==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 13-MAR-03 1ORG . COMPND 2 MOLECULE: PHEROMONE BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: LEUCOPHAEA MADERAE; . AUTHOR A.LARTIGUE,A.GRUEZ,S.SPINELLI,S.RIVIERE,R.BROSSUT,M.TEGONI, . 236 2 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12012.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 168 71.2 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 . 4 1.7 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 . 2 0.8 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 . 5 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 127 53.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 3.0 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 0 0 1 3 0 0 0 0 0 4 1 1 1 0 1 0 0 0 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 . 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 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 A S > 0 0 62 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 121.9 -0.9 10.7 -8.9 2 2 A T H > + 0 0 76 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.941 360.0 40.7 -63.8 -51.2 -1.7 13.6 -11.2 3 3 A Q H > S+ 0 0 115 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.855 112.7 53.8 -69.7 -36.6 -0.3 12.3 -14.5 4 4 A S H > S+ 0 0 40 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.900 108.6 50.6 -64.1 -39.5 -1.5 8.7 -14.0 5 5 A Y H X S+ 0 0 13 -4,-2.1 4,-3.0 1,-0.2 5,-0.3 0.918 112.5 47.5 -59.5 -45.4 -5.1 10.0 -13.5 6 6 A K H X S+ 0 0 51 -4,-1.8 4,-2.5 1,-0.2 -2,-0.2 0.894 108.5 54.0 -67.5 -39.1 -4.7 12.1 -16.7 7 7 A D H < S+ 0 0 108 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.882 117.6 36.6 -59.1 -38.3 -3.3 9.1 -18.6 8 8 A A H < S+ 0 0 16 -4,-2.0 4,-0.4 66,-0.3 -2,-0.2 0.894 126.4 34.7 -83.0 -41.3 -6.4 7.0 -17.6 9 9 A M H X S+ 0 0 0 -4,-3.0 4,-3.0 -5,-0.2 3,-0.4 0.769 97.2 80.5 -87.3 -31.2 -9.1 9.6 -17.8 10 10 A G H X S+ 0 0 5 -4,-2.5 4,-2.7 -5,-0.3 5,-0.2 0.894 94.9 44.7 -46.6 -55.3 -7.9 11.8 -20.6 11 11 A P H > S+ 0 0 74 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.865 116.2 48.1 -60.2 -35.9 -9.2 9.6 -23.5 12 12 A L H > S+ 0 0 18 -4,-0.4 4,-2.5 -3,-0.4 -2,-0.2 0.920 111.8 47.7 -72.0 -45.2 -12.5 9.0 -21.7 13 13 A V H X S+ 0 0 0 -4,-3.0 4,-1.4 1,-0.2 -1,-0.2 0.913 110.9 53.4 -60.4 -42.1 -13.1 12.7 -20.9 14 14 A R H < S+ 0 0 152 -4,-2.7 3,-0.4 -5,-0.3 4,-0.4 0.914 109.6 47.1 -59.2 -43.1 -12.2 13.5 -24.5 15 15 A E H >< S+ 0 0 113 -4,-1.9 3,-1.7 1,-0.2 -1,-0.2 0.907 108.3 56.8 -62.9 -41.2 -14.8 11.0 -25.7 16 16 A a H >X S+ 