53.2 -73.1 -45.4 -12.8 -3.6 64.7 29 30 A E H X S+ 0 0 42 -4,-3.0 4,-2.6 -5,-0.2 -2,-0.2 0.905 109.9 47.8 -53.8 -47.8 -14.5 -6.9 65.6 30 31 A E H X S+ 0 0 116 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.876 110.8 51.7 -65.8 -36.4 -17.7 -5.1 66.5 31 32 A A H X S+ 0 0 5 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.895 111.3 47.8 -63.1 -40.5 -17.6 -3.1 63.3 32 33 A I H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.914 111.4 50.4 -65.8 -44.8 -17.1 -6.3 61.3 33 34 A E H X S+ 0 0 76 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.900 110.4 49.5 -62.3 -40.2 -20.0 -7.9 63.2 34 35 A K H X S+ 0 0 50 -4,-2.3 4,-1.5 2,-0.2 -1,-0.2 0.913 111.8 48.9 -63.4 -43.5 -22.3 -5.0 62.5 35 36 A A H X S+ 0 0 7 -4,-2.0 4,-2.2 1,-0.2 3,-0.2 0.925 110.6 50.6 -60.9 -44.9 -21.3 -5.1 58.8 36 37 A L H X S+ 0 0 9 -4,-2.7 4,-2.8 1,-0.2 5,-0.2 0.834 102.9 59.0 -66.8 -33.8 -22.0 -8.9 58.6 37 38 A K H X S+ 0 0 126 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.911 109.7 44.9 -58.0 -42.3 -25.5 -8.4 60.2 38 39 A Q H X S+ 0 0 1 -4,-1.5 4,-2.9 -3,-0.2 -2,-0.2 0.899 111.7 52.2 -68.0 -42.8 -26.3 -6.2 57.3 39 40 A L H X S+ 0 0 4 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.913 108.7 50.0 -57.8 -45.9 -24.8 -8.6 54.8 40 41 A Y H X S+ 0 0 53 -4,-2.8 4,-1.1 2,-0.2 -1,-0.2 0.881 112.1 48.3 -63.5 -38.6 -26.9 -11.5 56.2 41 42 A I H X S+ 0 0 55 -4,-1.7 4,-1.3 -5,-0.2 3,-0.4 0.941 112.9 47.9 -60.6 -48.6 -30.0 -9.3 55.9 42 43 A N H X S+ 0 0 4 -4,-2.9 4,-3.3 1,-0.2 5,-0.4 0.711 100.0 66.8 -69.9 -22.4 -29.0 -8.4 52.3 43 44 A I H X S+ 0 0 5 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.940 106.0 42.0 -59.4 -47.6 -28.4 -12.0 51.4 44 45 A D H < S+ 0 0 126 -4,-1.1 -2,-0.2 -3,-0.4 -1,-0.2 0.828 117.1 49.8 -68.6 -32.8 -32.1 -12.7 51.8 45 46 A Y H < S+ 0 0 86 -4,-1.3 -2,-0.2 1,-0.1 -1,-0.2 0.914 122.0 29.3 -72.9 -47.0 -33.0 -9.5 50.1 46 47 A F H >< S+ 0 0 6 -4,-3.3 3,-2.4 1,-0.2 -2,-0.2 0.779 81.9 176.9 -83.3 -30.6 -30.7 -9.9 47.0 47 48 A G T 3< S- 0 0 33 -4,-2.4 -1,-0.2 -5,-0.4 -2,-0.1 -0.426 76.5 -17.0 57.6-125.4 -30.8 -13.8 46.8 48 49 A E T 3 S+ 0 0 132 -2,-0.2 -1,-0.3 -4,-0.1 2,-0.1 0.396 128.3 82.5 -87.7 0.7 -28.8 -14.7 43.7 49 50 A E S < S- 0 0 95 -3,-2.4 15,-0.2 15,-0.1 -3,-0.1 -0.176 75.6-113.5 -92.8-168.8 -29.1 -11.2 42.3 50 51 A Y E -A 63 0A 4 13,-2.9 13,-3.1 -2,-0.1 2,-0.1 -0.879 16.3-104.7-131.6 154.9 -27.0 -8.1 43.1 51 52 A P E -A 62 0A 3 0, 0.0 11,-0.2 0, 0.0 22,-0.1 -0.443 44.5-107.8 -66.0 151.5 -27.0 -4.6 44.6 52 53 A T E - 0 0 18 9,-1.4 287,-0.3 2,-0.2 11,-0.0 -0.349 40.1 -97.0 -68.7 162.9 -27.1 -1.6 42.2 53 54 A P E S+ 0 0 11 0, 0.0 286,-2.5 0, 0.0 287,-0.3 0.914 106.8 13.8 -49.9 -46.8 -23.8 0.4 42.1 54 55 A A E S-B 338 0B 8 284,-0.2 7,-0.5 285,-0.1 284,-0.3 -0.835 84.9-106.3-126.7 163.3 -25.2 2.9 44.6 55 56 A T E -A 60 0A 2 282,-2.7 2,-0.5 -2,-0.3 5,-0.3 -0.366 20.5-135.1 -81.3 164.9 -28.2 3.1 47.0 56 57 A F E > S-A 59 0A 105 3,-2.5 3,-1.2 1,-0.1 280,-0.1 -0.987 93.1 -14.2-122.4 115.7 -31.3 5.2 46.4 57 58 A N T 3 S- 0 0 145 -2,-0.5 -1,-0.1 1,-0.2 279,-0.1 0.885 132.8 -55.6 51.5 39.8 -32.3 7.0 49.6 58 59 A N T 3 S+ 0 0 33 1,-0.2 2,-0.4 279,-0.1 -1,-0.2 0.647 120.1 108.2 66.4 20.4 -29.8 4.5 51.3 59 60 A I E < -A 56 0A 51 -3,-1.2 -3,-2.5 259,-0.2 259,-0.2 -0.989 64.7-135.0-124.9 120.1 -31.6 1.4 49.9 60 61 A Y E -A 55 0A 1 257,-3.0 2,-0.2 -2,-0.4 -5,-0.2 -0.436 15.4-135.8 -63.4 142.1 -29.9 -0.6 47.1 61 62 A K E - 0 0 121 -7,-0.5 -9,-1.4 -2,-0.1 2,-0.5 -0.574 25.7-108.6 -87.8 166.5 -32.1 -1.7 44.3 62 63 A