==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN 20-OCT-04 1XT0 . COMPND 2 MOLECULE: GUANINE NUCLEOTIDE EXCHANGE PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: LEGIONELLA PNEUMOPHILA; . AUTHOR J.C.AMOR,J.SWAILS,C.R.ROY,H.NAGAI,A.INGMUNDSON,X.CHENG, . 203 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11120.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 142 70.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 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 . 1 0.5 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 . 8 3.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 108 53.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 0 1 0 1 1 0 1 2 1 1 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 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 -1 B G 0 0 99 0, 0.0 2,-0.3 0, 0.0 80,-0.0 0.000 360.0 360.0 360.0 84.9 -20.4 14.7 107.5 2 0 B A - 0 0 71 0, 0.0 2,-0.2 0, 0.0 45,-0.1 -0.989 360.0-118.7-149.5 155.5 -20.0 13.6 111.1 3 1 B S - 0 0 17 -2,-0.3 40,-0.0 1,-0.1 41,-0.0 -0.536 48.4 -82.8 -90.6 159.6 -17.3 12.7 113.6 4 2 B H >> - 0 0 47 -2,-0.2 4,-2.4 1,-0.1 3,-1.0 -0.353 45.3-114.5 -58.7 139.1 -16.9 9.3 115.2 5 3 B P H 3> S+ 0 0 78 0, 0.0 4,-1.7 0, 0.0 -1,-0.1 0.796 116.0 53.2 -47.3 -34.6 -19.3 9.1 118.2 6 4 B E H 3> S+ 0 0 53 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.860 108.6 48.0 -71.4 -36.4 -16.4 8.9 120.7 7 5 B I H <4 S+ 0 0 0 -3,-1.0 4,-0.4 1,-0.2 3,-0.2 0.914 110.4 53.8 -67.3 -41.9 -14.8 12.1 119.2 8 6 B E H >< S+ 0 0 106 -4,-2.4 3,-0.8 1,-0.2 4,-0.2 0.878 108.1 49.3 -58.9 -39.9 -18.2 13.7 119.5 9 7 B K H 3< S+ 0 0 134 -4,-1.7 3,-0.3 1,-0.2 -1,-0.2 0.801 116.3 41.7 -71.2 -29.7 -18.5 12.8 123.2 10 8 B A T 3X S+ 0 0 22 -4,-1.4 4,-2.2 -3,-0.2 3,-0.4 0.255 80.0 114.6-101.4 11.5 -15.0 14.1 124.0 11 9 B Q H <> S+ 0 0 56 -3,-0.8 4,-2.9 -4,-0.4 5,-0.2 0.836 71.5 56.1 -50.4 -42.5 -15.3 17.3 121.8 12 10 B R H > S+ 0 0 184 -3,-0.3 4,-2.4 -4,-0.2 5,-0.2 0.934 110.4 43.9 -58.9 -46.9 -15.2 19.7 124.8 13 11 B E H > S+ 0 0 109 -3,-0.4 4,-2.2 1,-0.2 -1,-0.2 0.897 114.7 50.4 -65.3 -40.4 -11.8 18.3 126.0 14 12 B I H X S+ 0 0 2 -4,-2.2 4,-2.8 -7,-0.2 -2,-0.2 0.906 111.6 47.8 -64.6 -42.6 -10.5 18.3 122.5 15 13 B I H X S+ 0 0 21 -4,-2.9 4,-2.7 2,-0.2 5,-0.2 0.946 112.9 46.2 -64.5 -51.0 -11.5 21.9 121.8 16 14 B E H X S+ 0 0 154 -4,-2.4 4,-1.2 1,-0.2 -1,-0.2 0.895 116.6 46.8 -59.2 -41.2 -10.1 23.3 125.1 17 15 B A H X S+ 0 0 11 -4,-2.2 4,-3.0 -5,-0.2 8,-0.4 