0 0 0 -4,-2.5 3,-1.8 1,-0.3 4,-1.2 0.727 89.6 72.5 -64.8 -24.1 -17.3 12.5 -23.3 17 17 A M T 3< S+ 0 0 56 -4,-1.4 -1,-0.3 -3,-0.4 5,-0.2 0.765 93.5 58.4 -61.5 -22.5 -16.8 16.0 -24.9 18 18 A G T <4 S+ 0 0 77 -3,-1.7 -1,-0.3 -4,-0.4 -2,-0.2 0.557 115.7 31.3 -80.5 -11.1 -18.8 14.5 -27.8 19 19 A S T <4 S+ 0 0 86 -3,-1.8 2,-0.4 1,-0.2 -2,-0.2 0.309 115.9 58.3-127.5 0.8 -21.9 13.7 -25.6 20 20 A V S < S- 0 0 23 -4,-1.2 2,-2.4 2,-0.1 -1,-0.2 -0.998 79.6-130.5-132.3 131.0 -21.7 16.5 -23.0 21 21 A S + 0 0 111 -2,-0.4 2,-0.2 -3,-0.1 -4,-0.1 -0.358 56.5 145.7 -84.3 66.4 -21.7 20.2 -24.0 22 22 A A - 0 0 16 -2,-2.4 2,-0.1 -5,-0.2 -2,-0.1 -0.627 43.8-119.3 -98.6 155.8 -18.7 21.1 -21.9 23 23 A T > - 0 0 70 -2,-0.2 4,-1.9 1,-0.1 3,-0.1 -0.444 25.8-106.0 -91.2 169.0 -16.1 23.6 -22.7 24 24 A E H > S+ 0 0 158 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.889 123.8 55.5 -59.2 -38.3 -12.3 23.3 -23.3 25 25 A D H > S+ 0 0 114 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.901 105.0 52.8 -62.6 -37.2 -11.9 24.9 -19.9 26 26 A D H > S+ 0 0 11 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.878 103.2 57.9 -63.5 -39.4 -14.1 22.2 -18.3 27 27 A F H X S+ 0 0 35 -4,-1.9 4,-2.6 1,-0.2 -1,-0.2 0.934 109.5 44.1 -53.6 -51.0 -11.9 19.5 -19.9 28 28 A K H X S+ 0 0 125 -4,-1.7 4,-2.6 2,-0.2 6,-0.2 0.902 110.5 55.1 -60.5 -44.1 -8.9 21.0 -18.1 29 29 A T H <>S+ 0 0 33 -4,-2.4 5,-2.4 1,-0.2 4,-0.3 0.936 112.8 42.9 -56.4 -44.4 -10.9 21.3 -14.8 30 30 A V H ><5S+ 0 0 0 -4,-2.6 3,-1.5 1,-0.2 -2,-0.2 0.954 114.5 47.8 -72.3 -45.7 -11.8 17.6 -14.9 31 31 A L H 3<5S+ 0 0 23 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.869 113.6 48.8 -63.1 -33.7 -8.3 16.4 -16.0 32 32 A N T 3<5S- 0 0 68 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.463 108.9-125.6 -81.6 -2.8 -6.7 18.5 -13.3 33 33 A R T < 5 + 0 0 74 -3,-1.5 -3,-0.2 -4,-0.3 -4,-0.1 0.836 54.7 159.5 54.9 39.1 -9.2 17.2 -10.6 34 34 A N < - 0 0 72 -5,-2.4 -1,-0.2 -6,-0.2 2,-0.1 -0.361 55.2 -70.2 -79.5 161.1 -10.1 20.8 -9.8 35 35 A P - 0 0 71 0, 0.0 2,-1.9 0, 0.0 3,-0.2 -0.401 47.5-124.3 -51.5 133.2 -13.4 21.6 -8.0 36 36 A L + 0 0 4 1,-0.2 6,-0.1 72,-0.2 76,-0.1 -0.565 48.0 158.7 -84.9 75.9 -16.2 21.0 -10.5 37 37 A E + 0 0 179 -2,-1.9 2,-0.3 4,-0.1 -1,-0.2 0.895 53.0 67.4 -71.6 -41.3 -17.7 24.5 -10.2 38 38 A S S > S- 0 0 37 -3,-0.2 4,-2.1 1,-0.1 5,-0.1 -0.600 78.5-135.4 -82.0 140.3 -19.6 24.5 -13.5 39 39 A R H > S+ 0 0 121 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.883 109.0 58.9 -55.2 -39.9 -22.5 22.2 -14.0 40 40 A T H > S+ 0 0 51 