V E +A 51 0A 54 -2,-0.2 2,-0.3 -11,-0.2 -16,-0.0 -0.856 45.1 165.9-102.4 129.6 -31.8 -5.3 43.0 63 64 A M E -A 50 0A 26 -13,-3.1 -13,-2.9 -2,-0.5 2,-0.1 -0.871 32.4-107.0-136.0 168.4 -30.2 -5.9 39.6 64 65 A D - 0 0 89 -2,-0.3 2,-2.0 -15,-0.2 3,-0.4 -0.211 55.4 -75.0 -86.5-175.3 -28.7 -8.8 37.5 65 66 A N S S+ 0 0 15 1,-0.2 -1,-0.1 -2,-0.1 43,-0.1 -0.428 98.7 102.2 -82.4 66.9 -25.0 -9.4 36.8 66 67 A T + 0 0 43 -2,-2.0 -1,-0.2 44,-0.0 2,-0.1 0.380 54.6 82.2-134.3 0.5 -24.6 -6.6 34.2 67 68 A E S S- 0 0 55 -3,-0.4 3,-0.3 1,-0.1 45,-0.1 -0.358 82.0-109.1-100.5-176.6 -22.9 -3.5 35.8 68 69 A W S S+ 0 0 42 1,-0.2 3,-0.2 -2,-0.1 -1,-0.1 0.569 112.7 55.2 -82.7 -7.8 -19.2 -2.6 36.5 69 70 A T >> + 0 0 1 1,-0.1 3,-1.4 2,-0.1 4,-0.6 0.408 68.4 101.9-109.5 -3.2 -19.8 -3.2 40.2 70 71 A N H >> S+ 0 0 2 -3,-0.3 4,-1.2 1,-0.3 3,-1.1 0.819 76.1 62.8 -61.1 -34.5 -21.1 -6.7 40.7 71 72 A G H 3> S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.759 93.1 64.2 -59.4 -30.2 -17.8 -8.2 41.9 72 73 A F H <> S+ 0 0 0 -3,-1.4 4,-1.7 2,-0.2 -1,-0.2 0.783 98.9 53.9 -66.8 -28.3 -17.8 -5.9 44.9 73 74 A W H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 3,-0.7 0.904 109.0 53.8 -55.7 -43.2 -17.4 -12.0 55.6 81 82 A Y H 3X S+ 0 0 40 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.849 100.3 60.0 -62.1 -37.4 -16.4 -15.6 55.0 82 83 A E H 3< S+ 0 0 23 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.810 110.2 44.8 -53.4 -34.6 -12.8 -14.8 56.0 83 84 A Y H << S+ 0 0 45 -4,-1.0 -2,-0.2 -3,-0.7 -1,-0.2 0.905 132.7 9.9 -82.7 -45.9 -14.2 -13.8 59.4 84 85 A N H < S- 0 0 56 -4,-1.9 -3,-0.2 2,-0.1 -2,-0.2 0.429 80.4-135.2-121.6 -1.0 -16.6 -16.6 60.2 85 86 A Q < + 0 0 117 -4,-2.5 2,-0.5 -5,-0.3 -4,-0.1 0.753 38.6 174.2 49.9 33.1 -16.1 -19.4 57.7 86 87 A D >> - 0 0 48 -6,-0.2 4,-1.4 1,-0.2 3,-1.0 -0.586 30.6-148.5 -76.2 119.3 -19.9 -19.8 57.2 87 88 A K H 3> S+ 0 0 151 -2,-0.5 4,-2.6 1,-0.3 5,-0.2 0.766 95.7 66.9 -60.2 -27.6 -20.7 -22.3 54.5 88 89 A K H 3> S+ 0 0 87 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.920 101.8 47.3 -55.9 -46.8 -23.8 -20.3 53.7 89 90 A L H <> S+ 0 0 0 -3,-1.0 4,-3.1 1,-0.2 5,-0.3 0.926 111.5 50.0 -60.2 -49.4 -21.6 -17.4 52.5 90 91 A K H X S+ 0 0 71 -4,-1.4 4,-3.1 1,-0.2 5,-0.2 0.898 109.2 52.6 -55.4 -44.5 -19.4 -19.7 50.4 91 92 A N H X S+ 0 0 85 -4,-2.6 4,-1.3 2,-0.2 -1,-0.2 0.896 115.0 39.6 -65.1 -42.0 -22.5 -21.2 48.8 92 93 A I H X S+ 0 0 28 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.944 117.3 49.0 -68.5 -50.3 -24.0 -17.9 47.7 93 94 A A H X S+ 0 0 0 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.896 109.7 52.2 -59.9 -40.4 -20.7 -16.3 46.7 94 95 A H H X S+ 0 0 41 -4,-3.1 4,-2.3 -5,-0.3 -1,-0.2 0.880 104.9 55.3 -64.0 -37.4 -19.8 -19.4 44.7 95 96 A K H X S+ 0 0 99 -4,-1.3 4,-1.8 -5,-0.2 -1,-0.2 0.893 107.5 50.9 -59.7 -38.8 -23.1 -19.1 42.8 96 97 A N H X S+ 0 0 2 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.933 106.7 54.0 -58.8 -48.4 -22.0 -15.5 42.0 97 98 A V H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.906 107.2 50.3 -53.4 -44.1 -18.7 -16.9 40.7 98 99 A L H X S+ 0 0 68 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.878 110.0 51.3 -62.8 -36.5 -20.6 -19.3 38.4 99 100 A S H X S+ 0 0 39 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.868 108.8 50.3 -65.8 -39.6 -22.6 -16.3 37.2 100 101 A F H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.849 109.1 51.9 -65.6 -35.2 -19.3 -14.4 36.5 101 102 A L H X S+ 0 0 14 -4,-2.2 4,-2.7 -5,-0.2 -2,-0.2 0.947 111.1 47.0 -64.5 -47.8 -18.1 -17.4 34.6 102 103 A N H X S+ 0 0 79 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.890 109.6 56.0 -55.6 -43.1 -21.3 -17.4 32.5 103 104 A R H <>S+ 0 0 2 -4,-2.3 5,-2.4 1,-0.2 -1,-0.2 0.902 113.3 37.8 -60.4 -46.2 -20.9 -13.6 32.0 104 105 A I H ><5S+ 0 0 7 -4,-2.1 3,-0.8 3,-0.2 -1,-0.2 0.880 114.2 55.7 -75.4 -37.1 -17.4 -13.9 30.5 105 106 A N H 3<5S+ 0 0 73 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.905 120.2 31.6 -56.0 -43.1 -18.2 -17.1 28.6 106 107 A N T 3<5S- 0 0 97 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.193 106.2-123.1-104.1 13.2 -21.1 -15.3 26.9 107 108 A R T < 5 + 0 0 167 -3,-0.8 2,-0.6 1,-0.2 3,-0.3 0.883 43.7 177.9 43.2 55.6 -19.7 -11.7 26.8 108 109 A I < - 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0 0 50 -6,-0.2 3,-1.7 1,-0.2 4,-1.3 -0.464 30.4-152.3 -67.9 113.0 -5.5 53.2 -5.0 449 88 B K H 3> S+ 0 0 148 -2,-0.5 4,-2.8 1,-0.3 -1,-0.2 0.693 92.2 70.4 -59.3 -21.2 -6.6 55.7 -2.3 450 89 B K H 3> S+ 0 0 99 2,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.860 100.4 46.3 -62.0 -37.8 -9.9 53.9 -2.2 451 90 B L H <> S+ 0 0 0 -3,-1.7 4,-2.6 2,-0.2 5,-0.2 0.906 111.6 51.6 -69.4 -44.7 -8.2 50.9 -0.5 452 91 B K H X S+ 0 0 70 -4,-1.3 4,-2.7 2,-0.2 5,-0.3 0.921 107.1 53.8 -54.8 -48.0 -6.3 53.3 1.8 453 92 B N H X S+ 0 0 91 -4,-2.8 4,-1.3 1,-0.2 -1,-0.2 0.904 114.3 39.2 -58.8 -45.4 -9.6 54.9 2.9 454 93 B I H X S+ 0 0 20 -4,-1.5 4,-1.7 2,-0.2 -1,-0.2 0.894 116.1 51.2 -72.1 -39.6 -11.3 51.6 3.9 455 94 B A H X S+ 0 0 0 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.847 108.7 51.5 -66.9 -35.1 -8.2 50.1 5.4 456 95 B H H X S+ 0 0 44 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.857 106.4 54.5 -69.4 -34.8 -7.6 53.2 7.6 457 96 B K H X S+ 0 0 108 -4,-1.3 4,-1.6 -5,-0.3 -2,-0.2 0.857 107.2 50.9 -65.2 -35.3 -11.2 53.0 8.8 458 97 B N H X S+ 0 0 0 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.924 108.2 53.5 -58.9 -46.2 -10.3 49.4 9.8 459 98 B V H X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.895 106.9 49.6 -58.7 -43.3 -7.3 50.8 11.6 460 99 B L H X S+ 0 0 66 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.856 109.0 53.6 -65.0 -34.7 -9.6 53.3 13.5 461 100 B S H X S+ 0 0 37 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.890 108.9 49.3 -62.8 -40.9 -11.8 50.3 14.4 462 101 B F H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.856 108.3 52.1 -66.5 -38.8 -8.7 48.5 15.8 463 102 B L H X S+ 0 0 14 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.900 110.9 48.7 -63.5 -41.2 -7.6 51.6 17.8 464 103 B N H X S+ 0 0 80 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.891 109.5 53.9 -59.6 -41.5 -11.2 51.6 19.3 465 104 B R H <>S+ 0 0 3 -4,-1.9 5,-2.0 1,-0.2 -2,-0.2 0.861 112.5 41.1 -65.0 -40.3 -10.8 47.8 20.0 466 105 B I H <5S+ 0 0 12 -4,-2.1 3,-0.4 3,-0.2 -1,-0.2 0.864 113.8 53.8 -75.9 -37.6 -7.6 48.2 22.0 467 106 B N H <5S+ 0 0 78 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.889 120.0 32.6 -60.3 -43.0 -8.8 51.3 23.8 468 107 B N T <5S- 0 0 97 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.317 104.6-128.7 -99.2 4.8 -12.0 49.5 25.0 469 108 B R T > 5 - 0 0 179 -3,-0.4 3,-0.5 -4,-0.2 2,-0.5 0.870 39.7-178.3 48.9 48.6 -10.3 46.1 25.3 470 109 B I T 3 < - 0 0 68 -5,-2.0 -1,-0.2 1,-0.2 -2,-0.1 -0.680 61.4 -25.0 -86.2 123.6 -13.0 44.4 23.2 471 110 B A T 3 S+ 0 0 40 -2,-0.5 3,-0.4 1,-0.2 -1,-0.2 0.816 86.8 142.1 43.6 43.4 -12.8 40.6 22.7 472 111 B L < + 0 0 6 -3,-0.5 -1,-0.2 1,-0.2 -2,-0.1 -0.068 25.8 116.1 -99.5 31.3 -9.0 40.8 23.2 