0.931 112.1 49.0 -67.1 -46.6 -6.9 21.4 124.5 18 16 B F H < S+ 0 0 3 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.941 110.6 51.0 -58.6 -49.2 -6.6 22.4 120.8 19 17 B N H < S+ 0 0 63 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.743 116.6 39.6 -61.8 -26.7 -7.1 26.1 121.7 20 18 B A H < S- 0 0 89 -4,-1.2 -1,-0.2 -3,-0.4 -2,-0.2 0.845 141.9 -0.0 -89.6 -37.8 -4.5 26.1 124.4 21 19 B K >X - 0 0 130 -4,-3.0 4,-1.6 -5,-0.2 3,-1.2 -0.788 65.0-154.2-154.7 101.9 -2.0 23.9 122.4 22 20 B P H 3> S+ 0 0 44 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.862 93.9 53.5 -44.4 -51.7 -2.9 22.6 118.9 23 21 B K H 3> S+ 0 0 115 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.804 106.9 53.6 -59.1 -30.1 -0.7 19.5 119.0 24 22 B N H <> S+ 0 0 63 -3,-1.2 4,-1.7 -7,-0.3 -1,-0.2 0.918 109.4 46.5 -70.7 -45.4 -2.3 18.4 122.3 25 23 B G H X S+ 0 0 0 -4,-1.6 4,-1.4 -8,-0.4 -2,-0.2 0.892 113.4 50.9 -62.9 -38.8 -5.8 18.6 120.9 26 24 B I H X S+ 0 0 2 -4,-2.4 4,-2.4 -5,-0.2 3,-0.3 0.931 107.6 51.8 -65.1 -43.9 -4.6 16.7 117.8 27 25 B N H X S+ 0 0 71 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.836 105.3 56.9 -62.7 -31.0 -3.0 14.0 119.9 28 26 B K H X S+ 0 0 41 -4,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.875 108.5 46.1 -66.7 -36.6 -6.3 13.5 121.8 29 27 B I H X S+ 0 0 2 -4,-1.4 4,-2.3 -3,-0.3 -2,-0.2 0.915 113.8 49.3 -70.0 -42.7 -8.1 12.9 118.5 30 28 B K H X S+ 0 0 69 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.855 108.3 53.1 -64.9 -37.1 -5.3 10.5 117.4 31 29 B E H X S+ 0 0 128 -4,-2.5 4,-1.8 2,-0.2 -1,-0.2 0.912 111.8 44.7 -67.5 -40.6 -5.4 8.6 120.7 32 30 B I H X S+ 0 0 29 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.894 112.0 53.0 -69.3 -37.9 -9.2 8.0 120.4 33 31 B C H <>S+ 0 0 1 -4,-2.3 5,-2.5 2,-0.2 4,-0.3 0.867 107.4 51.6 -63.3 -39.3 -8.8 7.0 116.8 34 32 B E H ><5S+ 0 0 165 -4,-2.0 3,-1.1 3,-0.2 -1,-0.2 0.943 109.8 50.7 -62.4 -45.6 -6.2 4.5 117.6 35 33 B Q H 3<5S+ 0 0 129 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.862 118.1 36.5 -60.6 -40.4 -8.5 3.0 120.3 36 34 B Y T 3<5S- 0 0 89 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.228 110.6-118.6-100.8 15.9 -11.5 2.7 117.9 37 35 B K T < 5 + 0 0 188 -3,-1.1 2,-0.3 -4,-0.3 -3,-0.2 0.860 64.0 139.7 51.8 48.3 -9.4 1.8 114.9 38 36 B I < - 0 0 45 -5,-2.5 -1,-0.2 -8,-0.1 -2,-0.1 -0.851 61.7 -94.9-120.9 156.9 -10.3 4.7 112.7 39 37 B S > - 0 0 61 -2,-0.3 4,-1.5 1,-0.2 5,-0.1 -0.542 29.4-161.5 -69.3 114.5 -8.3 6.9 110.3 40 38 B