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.915 106.1 46.0 -57.6 -42.3 -21.0 21.4 -17.4 41 41 A A H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.891 111.0 53.4 -68.1 -35.9 -17.7 20.1 -15.8 42 42 A Q H X S+ 0 0 17 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.930 112.3 44.4 -59.8 -47.7 -19.8 18.1 -13.2 43 43 A b H X S+ 0 0 20 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.861 110.5 55.2 -66.0 -38.2 -21.7 16.4 -16.1 44 44 A L H X S+ 0 0 0 -4,-2.3 4,-2.1 -5,-0.2 -2,-0.2 0.944 110.8 43.6 -59.9 -50.5 -18.4 15.9 -18.0 45 45 A L H X S+ 0 0 9 -4,-2.6 4,-3.2 2,-0.2 5,-0.3 0.903 109.4 58.3 -60.7 -41.2 -16.8 14.0 -15.1 46 46 A A H X S+ 0 0 1 -4,-2.3 4,-1.6 1,-0.2 -1,-0.2 0.912 108.4 46.0 -54.8 -45.1 -20.1 12.1 -14.5 47 47 A a H X S+ 0 0 16 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.925 114.0 47.7 -62.0 -45.3 -19.9 10.8 -18.1 48 48 A A H X S+ 0 0 0 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.877 109.4 52.6 -70.8 -36.2 -16.2 9.9 -17.8 49 49 A L H X>S+ 0 0 8 -4,-3.2 5,-2.6 2,-0.2 4,-0.6 0.824 108.8 51.0 -66.0 -33.2 -16.6 8.1 -14.5 50 50 A D H ><5S+ 0 0 82 -4,-1.6 3,-0.9 -5,-0.3 5,-0.3 0.940 111.5 48.6 -66.2 -44.2 -19.4 6.0 -16.0 51 51 A K H 3<5S+ 0 0 82 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.827 107.3 54.3 -62.5 -34.5 -17.0 5.2 -18.9 52 52 A V H 3<5S- 0 0 7 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.588 121.7-103.7 -81.9 -10.6 -14.2 4.2 -16.5 53 53 A G T <<5S+ 0 0 34 -3,-0.9 -3,-0.2 -4,-0.6 17,-0.2 0.628 87.5 116.7 105.0 17.1 -16.3 1.7 -14.7 54 54 A L < + 0 0 5 -5,-2.6 8,-2.9 16,-0.1 2,-0.5 0.598 60.8 71.8 -92.0 -12.8 -17.2 3.6 -11.5 55 55 A I B S-A 61 0A 20 -6,-0.6 6,-0.2 -5,-0.3 -2,-0.1 -0.905 74.3-133.5-115.7 130.4 -21.0 3.8 -11.9 56 56 A S > - 0 0 10 4,-3.4 3,-2.2 -2,-0.5 -2,-0.1 -0.226 34.2-100.4 -73.7 162.9 -23.5 1.0 -11.7 57 57 A P T 3 S+ 0 0 121 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.836 125.6 52.5 -50.7 -32.8 -26.2 0.4 -14.3 58 58 A E T 3 S- 0 0 163 2,-0.1 -2,-0.0 1,-0.0 -3,-0.0 0.453 125.8-100.0 -86.5 -3.5 -28.7 2.0 -11.9 59 59 A G S < S+ 0 0 36 -3,-2.2 2,-0.3 1,-0.3 39,-0.2 0.613 76.4 136.6 96.6 12.3 -26.5 5.1 -11.4 60 60 A A - 0 0 38 37,-0.1 -4,-3.4 38,-0.0 2,-0.3 -0.714 58.5-115.1 -90.3 145.1 -24.8 4.3 -8.1 61 61 A I B -A 55 0A 3 -2,-0.3 -6,-0.2 -6,-0.2 6,-0.1 -0.640 40.0-114.1 -73.8 130.1 -21.1 4.9 -7.4 62 62 A Y - 0 0 66 -8,-2.9 2,-0.3 -2,-0.3 31,-0.1 -0.350 36.4-171.2 -64.9 147.2 -19.4 1.5 -6.8 63 63 A T > + 0 0 42 30,-0.1 3,-1.4 -2,-0.1 4,-0.2 -0.816 44.3 6.0-130.0 171.0 -18.0 