473 112 B D + 0 0 117 3,-0.0 2,-0.2 -4,-0.0 -1,-0.2 0.507 52.0 103.5 -75.5 -4.9 -9.0 37.4 25.1 474 113 B H S S- 0 0 40 -3,-0.4 3,-0.1 1,-0.1 -45,-0.0 -0.576 72.1-139.9 -78.0 140.3 -6.9 36.1 22.2 475 114 B H S S+ 0 0 85 -2,-0.2 2,-1.4 1,-0.2 3,-0.2 0.878 84.2 77.1 -63.5 -40.2 -3.1 35.6 22.8 476 115 B N > + 0 0 4 1,-0.2 4,-0.8 2,-0.1 -1,-0.2 -0.567 38.8 154.0 -91.1 86.5 -2.1 36.9 19.4 477 116 B L H > S+ 0 0 0 -2,-1.4 4,-3.1 2,-0.2 5,-0.4 0.717 74.4 67.7 -74.3 -24.5 -2.3 40.7 19.2 478 117 B G H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.938 98.5 48.9 -58.6 -49.6 0.4 40.5 16.5 479 118 B F H 4 S+ 0 0 2 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.845 117.6 43.1 -59.0 -35.7 -2.0 38.8 14.1 480 119 B L H < S+ 0 0 0 -4,-0.8 -2,-0.2 -47,-0.1 -1,-0.2 0.917 127.1 24.6 -76.2 -45.3 -4.6 41.5 14.9 481 120 B Y H X>S+ 0 0 0 -4,-3.1 5,-2.4 3,-0.2 4,-1.6 0.712 109.7 65.0-101.7 -23.2 -2.5 44.7 14.9 482 121 B T T <>S+ 0 0 1 -4,-2.5 5,-1.6 -5,-0.4 -3,-0.1 0.968 107.3 38.2 -69.5 -53.7 0.5 44.0 12.7 483 122 B P T 45S+ 0 0 0 0, 0.0 -43,-0.3 0, 0.0 -1,-0.2 0.575 130.1 33.7 -75.1 -7.0 -1.2 43.5 9.3 484 123 B S T >5S+ 0 0 0 -4,-0.1 4,-1.1 3,-0.1 -2,-0.2 0.819 132.5 15.4-108.1 -61.2 -3.7 46.3 10.0 485 124 B C H X5S+ 0 0 0 -4,-1.6 4,-2.0 2,-0.2 -3,-0.2 0.896 128.8 44.5 -89.4 -48.0 -2.1 49.0 12.1 486 125 B T H >S+ 0 0 1 -4,-1.1 4,-3.3 2,-0.2 5,-0.6 0.901 112.9 52.8 -62.5 -41.3 -0.4 51.5 7.7 489 128 B Y H X5S+ 0 0 60 -4,-2.0 4,-2.0 4,-0.2 -2,-0.2 0.924 109.8 49.0 -59.2 -44.6 2.4 53.0 9.8 490 129 B R H <5S+ 0 0 38 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.909 117.0 43.0 -56.3 -44.7 5.0 51.2 7.7 491 130 B I H <5S- 0 0 45 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.906 140.3 -4.8 -73.3 -46.1 3.3 52.5 4.5 492 131 B N H <5S- 0 0 60 -4,-3.3 -3,-0.2 -5,-0.1 -2,-0.2 0.340 87.6-112.2-138.4 5.1 2.5 56.1 5.4 493 132 B G << - 0 0 32 -4,-2.0 -4,-0.2 -5,-0.6 -3,-0.1 0.630 43.8-176.2 71.5 15.9 3.5 56.8 9.0 494 133 B D > - 0 0 38 -6,-0.6 4,-1.8 1,-0.1 -1,-0.2 -0.213 19.1-147.9 -50.7 125.1 -0.1 57.3 10.2 495 134 B V H > S+ 0 0 106 1,-0.2 4,-2.4 2,-0.2 -1,-0.1 0.776 94.6 53.8 -73.7 -29.2 0.1 58.3 13.9 496 135 B K H > S+ 0 0 96 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.824 108.4 51.5 -72.8 -31.2 -3.2 56.6 14.9 497 136 B A H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.889 111.5 47.0 -68.3 -41.7 -1.9 53.4 13.4 498 137 B L H X S+ 0 0 42 -4,-1.8 4,-2.6 2,-0.2 5,-0.2 0.913 111.6 51.8 -61.7 -45.4 1.3 53.8 15.4 499 138 B E H X S+ 0 0 73 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.901 109.9 48.4 -58.8 -45.4 -0.8 54.6 18.5 500 139 B A H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.906 112.6 49.4 -61.6 -43.6 -2.9 51.4 18.1 501 140 B T H X S+ 0 0 0 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.919 110.1 48.0 -62.4 -49.5 0.2 49.3 17.6 502 141 B I H X S+ 0 0 33 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.895 112.5 50.4 -61.7 -40.9 2.1 50.6 20.7 503 142 B K H X S+ 0 0 70 -4,-2.0 4,-1.9 -5,-0.2 -1,-0.2 0.858 110.4 49.8 -62.1 -38.5 -1.1 50.1 22.8 504 143 B A H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.931 110.7 49.8 -64.7 -45.0 -1.3 46.5 21.4 505 144 B A H X S+ 0 0 0 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.888 109.8 51.3 -58.8 -42.9 2.3 45.9 22.3 506 145 B D H X S+ 0 0 65 -4,-2.4 4,-1.7 2,-0.2 -1,-0.2 0.891 109.5 49.5 -61.9 -42.6 1.7 47.2 25.8 507 146 B K H X S+ 0 0 29 -4,-1.9 4,-1.1 1,-0.2 -1,-0.2 0.863 111.8 49.3 -64.6 -37.3 -1.2 44.9 26.3 508 147 B L H