P H > S+ 0 0 40 0, 0.0 4,-3.6 0, 0.0 5,-0.3 0.851 82.7 65.9 -67.7 -33.8 -7.2 10.0 112.2 41 39 B N H > S+ 0 0 38 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.943 109.3 37.0 -52.2 -55.2 -6.5 12.1 109.1 42 40 B E H > S+ 0 0 88 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.880 116.8 55.0 -65.2 -37.6 -10.1 12.2 108.1 43 41 B E H X S+ 0 0 20 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.920 109.2 45.4 -63.4 -45.1 -11.2 12.5 111.7 44 42 B I H X S+ 0 0 0 -4,-3.6 4,-2.2 2,-0.2 -1,-0.2 0.917 113.8 50.6 -63.8 -42.3 -9.0 15.5 112.4 45 43 B A H X S+ 0 0 0 -4,-2.0 4,-1.7 -5,-0.3 -2,-0.2 0.897 110.4 48.9 -61.8 -42.2 -10.3 17.1 109.1 46 44 B E H X S+ 0 0 25 -4,-2.5 4,-3.1 1,-0.2 -1,-0.2 0.892 108.4 54.1 -65.2 -41.0 -13.9 16.4 110.1 47 45 B F H X S+ 0 0 4 -4,-2.2 4,-3.2 1,-0.2 -2,-0.2 0.926 105.7 52.8 -60.3 -45.1 -13.3 17.9 113.5 48 46 B F H < S+ 0 0 6 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.896 114.2 43.0 -58.4 -41.1 -12.0 21.2 111.9 49 47 B H H >< S+ 0 0 56 -4,-1.7 3,-0.7 -5,-0.2 -2,-0.2 0.936 119.5 42.0 -70.4 -45.2 -15.1 21.4 109.8 50 48 B Q H 3< S+ 0 0 93 -4,-3.1 3,-0.3 1,-0.2 -2,-0.2 0.850 121.4 37.1 -72.1 -38.5 -17.6 20.5 112.5 51 49 B Q T >X S+ 0 0 22 -4,-3.2 3,-1.7 -5,-0.2 4,-0.7 0.039 77.4 122.2-104.4 24.2 -16.1 22.5 115.4 52 50 B R G X4 S+ 0 0 94 -3,-0.7 3,-1.0 1,-0.3 -1,-0.2 0.883 70.6 56.2 -52.6 -44.1 -15.1 25.5 113.3 53 51 B K G 34 S+ 0 0 174 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.622 112.2 43.3 -67.1 -11.8 -17.2 27.9 115.4 54 52 B N G <4 S+ 0 0 55 -3,-1.7 -1,-0.2 2,-0.0 -2,-0.2 0.439 100.0 88.1-111.6 -3.7 -15.4 26.8 118.6 55 53 B L S << S- 0 0 15 -3,-1.0 2,-1.4 -4,-0.7 3,-0.1 -0.508 85.8-103.9-101.3 164.8 -11.8 26.7 117.4 56 54 B D >> - 0 0 67 1,-0.2 4,-2.0 -2,-0.2 3,-0.5 -0.740 36.8-162.6 -82.7 94.8 -8.9 29.1 117.1 57 55 B L H 3> S+ 0 0 47 -2,-1.4 4,-2.6 1,-0.3 44,-0.5 0.789 86.3 55.6 -52.1 -33.9 -9.2 29.6 113.3 58 56 B E H 3> S+ 0 0 92 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.932 107.5 49.6 -67.2 -41.4 -5.7 31.0 113.1 59 57 B A H <> S+ 0 0 16 -3,-0.5 4,-2.5 2,-0.2 -2,-0.2 0.878 111.1 50.3 -62.7 -38.5 -4.3 27.9 114.7 60 58 B V H X S+ 0 0 14 -4,-2.0 4,-3.0 2,-0.2 5,-0.3 0.966 110.6 47.7 -65.1 -51.7 -6.3 25.7 112.3 61 59 B G H X S+ 0 0 1 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.889 113.4 49.4 -55.5 -40.2 -5.1 27.6 109.2 62 60 B D H < S+ 0 0 56 -4,-2.4 4,-0.3 2,-0.2 -1,-0.2 0.923 112.5 46.3 -66.5 -45.0 -1.5 27.3 110.6 63 61 B Y H >< S+ 0 0 10 -4,-2.5 3,-1.0 1,-0.2 -2,-0.2 0.907 114.1 48.1 -63.7 -43.1 -1.8 23.6 111.2 64 62 B L H 3< S+ 0 0 0 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.752 111.0 50.5 -71.0 -26.4 -3.4 22.9 107.8 65 63 B S T 3< S+ 0 0 0 -4,-1.6 -1,-0.2 -5,-0.3 46,-0.2 0.373 86.9 113.8 -94.0 6.2 -0.8 24.9 105.9 66 64 B S < - 0 0 21 -3,-1.0 -3,-0.0 -4,-0.3 -4,-0.0 -0.428 69.0-130.4 -76.6 151.5 2.1 23.2 107.6 67 65 B P + 0 0 78 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.644 66.3 118.0 -76.4 -17.6 4.5 20.9 105.5 68 66 B E S > S- 0 0 127 1,-0.1 4,-2.9 3,-0.1 5,-0.2 -0.149 73.4-118.9 -54.7 146.0 4.5 17.9 107.8 69 67 B A H > S+ 0 0 84 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.895 113.3 47.8 -50.9 -52.0 3.1 14.6 106.4 70 68 B E H > S+ 0 0 50 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.934 113.4 48.7 -57.9 -47.6 0.3 14.3 108.9 71 69 B N H > S+ 0 0 6 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.921 110.9 50.2 -58.4 -47.1 -0.7 17.9 108.4 72 70 B Q H X S+ 0 0 79 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.866 111.0 48.6 -61.0 -38.6 -0.7 17.5 104.6 73 71 B Q H X S+ 0 0 78 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.885 110.5 51.0 -70.8 -37.9 -2.8 14.4 104.8 74 72 B V H X S+ 0 0 0 -4,-2.4 4,-3.0 2,-0.2 -2,-0.2 0.930 110.6 49.8 -63.5 -43.3 -5.3 16.2 107.1 75 73 B L H X S+ 0 0 2 -4,-2.7 4,-2.6 2,-0.2 5,-0.3 0.913 108.7 52.0 -60.4 -45.5 -5.5 19.1 104.6 76 74 B K H X S+ 0 0 133 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.941 114.2 43.2 -57.3 -47.0 -6.1 16.7 101.7 77 75 B A H X S+ 0 0 5 -4,-2.3 4,-1.1 1,-0.2 -2,-0.2 0.901 113.0 53.8 -64.8 -41.2 -9.0 15.1 103.6 78 76 B F H < S+ 0 0 5 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.883 113.8 39.8 -61.5 -42.1 -10.2 18.5 104.7 79 77 B T H >< S+ 0 0 0 -4,-2.6 3,-1.6 1,-0.2 -1,-0.2 0.846 110.0 57.6 -78.9 -35.8 -10.4 19.9 101.2 80 78 B S H 3< S+ 0 0 66 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.733 98.3 63.5 -67.4 -20.3 -11.8 16.8 99.6 81 79 B Q T 3< S+ 0 0 68 -4,-1.1 -1,-0.3 -5,-0.2 2,-0.2 0.548 89.6 87.9 -79.5 -7.9 -14.7 17.0 102.0 82 80 B X S < S- 0 0 25 -3,-1.6 2,-0.7 -4,-0.1 -3,-0.0 -0.612 85.1-115.5 -91.3 152.5 -15.7 20.3 100.4 83 81 B N + 0 0 106 -2,-0.2 -2,-0.1 1,-0.1 37,-0.1 -0.791 43.3 156.3 -95.4 114.6 -18.0 20.4 97.4 84 82 B F + 0 0 1 -2,-0.7 3,-0.4 35,-0.1 2,-0.3 0.349 52.8 91.6-112.3 -0.2 -16.4 21.8 94.2 85 83 B N S S+ 0 0 91 1,-0.2 39,-0.1 7,-0.1 3,-0.1 -0.693 88.5 23.6 -92.3 148.3 -18.8 