X S+ 0 0 1 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.851 106.5 57.2 -69.6 -35.7 0.9 42.0 25.0 509 148 B M H < S+ 0 0 41 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.902 107.8 45.1 -61.1 -45.6 3.7 43.0 27.4 510 149 B E H < S+ 0 0 148 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.762 111.8 54.1 -73.3 -24.9 1.6 42.7 30.6 511 150 B R H < 0 0 113 -4,-1.1 -2,-0.2 -5,-0.2 -1,-0.2 0.861 360.0 360.0 -72.9 -38.7 0.1 39.4 29.3 512 151 B Y < 0 0 74 -4,-1.9 28,-0.0 -5,-0.1 32,-0.0 -0.529 360.0 360.0 -72.1 360.0 3.6 37.8 28.9 513 ! 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 0.0 514 172 B L 0 0 114 0, 0.0 2,-0.3 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 119.6 3.5 29.0 24.9 515 173 B I > - 0 0 69 1,-0.1 3,-2.0 52,-0.0 4,-0.2 -0.945 360.0-111.9-128.1 157.9 2.2 28.2 21.3 516 174 B I T > S+ 0 0 3 44,-0.4 3,-1.9 -2,-0.3 4,-0.2 0.802 110.6 64.5 -61.3 -32.7 4.2 28.3 18.1 517 175 B D T >> S+ 0 0 18 1,-0.3 4,-1.8 2,-0.2 3,-1.4 0.579 79.5 84.3 -71.1 -6.3 2.4 31.3 16.5 518 176 B C H <> S+ 0 0 8 -3,-2.0 4,-2.2 1,-0.2 -1,-0.3 0.737 75.8 71.9 -61.1 -22.4 3.9 33.4 19.4 519 177 B L H <4 S+ 0 0 2 -3,-1.9 -1,-0.2 -4,-0.2 -2,-0.2 0.790 105.8 36.9 -61.9 -27.0 6.9 33.5 17.0 520 178 B L H X4 S+ 0 0 0 -3,-1.4 3,-1.3 -4,-0.2 4,-0.4 0.814 110.6 61.4 -89.3 -39.1 4.7 35.9 14.9 521 179 B N H >< S+ 0 0 0 -4,-1.8 3,-1.3 1,-0.2 4,-0.3 0.875 97.9 58.6 -51.0 -43.7 3.1 37.6 18.0 522 180 B I T 3X S+ 0 0 1 -4,-2.2 4,-1.9 1,-0.3 3,-0.5 0.575 82.6 80.1 -71.1 -13.4 6.5 38.9 19.2 523 181 B Q H <> S+ 0 0 0 -3,-1.3 4,-2.1 1,-0.2 -1,-0.3 0.825 87.9 60.5 -61.3 -30.9 7.2 40.8 16.0 524 182 B L H <> S+ 0 0 0 -3,-1.3 4,-1.8 -4,-0.4 -1,-0.2 0.857 104.5 48.4 -59.3 -39.6 4.9 43.4 17.6 525 183 B L H > S+ 0 0 0 -3,-0.5 4,-2.2 -4,-0.3 -2,-0.2 0.887 108.2 52.2 -71.1 -41.2 7.3 43.7 20.5 526 184 B F H X S+ 0 0 2 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.894 110.4 50.3 -60.1 -40.3 10.4 44.1 18.2 527 185 B F H X S+ 0 0 2 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.921 108.5 51.5 -60.8 -45.8 8.6 46.9 16.4 528 186 B A H X S+ 0 0 0 -4,-1.8 4,-2.4 1,-0.2 5,-0.4 0.869 109.2 51.2 -61.6 -38.3 7.8 48.6 19.8 529 187 B Y H X S+ 0 0 71 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.910 110.0 49.1 -61.8 -44.8 11.5 48.4 20.7 530 188 B E H < S+ 0 0 85 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.798 116.5 42.0 -67.7 -31.3 12.6 50.0 17.4 531 189 B Q H < S+ 0 0 72 -4,-1.9 -2,-0.2 -5,-0.1 -1,-0.2 0.913 128.1 25.8 -82.0 -45.6 10.1 52.8 17.7 532 190 B T H < S- 0 0 74 -4,-2.4 -3,-0.2 -5,-0.2 -2,-0.2 0.787 89.7-133.2 -90.6 -32.5 10.4 53.7 21.5 533 191 B G < + 0 0 50 -4,-2.2 2,-0.7 -5,-0.4 -4,-0.1 0.359 54.3 147.9 88.0 -3.7 14.0 52.5 22.2 534 192 B D >> - 0 0 79 -6,-0.4 3,-1.2 1,-0.2 4,-0.7 -0.547 39.3-156.1 -70.5 109.7 12.7 50.8 25.3 535 193 B E H 3> S+ 0 0 99 -2,-0.7 4,-2.5 1,-0.2 -1,-0.2 0.679 83.6 74.0 -62.4 -21.2 14.8 47.7 25.8 536 194 B K H 3> S+ 0 0 151 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.843 91.4 55.9 -65.3 -34.0 12.2 45.8 27.8 537 195 B Y H <> S+ 0 0 17 -3,-1.2 4,-2.0 1,-0.2 -1,-0.2 0.943 111.9 43.7 -57.9 -48.8 10.1 45.2 24.6 538 196 B R H X S+ 0 0 66 -4,-0.7 4,-2.8 2,-0.2 5,-0.2 0.884 110.5 55.0 -64.0 -41.8 13.2 43.5 23.1 539 197 B Q H X S+ 0 0 89 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.931 111.2 43.3 -59.5 -49.6 14.0 41.5 26.2 540 198 B V H X S+ 0 0 30 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.914 113.9 53.1 -61.7 -43.6 10.5 40.0 26.5 541 199 B A H X S+ 0 0 0 -4,-2.0 