20.1 91.8 86 84 B G S S+ 0 0 72 -2,-0.3 -1,-0.2 1,-0.1 2,-0.2 0.981 108.6 83.6 58.2 58.6 -21.9 22.0 90.9 87 85 B Q S S- 0 0 53 -3,-0.4 -1,-0.1 0, 0.0 5,-0.1 -0.629 87.9 -98.4 173.9 123.9 -20.3 25.4 91.6 88 86 B S > - 0 0 22 -2,-0.2 4,-2.7 1,-0.1 5,-0.2 -0.002 33.5-108.4 -52.1 160.0 -18.1 27.4 89.2 89 87 B F H > S+ 0 0 4 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.928 121.6 46.9 -54.8 -49.5 -14.3 27.3 89.5 90 88 B V H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.907 111.7 49.7 -60.9 -45.0 -14.3 30.9 90.8 91 89 B E H > S+ 0 0 81 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.893 112.5 49.7 -62.1 -39.0 -17.1 30.2 93.3 92 90 B G H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.928 112.3 44.9 -66.4 -45.8 -15.2 27.2 94.4 93 91 B L H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 5,-0.2 0.909 112.7 52.9 -64.8 -40.6 -11.9 29.0 94.9 94 92 B R H X S+ 0 0 22 -4,-2.8 4,-2.4 -5,-0.2 -2,-0.2 0.951 112.0 44.9 -57.8 -52.2 -13.7 31.9 96.6 95 93 B T H X S+ 0 0 56 -4,-2.5 4,-1.0 2,-0.2 -2,-0.2 0.924 112.1 51.4 -59.1 -49.0 -15.4 29.5 99.1 96 94 B F H >X S+ 0 0 0 -4,-2.7 3,-1.2 1,-0.2 4,-0.6 0.960 112.6 45.3 -53.9 -54.3 -12.2 27.6 99.8 97 95 B L H >< S+ 0 0 7 -4,-2.7 3,-1.1 1,-0.3 100,-0.3 0.887 108.7 56.3 -58.3 -41.9 -10.2 30.7 100.5 98 96 B K H 3< S+ 0 0 84 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.679 94.3 70.5 -64.1 -19.1 -12.9 32.2 102.7 99 97 B T H << S+ 0 0 23 -3,-1.2 -1,-0.2 -4,-1.0 -2,-0.2 0.856 95.1 66.5 -67.7 -32.5 -12.8 29.1 104.8 100 98 B F S << S- 0 0 8 -3,-1.1 2,-1.0 -4,-0.6 97,-0.4 -0.463 71.6-137.8 -97.8 162.4 -9.4 30.0 106.3 101 99 B K - 0 0 70 -44,-0.5 97,-0.2 -2,-0.2 98,-0.1 -0.895 54.0-133.6-106.9 84.2 -7.7 32.6 108.5 102 100 B L B -a 198 0A 2 95,-1.8 97,-3.1 -2,-1.0 2,-0.2 -0.138 7.9-121.9 -50.2 133.2 -4.9 32.7 105.9 103 101 B P - 0 0 2 0, 0.0 2,-1.4 0, 0.0 6,-0.2 -0.508 20.7-121.4 -75.4 146.1 -1.3 32.5 107.2 104 102 B G S S+ 0 0 50 96,-0.3 2,-0.4 -2,-0.2 94,-0.0 -0.254 81.3 102.4 -84.1 50.6 0.9 35.5 106.2 105 103 B E > - 0 0 67 -2,-1.4 4,-2.6 1,-0.1 5,-0.3 -0.981 64.8-146.9-138.7 123.3 3.4 33.1 104.5 106 104 B A H > S+ 0 0 85 -2,-0.4 4,-2.5 1,-0.2 5,-0.2 0.885 100.7 51.2 -53.6 -46.6 3.7 32.5 100.7 107 105 B Q H > S+ 0 0 146 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.881 112.6 46.6 -60.5 -40.7 4.7 28.9 101.1 108 106 B K H > S+ 0 0 15 -3,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.927 112.2 48.2 -68.2 -47.0 1.8 28.1 103.4 109 107 B I H X S+ 0 