4,-1.4 -5,-0.2 -2,-0.2 0.927 112.8 42.7 -56.3 -50.8 10.6 39.3 22.7 542 200 B V H X S+ 0 0 5 -4,-2.8 4,-2.0 2,-0.2 3,-0.2 0.921 113.5 51.0 -64.4 -48.2 13.9 37.5 22.8 543 201 B N H X S+ 0 0 75 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.884 111.8 48.4 -57.2 -40.8 13.1 35.5 26.0 544 202 B H H X S+ 0 0 43 -4,-2.4 4,-1.7 2,-0.2 -1,-0.2 0.754 106.7 56.6 -75.5 -25.5 9.8 34.3 24.4 545 203 B F H X S+ 0 0 0 -4,-1.4 4,-3.0 -3,-0.2 -2,-0.2 0.945 111.9 41.7 -64.6 -50.4 11.5 33.3 21.2 546 204 B Y H X S+ 0 0 3 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.870 112.8 53.0 -68.6 -37.5 13.9 31.0 23.0 547 205 B A H X S+ 0 0 33 -4,-2.1 4,-0.9 -5,-0.2 5,-0.2 0.910 114.8 43.4 -61.4 -41.6 11.2 29.6 25.3 548 206 B S H >X>S+ 0 0 2 -4,-1.7 4,-2.8 2,-0.2 5,-0.8 0.931 111.9 51.5 -68.3 -49.3 9.1 28.8 22.2 549 207 B A H 3<5S+ 0 0 0 -4,-3.0 4,-0.3 1,-0.2 -1,-0.2 0.853 114.6 44.7 -56.1 -37.2 12.0 27.4 20.1 550 208 B N H 3<5S+ 0 0 38 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.671 126.9 25.0 -84.4 -17.5 12.9 25.0 23.0 551 209 B N H <<5S+ 0 0 97 -4,-0.9 -2,-0.2 -3,-0.6 -3,-0.2 0.746 120.2 45.8-117.4 -37.7 9.4 23.9 24.0 552 210 B V T <5S+ 0 0 8 -4,-2.8 8,-2.5 -5,-0.2 2,-0.5 0.694 102.3 71.5 -87.9 -21.6 7.0 24.1 21.0 553 211 B V B - 0 0 95 4,-3.3 3,-2.0 -2,-0.5 -2,-0.1 -0.383 27.5 -99.1 -87.1 169.1 10.0 18.8 19.0 555 213 B D T 3 S+ 0 0 112 1,-0.3 -186,-2.9 2,-0.1 -1,-0.1 0.735 123.5 53.1 -60.8 -27.0 13.3 16.9 18.6 556 214 B D T 3 S- 0 0 54 -188,-0.2 -1,-0.3 2,-0.1 -185,-0.2 0.317 122.9-104.1 -91.3 7.4 12.3 15.7 15.1 557 215 B S S < S+ 0 0 0 -3,-2.0 2,-0.2 1,-0.3 -2,-0.1 0.454 79.7 131.7 81.9 5.5 11.7 19.4 14.0 558 216 B S - 0 0 2 39,-0.1 -4,-3.3 1,-0.1 -1,-0.3 -0.527 55.7-115.0 -84.5 156.4 7.9 19.0 14.1 559 217 B A B L 553 0L 7 -6,-0.2 5,-0.3 5,-0.2 -6,-0.2 -0.628 360.0 360.0 -92.0 147.9 5.6 21.6 15.9 560 218 B F 0 0 139 -8,-2.5 -44,-0.4 -2,-0.2 3,-0.1 -0.650 360.0 360.0 -76.8 360.0 3.4 21.0 18.9 561 ! 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 0.0 562 243 B S 0 0 98 0, 0.0 2,-0.3 0, 0.0 49,-0.0 0.000 360.0 360.0 360.0 -47.3 0.5 14.2 14.3 563 244 B S - 0 0 0 -5,-0.1 49,-3.3 -3,-0.1 2,-0.2 -0.693 360.0-152.4-133.7 83.8 2.1 17.1 12.4 564 245 B W B > -M 611 0M 90 -5,-0.3 4,-1.6 -2,-0.3 3,-0.3 -0.347 11.3-144.1 -56.3 117.7 -0.4 20.0 12.0 565 246 B A H > S+ 0 0 0 45,-2.2 4,-2.0 1,-0.2 -1,-0.1 0.857 93.9 50.1 -60.5 -42.7 0.7 21.7 8.8 566 247 B R H > S+ 0 0 8 44,-0.5 4,-2.3 1,-0.2 -1,-0.2 0.847 107.3 55.2 -69.0 -33.6 -0.1 25.3 9.8 567 248 B G H > S+ 0 0 0 -3,-0.3 4,-1.3 2,-0.2 -1,-0.2 0.896 107.7 49.7 -60.0 -42.9 1.8 24.9 13.0 568 249 B Q H X S+ 0 0 0 -4,-1.6 4,-2.2 1,-0.2 -2,-0.2 0.908 111.3 49.7 -61.4 -43.0 4.9 23.8 11.0 569 250 B A H X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 5,-0.4 0.841 102.3 59.9 -66.0 -37.3 4.4 26.9 8.8 570 251 B W H X S+ 0 0 4 -4,-2.3 4,-2.7 1,-0.2 -1,-0.2 0.877 110.5 44.1 -57.2 -37.0 4.1 29.3 11.8 571 252 B G H X S+ 0 0 0 -4,-1.3 4,-2.7 -3,-0.2 -2,-0.2 0.931 109.0 55.7 -71.2 -45.4 7.6 28.1 12.7 572 253 B I H < S+ 0 0 0 -4,-2.2 -2,-0.2 1,-0.2 65,-0.2 0.809 122.4 28.1 -58.7 -33.1 8.9 28.3 9.1 573 254 B Y H X S+ 0 0 0 -4,-2.1 4,-1.9 2,-0.1 -2,-0.2 0.827 117.7 57.1 -95.8 -41.1 7.9 32.0 9.0 574 255 B G H X S+ 0 0 0 -4,-2.7 4,-1.9 -5,-0.4 -3,-0.2 0.867 103.4 56.0 -56.6 -39.7 8.2 32.9 12.7 575 256 B I H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.963 109.9 40.3 -63.5 -55.9 11.8 31.8 12.8 576 257 B P H > S+ 0 0 0 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.849 112.0 