0 41 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.910 110.3 54.9 -59.8 -40.0 -0.8 29.9 101.2 110 108 B D H X S+ 0 0 53 -4,-2.5 4,-2.6 -5,-0.3 -1,-0.2 0.893 104.4 52.2 -61.2 -42.0 0.7 28.0 98.2 111 109 B R H X S+ 0 0 43 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.883 110.0 49.8 -63.5 -36.1 0.2 24.6 99.9 112 110 B L H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.940 111.3 47.9 -67.2 -45.9 -3.5 25.5 100.6 113 111 B V H X S+ 0 0 6 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.894 110.0 53.5 -61.7 -38.3 -4.0 26.5 96.9 114 112 B Q H X S+ 0 0 91 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.921 107.0 51.4 -61.8 -42.6 -2.3 23.3 95.9 115 113 B S H X S+ 0 0 19 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.919 110.9 48.8 -60.2 -43.9 -4.7 21.3 98.0 116 114 B F H X S+ 0 0 0 -4,-2.3 4,-3.3 1,-0.2 5,-0.2 0.926 108.4 52.2 -61.6 -47.1 -7.7 23.1 96.4 117 115 B S H X S+ 0 0 5 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.878 109.8 50.4 -59.1 -37.3 -6.4 22.5 92.9 118 116 B G H X S+ 0 0 22 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.935 114.5 42.4 -66.0 -46.6 -6.1 18.8 93.6 119 117 B A H X S+ 0 0 10 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.890 111.4 55.3 -67.1 -41.7 -9.6 18.5 95.0 120 118 B Y H X S+ 0 0 5 -4,-3.3 4,-0.9 1,-0.2 -1,-0.2 0.926 110.2 47.1 -57.5 -45.2 -11.1 20.7 92.3 121 119 B F H >< S+ 0 0 42 -4,-2.0 3,-1.0 -5,-0.2 -2,-0.2 0.941 107.8 53.1 -61.9 -51.6 -9.6 18.4 89.6 122 120 B Q H 3< S+ 0 0 145 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.840 116.5 41.7 -53.8 -34.6 -10.8 15.2 91.2 123 121 B Q H 3< S+ 0 0 45 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.579 126.0 32.8 -91.0 -10.5 -14.3 16.6 91.3 124 122 B N XX + 0 0 8 -3,-1.0 4,-1.6 -4,-0.9 3,-1.4 -0.409 61.7 154.3-142.5 59.2 -14.2 18.2 87.8 125 123 B P T 34 S+ 0 0 82 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 0.608 79.4 55.8 -65.0 -9.5 -12.0 16.0 85.6 126 124 B D T 34 S+ 0 0 136 -5,-0.1 3,-0.1 1,-0.1 -5,-0.1 0.631 104.4 50.7 -95.4 -18.3 -14.0 17.3 82.7 127 125 B V T <4 S+ 0 0 45 -3,-1.4 2,-0.3 1,-0.3 -1,-0.1 0.829 122.0 19.4 -87.7 -38.3 -13.2 21.0 83.4 128 126 B V S < S- 0 0 3 -4,-1.6 -1,-0.3 -7,-0.2 3,-0.1 -0.968 71.2-130.8-133.1 150.2 -9.5 20.8 83.7 129 127 B S S S- 0 0 51 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.856 79.6 -22.8 -69.5 -38.0 -7.1 18.0 82.5 130 128 B N S > S- 0 0 40 1,-0.1 4,-1.8 -13,-0.0 5,-0.1 -0.921 73.9 -79.8-158.9-176.2 -5.2 17.6 85.8 131 129 B A H > S+ 0 0 31 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.885 122.8 55.8 -62.4 -42.2 -4.2 19.1 89.2 132 130 B D H > S+ 0 0 121 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.885 107.5 49.5 -58.0 -40.9 -1.4 21.1 87.7 133 131 B A H > S+ 0 0 1 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.895 111.0 49.2 -65.5 -41.7 -3.8 22.7 85.3 134 132 B A H X S+ 0 0 0 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.876 110.3 52.1 -64.5 -38.2 -6.2 23.5 88.1 135 133 B Y H X S+ 0 0 66 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.898 108.2 49.7 -65.8 -42.7 -3.3 25.0 90.1 136 134 B L H X S+ 0 0 59 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.910 111.7 49.3 -62.6 -42.1 -2.3 27.3 87.1 137 135 B L H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.897 112.3 48.1 -63.2 -41.8 -5.9 28.5 86.8 138 136 B A H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.924 112.1 48.6 -65.1 -45.0 -6.0 29.2 90.6 139 137 B F H X S+ 0 0 106 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.936 114.0 46.8 -59.9 -47.6 -2.7 31.0 90.5 140 138 B Q H X S+ 0 0 15 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.877 111.8 50.8 -61.5 -41.1 -3.9 33.1 87.5 141 139 B T H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.891 110.0 49.7 -65.8 -40.4 -7.2 33.8 89.2 142 140 B I H X S+ 0 0 38 -4,-2.4 4,-1.6 2,-0.2 -2,-0.2 0.893 111.2 48.7 -65.5 -41.2 -5.6 35.0 92.4 143 141 B X H X S+ 0 0 77 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.855 112.1 50.6 -67.2 -33.7 -3.2 37.3 90.4 144 142 B L H X S+ 0 0 3 -4,-1.9 4,-2.4 2,-0.2 5,-0.3 0.906 104.3 57.4 -68.3 -43.3 -6.3 38.6 88.6 145 143 B N H < S+ 0 0 13 -4,-2.5 4,-0.4 1,-0.2 -2,-0.2 0.867 114.4 38.3 -55.3 -40.5 -8.2 39.2 91.8 146 144 B T H < S+ 0 0 74 -4,-1.6 3,-0.4 2,-0.1 4,-0.4 0.955 119.7 43.0 -77.1 -53.7 -5.4 41.5 93.0 147 145 B D H >< S+ 0 0 71 -4,-2.4 3,-1.1 1,-0.2 -2,-0.2 0.898 109.0 53.8 -62.6 -47.6 -4.5 43.3 89.8 148 146 B L T 3< S+ 0 0 14 -4,-2.4 -1,-0.2 1,-0.2 -3,-0.1 0.750 115.2 42.9 -61.5 -23.7 -7.9 44.0 88.4 149 147 B H T 3 S+ 0 0 67 -3,-0.4 -1,-0.2 -4,-0.4 -2,-0.2 0.388 78.2 119.5-107.1 5.7 -9.0 45.7 91.6 150 148 B N X - 0 0 52 -3,-1.1 3,-1.3 -4,-0.4 -4,-0.0 -0.608 51.1-154.3 -74.3 119.4 -5.9 47.8 92.5 151 149 B P T 3 S+ 0 0 130 0, 0.0 -1,-0.2 0, 0.0 4,-0.1 0.768 89.7 59.5 -64.1 -30.0 -7.0 51.5 92.5 152 150 B S T 3 S+ 0 0 98 2,-0.1 -2,-0.1 -3,-0.0 -3,-0.0 0.240 87.1 93.2 -86.0 14.2 -3.5 52.8 91.7 153 151 B I S < S- 0 