57.7 -64.5 -32.3 13.3 34.0 10.0 577 258 B L H X S+ 0 0 0 -4,-1.9 4,-0.5 1,-0.2 -2,-0.2 0.923 112.9 40.8 -57.9 -43.7 11.1 37.0 11.1 578 259 B S H >X S+ 0 0 0 -4,-1.9 3,-1.1 1,-0.2 4,-0.8 0.866 107.5 62.4 -71.6 -38.5 12.8 36.7 14.6 579 260 B Y H >X S+ 0 0 9 -4,-2.7 4,-3.2 1,-0.3 3,-0.8 0.866 93.8 63.8 -54.7 -40.4 16.2 36.1 13.0 580 261 B R H 3< S+ 0 0 33 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.861 112.5 35.3 -46.3 -41.9 16.0 39.6 11.4 581 262 B K H << S+ 0 0 48 -3,-1.1 -1,-0.2 -4,-0.5 -2,-0.2 0.494 130.0 30.5 -97.5 -8.3 16.0 41.0 14.9 582 263 B M H << S- 0 0 17 -4,-0.8 -3,-0.2 -3,-0.8 -2,-0.2 0.649 75.8-154.9-125.4 -29.9 18.3 38.6 16.6 583 264 B K < + 0 0 92 -4,-3.2 2,-0.6 -5,-0.2 -4,-0.1 0.854 33.9 156.8 48.8 45.1 20.8 37.3 14.0 584 265 B D >> - 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0 0 33 -4,-1.5 -4,-0.2 -5,-0.8 -3,-0.1 0.628 42.8-176.0 71.2 16.6 20.1 -15.7 40.0 851 133 C D > - 0 0 39 -6,-0.5 4,-1.7 1,-0.1 -1,-0.2 -0.199 20.2-147.3 -49.6 126.1 23.5 -17.3 39.8 852 134 C V H > S+ 0 0 107 1,-0.2 4,-2.4 2,-0.2 -1,-0.1 0.765 96.2 54.5 -73.7 -27.9 23.0 -21.0 38.8 853 135 C K H > S+ 0 0 96 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.873 107.6 51.6 -70.3 -38.9 26.1 -22.2 40.7 854 136 C A H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.911 112.6 46.0 -59.7 -44.0 24.6 -20.6 43.8 855 137 C L H X S+ 0 0 40 -4,-1.7 4,-2.8 2,-0.2 5,-0.3 0.907 109.7 54.5 -65.1 -44.0 21.3 -22.3 43.2 856 138 C E H X S+ 0 0 69 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.936 109.6 46.5 -56.0 -49.7 23.1 -25.7 42.5 857 139 C A H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.911 113.0 51.0 -58.6 -45.2 24.9 -25.5 45.9 858 140 C T H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.915 111.0 45.7 -59.2 -50.2 21.6 -24.6 47.7 859 141 C I H X S+ 0 0 34 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.914 113.2 51.0 -63.8 -42.5 19.6 -27.4 46.1 860 142 C K H X S+ 0 0 71 -4,-2.4 4,-1.8 -5,-0.3 -1,-0.2 0.891 110.7 49.2 -57.6 -42.7 22.4 -29.9 46.9 861 143 C A H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.928 110.7 50.3 -62.7 -45.1 22.5 -28.6 50.5 862 144 C A H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.888 108.7 52.1 -58.1 -42.8 18.7 -29.0 50.7 863 145 C D H X S+ 0 0 64 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.868 108.7 50.9 -62.9 -38.3 19.0 -32.6 49.4 864 146 C K H X S+ 0 0 24 -4,-1.8 4,-1.3 2,-0.2 -1,-0.2 0.872 109.2 50.6 -65.8 -39.8 21.6 -33.4 52.1 865 147 C L H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.868 107.5 53.8 -67.5 -37.9 19.3 -32.0 54.8 866 148 C M H X S+ 0 0 22 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.910 107.7 50.7 -57.8 -44.8 16.4 -34.2 53.5 867 149 C E H < S+ 0 0 127 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.757 111.6 48.0 -69.3 -26.9 18.7 -37.2 53.8 868 150 C R H < S+ 0 0 106 -4,-1.3 -1,-0.2 1,-0.1 -2,-0.2 0.916 114.8 45.3 -71.9 -47.1 19.5 -36.3 57.4 869 151 C Y H < 0 0 55 -4,-2.4 -2,-0.2 -5,-0.1 -3,-0.1 0.798 360.0 360.0 -71.0 -34.9 15.9 -35.7 58.4 870 152 C Q < 0 0 185 -4,-2.2 28,-0.0 -5,-0.2 -4,-0.0 -0.502 360.0 360.0 -76.4 360.0 14.3 -38.8 56.8 871 ! 