0 43 -3,-1.3 5,-0.1 -6,-0.1 -1,-0.0 -0.932 81.9-119.3-114.1 118.0 -3.3 50.9 88.4 154 152 B P >> - 0 0 74 0, 0.0 3,-2.6 0, 0.0 4,-0.6 -0.239 25.1-122.7 -51.4 133.2 -4.5 52.7 85.2 155 153 B E G >4 S+ 0 0 149 1,-0.3 3,-1.7 2,-0.2 -2,-0.0 0.864 110.4 59.6 -46.1 -45.1 -7.4 50.8 83.7 156 154 B K G 34 S+ 0 0 187 1,-0.3 -1,-0.3 4,-0.0 4,-0.1 0.614 99.0 58.2 -63.5 -13.1 -5.5 50.3 80.4 157 155 B N G <4 S+ 0 0 108 -3,-2.6 -1,-0.3 2,-0.1 -2,-0.2 0.621 85.7 103.6 -90.8 -14.0 -2.7 48.4 82.3 158 156 B K S << S- 0 0 30 -3,-1.7 -10,-0.1 -4,-0.6 -14,-0.0 -0.414 84.3 -98.5 -73.4 141.8 -5.1 45.8 83.6 159 157 B X - 0 0 53 -2,-0.1 2,-0.2 4,-0.1 -1,-0.1 -0.325 39.7-150.3 -60.3 133.2 -5.3 42.3 82.0 160 158 B T > - 0 0 63 -4,-0.1 4,-2.4 1,-0.1 5,-0.1 -0.488 31.4-101.7 -97.0 171.8 -8.1 42.0 79.5 161 159 B V H > S+ 0 0 37 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.912 127.7 54.5 -58.8 -40.5 -10.0 38.8 78.7 162 160 B D H > S+ 0 0 93 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.892 107.7 49.7 -58.3 -42.5 -7.8 38.7 75.6 163 161 B G H > S+ 0 0 12 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.908 107.4 53.5 -64.9 -43.8 -4.8 38.9 77.8 164 162 B L H X S+ 0 0 0 -4,-2.4 4,-1.5 1,-0.2 -2,-0.2 0.939 107.7 50.7 -56.7 -49.2 -5.9 36.1 80.1 165 163 B K H < S+ 0 0 49 -4,-2.3 4,-0.3 1,-0.2 -1,-0.2 0.860 111.2 48.2 -59.3 -37.2 -6.4 33.7 77.1 166 164 B R H >< S+ 0 0 160 -4,-1.6 3,-0.9 1,-0.2 -1,-0.2 0.904 110.8 52.0 -70.0 -38.5 -2.9 34.4 75.8 167 165 B N H 3< S+ 0 0 103 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.707 110.7 46.7 -70.3 -21.9 -1.5 33.9 79.3 168 166 B L T >< S+ 0 0 3 -4,-1.5 3,-2.4 -5,-0.2 -1,-0.2 0.375 78.9 139.1-101.6 4.0 -3.1 30.5 79.8 169 167 B R T < S- 0 0 142 -3,-0.9 7,-0.1 -4,-0.3 6,-0.1 -0.243 80.1 -0.0 -53.3 126.2 -2.2 29.1 76.4 170 168 B G T 3> S+ 0 0 33 1,-0.1 4,-1.1 2,-0.1 -1,-0.3 0.615 97.7 120.1 69.4 12.7 -1.1 25.5 76.6 171 169 B G T <4 + 0 0 16 -3,-2.4 2,-0.9 1,-0.2 -35,-0.2 0.429 48.1 82.9 -89.0 0.7 -1.7 25.5 80.4 172 170 B N B >4 S-B 175 0B 32 3,-2.8 3,-1.7 -4,-0.2 -1,-0.2 -0.585 131.6 -60.4-103.9 69.1 -4.3 22.8 80.4 173 171 B N T 34 S- 0 0 105 -2,-0.9 -2,-0.2 1,-0.3 3,-0.1 0.909 112.3 -39.0 57.0 46.2 -1.9 19.9 80.4 174 172 B G T 3< S+ 0 0 66 -4,-1.1 -1,-0.3 1,-0.4 -3,-0.1 0.061 132.6 82.7 94.8 -25.1 -0.4 21.0 77.1 175 173 B G B < S-B 172 0B 32 -3,-1.7 -3,-2.8 -5,-0.1 -1,-0.4 -0.269 81.4 -97.6 -98.9-170.9 -3.8 22.0 75.7 176 174 B D - 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