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 0.0 872 172 C L 0 0 64 0, 0.0 49,-2.4 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 131.4 15.6 -31.7 67.5 873 173 C I B > -T 920 0T 30 47,-0.2 3,-2.2 1,-0.1 4,-0.3 -0.949 360.0-126.2-123.3 140.6 17.4 -28.4 68.0 874 174 C I T > S+ 0 0 0 45,-1.8 3,-1.9 -2,-0.4 4,-0.2 0.843 107.9 61.1 -54.2 -38.9 15.8 -25.0 68.2 875 175 C D T >> S+ 0 0 10 1,-0.3 4,-1.8 44,-0.2 3,-1.5 0.556 79.9 86.1 -70.6 -5.2 17.9 -23.5 65.4 876 176 C C H <> S+ 0 0 5 -3,-2.2 4,-2.4 1,-0.3 -1,-0.3 0.752 74.4 73.6 -60.4 -22.5 16.4 -26.1 63.1 877 177 C L H <4 S+ 0 0 1 -3,-1.9 -1,-0.3 -4,-0.3 -2,-0.2 0.772 104.9 35.6 -62.4 -26.2 13.6 -23.5 62.7 878 178 C L H X4 S+ 0 0 0 -3,-1.5 3,-1.3 -4,-0.2 4,-0.4 0.786 111.7 62.1 -91.0 -37.7 16.1 -21.5 60.6 879 179 C N H >< S+ 0 0 0 -4,-1.8 3,-1.4 1,-0.2 4,-0.4 0.876 96.3 60.1 -50.6 -43.6 17.6 -24.7 59.0 880 180 C I T 3X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.3 3,-0.4 0.603 82.9 78.6 -69.4 -13.2 14.2 -25.6 57.5 881 181 C Q H <> S+ 0 0 2 -3,-1.3 4,-2.5 1,-0.2 -1,-0.3 0.820 87.3 61.8 -63.7 -30.4 14.0 -22.4 55.4 882 182 C L H <> S+ 0 0 0 -3,-1.4 4,-2.1 -4,-0.4 -1,-0.2 0.890 105.0 47.0 -55.9 -42.2 16.4 -24.2 53.0 883 183 C L H > S+ 0 0 0 -3,-0.4 4,-2.4 -4,-0.4 -2,-0.2 0.896 109.5 51.8 -69.6 -43.8 13.7 -26.8 52.5 884 184 C F H X S+ 0 0 2 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.896 111.4 48.9 -58.3 -41.9 11.0 -24.2 51.9 885 185 C F H X S+ 0 0 2 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.937 108.9 52.0 -61.2 -47.8 13.2 -22.6 49.3 886 186 C A H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 6,-0.4 0.890 109.4 51.0 -58.2 -42.4 13.9 -25.9 47.6 887 187 C Y H X S+ 0 0 68 -4,-2.4 4,-3.3 1,-0.2 5,-0.2 0.946 109.9 48.6 -56.1 -51.9 10.1 -26.5 47.5 888 188 C E H < S+ 0 0 86 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.808 114.7 46.3 -62.8 -30.4 9.5 -23.1 45.9 889 189 C Q H < S+ 0 0 72 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.815 127.7 22.6 -80.9 -33.1 12.2 -23.7 43.3 890 190 C T H < S- 0 0 74 -4,-1.9 -2,-0.2 -3,-0.2 -3,-0.2 0.649 89.5-130.4-109.3 -24.8 11.3 -27.3 42.2 891 191 C G < + 0 0 53 -4,-3.3 2,-0.8 -5,-0.3 -4,-0.1 0.517 56.0 148.3 78.9 5.9 7.6 -27.6 43.1 892 192 C D >> - 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0 0 87 -2,-0.3 2,-1.7 -15,-0.2 3,-0.4 -0.165 53.9 -75.0 -88.0-172.3 52.3 55.2 6.8 1146 66 D N S S+ 0 0 14 1,-0.2 -1,-0.1 -2,-0.1 43,-0.0 -0.432 97.6 100.7 -86.8 65.7 48.6 56.3 7.1 1147 67 D T + 0 0 52 -2,-1.7 -1,-0.2 44,-0.0 2,-0.1 0.370 58.1 82.5-133.5 2.1 48.7 59.0 4.3 1148 68 D E S S- 0 0 67 -3,-0.4 3,-0.2 1,-0.0 -15,-0.0 -0.298 81.4-111.3 -98.5-174.0 47.1 57.5 1.2 1149 69 D W S S+ 0 0 69 1,-0.1 3,-0.2 -2,-0.1 -3,-0.0 0.507 111.1 55.4 -90.5 -5.8 43.5 57.0 -0.1 1150 70 D T >> + 0 0 0 1,-0.1 3,-1.2 2,-0.1 4,-0.6 0.411 69.6 100.7-113.6 -5.9 43.8 53.2 0.4 1151 71 D N H >> S+ 0 0 2 1,-0.3 4,-1.3 2,-0.2 3,-0.9 0.798 76.7 62.0 -58.0 -35.6 44.8 52.6 4.0 1152 72 D G H 3> S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.779 93.9 63.3 -62.6 -30.2 41.3 51.7 5.2 1153 73 D F H <> S+ 0 0 0 -3,-1.2 4,-1.6 2,-0.2 -1,-0.2 0.799 99.5 54.1 -65.9 -31.6 41.1 48.7 2.8 1154 74 D W H X S+ 0 0 0 -4,-2.1 4,-1.8 1,-0.2 3,-1.4 0.904 107.7 56.6 -62.1 -41.0 39.3 38.0 8.7 1162 82 D Y H 3X S+ 0 0 48 -4,-2.4 4,-2.8 1,-0.3 -1,-0.2 0.847 101.8 55.7 -59.9 -36.0 38.2 38.7 12.3 1163 83 D E H 3< S+ 0 0 22 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.592 107.5 50.9 -74.2 -13.8 34.6 37.9 11.3 1164 84 D Y H <4 S+ 0 0 40 -3,-1.4 -2,-0.2 -4,-0.5 -1,-0.2 0.887 132.2 7.2 -84.5 -48.2 35.7 34.5 10.0 1165 85 D N H < S- 0 0 58 -4,-1.8 -2,-0.2 2,-0.1 -3,-0.2 0.436 83.2-131.7-120.9 -1.5 37.7 33.3 13.1 1166 86 D Q < + 0 0 118 -4,-2.8 2,-0.6 -5,-0.3 -4,-0.1 0.777 40.8 172.8 52.1 33.7 37.2 35.9 15.9 1167 87 D D >> - 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