0.7 -3.4 64 64 A G G >> S- 0 0 16 1,-0.3 3,-1.8 -2,-0.3 4,-0.6 -0.193 129.3 -3.6 61.7-140.6 -15.9 -2.1 -1.9 65 65 A D G >4 S+ 0 0 85 1,-0.3 3,-1.0 2,-0.2 -1,-0.3 0.812 130.4 65.4 -53.8 -30.7 -14.4 -4.7 -4.2 66 66 A D G <4 S+ 0 0 100 -3,-1.4 4,-0.3 1,-0.3 -1,-0.3 0.720 98.1 54.4 -68.2 -21.4 -16.3 -3.0 -7.1 67 67 A L G <> S+ 0 0 0 -3,-1.8 4,-2.4 -4,-0.2 3,-0.3 0.666 89.2 80.4 -80.4 -22.9 -14.1 0.1 -6.6 68 68 A M H S+ 0 0 87 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.884 113.5 49.3 -61.4 -34.9 -10.4 -2.1 -10.7 70 70 A V H > S+ 0 0 5 -4,-0.3 4,-2.6 -3,-0.3 5,-0.3 0.958 110.2 48.1 -67.5 -51.1 -11.1 1.6 -11.0 71 71 A M H X>S+ 0 0 5 -4,-2.4 4,-2.4 1,-0.2 5,-1.0 0.903 113.5 50.4 -53.1 -42.3 -8.6 2.6 -8.3 72 72 A N H X5S+ 0 0 77 -4,-2.6 4,-0.7 3,-0.2 -1,-0.2 0.897 111.7 45.9 -60.9 -45.2 -6.1 0.3 -10.1 73 73 A R H <5S+ 0 0 131 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.904 119.6 40.1 -66.3 -41.9 -6.7 1.9 -13.5 74 74 A L H <5S- 0 0 6 -4,-2.6 -66,-0.3 -5,-0.1 -2,-0.2 0.863 139.4 -1.6 -76.7 -39.1 -6.5 5.4 -12.3 75 75 A Y H <5S- 0 0 27 -4,-2.4 3,-0.4 -5,-0.3 -3,-0.2 0.613 81.8-138.8-132.8 -23.5 -3.7 5.2 -9.8 76 76 A G << - 0 0 20 -5,-1.0 3,-0.2 -4,-0.7 2,-0.1 -0.037 34.2 -91.4 65.9 176.1 -2.2 1.8 -9.5 77 77 A F S S+ 0 0 4 1,-0.1 -1,-0.2 -5,-0.1 114,-0.1 -0.489 94.8 100.9-122.8 61.1 -1.3 0.5 -6.0 78 78 A N S S+ 0 0 119 -3,-0.4 2,-0.5 -2,-0.1 109,-0.2 0.553 72.0 70.2-108.4 -18.7 2.3 1.6 -5.6 79 79 A D S >> S- 0 0 71 -3,-0.2 3,-1.0 -4,-0.2 4,-0.6 -0.882 72.4-144.9-105.4 128.6 1.6 4.6 -3.5 80 80 A F H >> S+ 0 0 11 -2,-0.5 4,-1.5 1,-0.2 3,-1.0 0.803 99.6 64.7 -58.6 -29.9 0.3 4.3 0.1 81 81 A K H 3> S+ 0 0 121 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.892 90.0 66.4 -94.4 23.7 -1.8 7.3 -0.2 82 82 A T H <> S+ 0 0 9 -3,-1.0 4,-2.5 2,-0.2 -1,-0.2 0.884 98.0 56.6 -73.5 -30.7 -4.0 5.3 -2.9 83 83 A V H < S+ 0 0 4 -4,-2.1 3,-2.4 -5,-0.1 4,-0.5 0.696 86.0 116.1 -95.7 -25.1 -23.9 10.4 -1.4 97 97 A N T 3< S+ 0 0 44 -4,-2.4 -37,-0.1 -5,-0.3 -38,-0.0 -0.265 90.8 5.0 -55.3 127.9 -25.4 7.3 -3.1 98 98 A G T 3 S+ 0 0 86 2,-0.2 -1,-0.3 -39,-0.2 -2,-0.1 0.394 108.5 95.4 80.2 -2.0 -29.2 7.7 -3.5 99 99 A A S < S+ 0 0 57 -3,-2.4 -2,-0.2 1,-0.2 -1,-0.0 0.589 77.7 51.2 -95.6 -14.3 -29.2 11.3 -2.2 100 100 A Y - 0 0 81 -4,-0.5 -2,-0.2 1,-0.1 -1,-0.2 -0.924 55.5-169.4-132.3 104.1 -29.0 13.2 -5.5 101 101 A P S S+ 0 0 137 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.773 76.1 78.0 -62.7 -27.8 -31.5 12.4 -8.4 102 102 A D S > S- 0 0 53 1,-0.1 4,-1.9 2,-0.0 5,-0.1 -0.777 76.9-147.8 -85.9 125.1 -29.5 14.5 -10.8 103 103 A R H > S+ 0 0 127 -2,-0.6 4,-1.5 1,-0.2 -1,-0.1 0.753 97.4 50.9 -64.1 -31.2 -26.4 12.6 -11.9 104 104 A b H > S+ 0 0 4 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.913 109.1 50.9 -76.9 -40.0 -24.2 15.6 -12.2 105 105 A D H > S+ 0 0 65 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.869 106.8 56.7 -57.8 -39.0 -25.2 16.8 -8.7 106 106 A L H X S+ 0 0 12 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.935 110.4 42.7 -57.6 -47.8 -24.3 13.3 -7.4 107 107 A I H X S+ 0 0 2 -4,-1.5 4,-2.8 2,-0.2 5,-0.3 0.875 110.4 56.2 -71.7 -36.1 -20.8 13.7 -8.9 108 108 A K H X S+ 0 0 55 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.957 113.9 40.3 -55.5 -50.3 -20.4 17.2 -7.6 109 109 A N H X S+ 0 0 49 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.881 113.8 53.7 -70.8 -35.4 -21.1 16.1 -4.1 110 110 A F H X S+ 0 0 11 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.935 111.7 44.3 -60.7 -50.1 -19.1 12.9 -4.4 111 111 A T H X S+ 0 0 19 -4,-2.8 4,-2.7 2,-0.2 -2,-0.2 0.872 112.0 52.0 -69.2 -36.3 -16.0 14.8 -5.5 112 112 A D H X S+ 0 0 33 -4,-2.1 4,-2.3 -5,-0.3 -1,-0.2 0.945 110.2 50.2 -58.8 -48.3 -16.3 17.5 -2.9 113 113 A c H X S+ 0 0 17 -4,-2.4 4,-0.7 1,-0.2 -2,-0.2 0.904 112.6 46.0 -56.7 -46.4 -16.6 14.8 -0.2 114 114 A V H >< S+ 0 0 17 -4,-2.3 3,-0.9 1,-0.2 -1,-0.2 0.923 112.3 50.5 -61.8 -44.7 -13.5 13.1 -1.5 115 115 A R H 3< S+ 0 0 99 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.874 109.9 51.3 -61.0 -37.6 -11.6 16.4 -1.8 116 116 A N H 3< S+ 0 0 129 -4,-2.3 -1,-0.2 -5,-0.2 2,-0.2 0.594 91.1 99.0 -75.3 -17.0 -12.6 17.3 1.8 117 117 A S << 0 0 45 -3,-0.9 -29,-0.1 -4,-0.7 -3,-0.0 -0.530 360.0 360.0 -76.8 136.1 -11.4 13.9 3.2 118 118 A Y 0 0 255 -2,-0.2 -1,-0.2 -30,-0.0 -30,-0.1 0.942 360.0 360.0 -76.9 360.0 -8.0 13.7 4.8 119 !* 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 0.0 120 1 B S > 0 0 91 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 126.6 -6.4 -14.0 1.1 121 2 B T H > + 0 0 73 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.942 360.0 49.9 -63.6 -43.9 -5.1 -16.7 3.5 122 3 B Q H > S+ 0 0 102 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.907 107.5 52.2 -63.2 -41.5 -4.1 -18.7 0.4 123 4 B S H > S+ 0 0 34 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.907 109.1 51.3 -59.9 -40.6 -2.3 -15.7 -1.3 124 5 B Y H X S+ 0 0 14 -4,-1.9 4,-2.8 1,-0.2 5,-0.3 0.928 111.5 47.0 -57.6 -47.5 -0.3 -15.2 1.9 125 6 B K H X S+ 0 0 49 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.876 109.5 53.2 -67.5 -39.5 0.7 -18.9 2.0 126 7 B D H < S+ 0 0 105 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.893 116.3 39.4 -62.2 -38.7 1.7 -18.9 -1.7 127 8 B A H < S+ 0 0 15 -4,-2.0 4,-0.5 66,-0.2 -2,-0.2 0.892 125.1 35.3 -77.2 -39.2 4.0 -15.9 -1.2 128 9 B M H X S+ 0 0 0 -4,-2.8 4,-3.0 -5,-0.2 5,-0.3 0.799 97.4 78.3 -91.5 -30.0 5.4 -16.8 2.1 129 10 B G H X S+ 0 0 6 -4,-2.5 4,-2.7 -5,-0.3 5,-0.2 0.899 96.5 45.0 -47.3 -56.6 5.7 -20.6 1.9 130 11 B P H > S+ 0 0 71 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.882 116.6 47.6 -57.2 -38.5 8.9 -20.7 -0.2 131 12 B L H > S+ 0 0 17 -4,-0.5 4,-1.6 -3,-0.2 -2,-0.2 0.882 110.7 49.8 -72.1 -40.9 10.5 -18.1 2.0 132 13 B V H X S+ 0 0 0 -4,-3.0 4,-0.8 2,-0.2 3,-0.2 0.931 110.0 52.6 -63.4 -42.9 9.6 -19.7 5.2 133 14 B R H >< S+ 0 0 170 -4,-2.7 3,-1.1 -5,-0.3 4,-0.4 0.939 108.3 50.1 -55.8 -49.7 11.0 -23.0 3.9 134 15 B E H 3< S+ 0 0 123 -4,-2.2 4,-0.3 1,-0.2 -1,-0.2 0.807 112.9 48.4 -55.0 -35.3 14.3 -21.3 3.0 135 16 B d H 3X S+ 0 0 0 -4,-1.6 4,-1.0 -3,-0.2 -1,-0.2 0.558 84.8 91.8 -80.5 -14.1 14.5 -19.8 6.6 136 17 B M H XX>S+ 0 0 45 -3,-1.1 5,-2.5 -4,-0.8 3,-0.5 0.879 86.7 43.8 -63.1 -43.4 13.8 -22.9 8.6 137 18 B G H >45S+ 0 0 69 -4,-0.4 3,-1.0 1,-0.2 -1,-0.2 0.894 108.9 56.3 -65.8 -42.0 17.3 -24.2 9.2 138 19 B S H 345S+ 0 0 93 -4,-0.3 -1,-0.2 1,-0.3 -2,-0.2 0.739 116.4 37.6 -61.8 -22.5 18.8 -20.7 10.1 139 20 B V H <<5S- 0 0 25 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.400 107.0-120.0-115.3 -3.5 16.3 -20.3 12.8 140 21 B S T <<5 + 0 0 96 -3,-1.0 -3,-0.2 -4,-0.5 -4,-0.1 0.835 52.1 175.1 58.5 37.7 16.1 -23.9 14.1 141 22 B A < - 0 0 18 -5,-2.5 -1,-0.2 -6,-0.2 2,-0.2 -0.398 21.2-139.7 -75.4 150.5 12.4 -24.0 13.2 142 23 B T > - 0 0 70 -2,-0.1 4,-1.8 1,-0.1 5,-0.1 -0.508 28.7-104.7 -98.7 169.9 10.2 -27.1 13.6 143 24 B E H > S+ 0 0 128 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.884 124.0 55.9 -61.4 -37.9 7.4 -28.4 11.3 144 25 B D H > S+ 0 0 112 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.892 105.3 52.0 -60.2 -37.9 4.9 -27.1 13.8 145 26 B D H > S+ 0 0 14 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.878 104.8 56.1 -66.6 -38.2 6.5 -23.6 13.5 146 27 B F H X S+ 0 0 28 -4,-1.8 4,-2.8 2,-0.2 -1,-0.2 0.953 111.1 43.9 -56.1 -48.8 6.1 -23.8 9.7 147 28 B K H X S+ 0 0 101 -4,-2.0 4,-2.4 2,-0.2 6,-0.3 0.910 111.7 53.8 -63.8 -42.7 2.4 -24.4 10.2 148 29 B T H <>S+ 0 0 32 -4,-2.6 5,-2.6 1,-0.2 -1,-0.2 0.938 114.3 40.7 -55.4 -50.0 2.1 -21.7 12.8 149 30 B V H ><5S+ 0 0 1 -4,-2.6 3,-1.5 3,-0.2 -2,-0.2 0.932 114.7 50.3 -69.3 -47.1 3.7 -19.1 10.5 150 31 B L H 3<5S+ 0 0 22 -4,-2.8 -1,-0.2 -5,-0.3 -2,-0.2 0.857 113.4 46.6 -60.4 -33.8 1.9 -20.2 7.3 151 32 B N T 3<5S- 0 0 70 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.370 109.1-124.1 -87.0 3.7 -1.5 -20.1 9.1 152 33 B R T < 5 + 0 0 81 -3,-1.5 -3,-0.2 -4,-0.2 -4,-0.1 0.850 54.5 161.2 50.5 39.4 -0.7 -16.6 10.7 153 34 B N < - 0 0 73 -5,-2.6 -1,-0.1 -6,-0.3 -2,-0.0 -0.410 54.7 -69.3 -76.9 161.6 -1.4 -18.1 14.2 154 35 B P - 0 0 73 0, 0.0 2,-1.6 0, 0.0 3,-0.2 -0.302 49.1-123.6 -50.4 132.6 -0.0 -16.4 17.3 155 36 B L + 0 0 3 1,-0.2 6,-0.1 72,-0.2 76,-0.1 -0.615 47.5 159.3 -84.7 79.7 3.8 -16.7 17.3 156 37 B E + 0 0 179 -2,-1.6 2,-0.2 4,-0.1 -1,-0.2 0.941 53.3 63.9 -72.7 -48.0 4.2 -18.3 20.7 157 38 B S S > S- 0 0 45 -3,-0.2 4,-2.1 1,-0.1 3,-0.2 -0.532 79.1-133.7 -78.3 141.6 7.6 -19.9 20.3 158 39 B R H > S+ 0 0 120 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.860 110.4 60.0 -58.3 -34.3 10.6 -17.7 19.8 159 40 B T H > S+ 0 0 43 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.918 105.5 46.0 -59.8 -42.8 11.5 -20.0 17.0 160 41 B A H > S+ 0 0 0 -3,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.884 112.6 51.4 -65.8 -40.2 8.3 -19.2 15.2 161 42 B Q H X S+ 0 0 19 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.934 113.5 43.7 -60.8 -48.2 8.9 -15.5 15.8 162 43 B e H X S+ 0 0 20 -4,-3.1 4,-2.2 2,-0.2 -2,-0.2 0.866 111.1 55.4 -66.2 -37.2 12.4 -15.7 14.4 163 44 B L H X S+ 0 0 0 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.956 111.2 43.2 -59.3 -53.4 11.1 -17.9 11.5 164 45 B L H X S+ 0 0 6 -4,-2.5 4,-2.9 2,-0.2 5,-0.2 0.909 111.9 53.9 -59.3 -43.4 8.5 -15.3 10.5 165 46 B A H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.907 109.5 49.0 -61.3 -37.0 11.0 -12.4 10.9 166 47 B d H X S+ 0 0 12 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.926 113.4 45.9 -64.8 -42.7 13.4 -14.1 8.6 167 48 B A H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.877 111.2 52.3 -71.9 -36.3 10.7 -14.7 6.0 168 49 B L H X>S+ 0 0 6 -4,-2.9 5,-2.6 2,-0.2 4,-0.7 0.831 107.2 52.7 -67.7 -32.7 9.5 -11.1 6.3 169 50 B D H ><5S+ 0 0 66 -4,-1.8 3,-0.8 -5,-0.2 5,-0.3 0.930 110.9 48.6 -64.0 -43.5 13.0 -9.9 5.7 170 51 B K H 3<5S+ 0 0 94 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.867 107.7 52.6 -63.9 -37.9 13.0 -12.1 2.6 171 52 B V H 3<5S- 0 0 7 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.562 122.7-102.9 -79.1 -10.7 9.7 -10.8 1.3 172 53 B G T <<5S+ 0 0 33 -3,-0.8 -3,-0.2 -4,-0.7 17,-0.2 0.575 87.0 118.0 107.2 14.2 10.9 -7.2 1.6 173 54 B L < + 0 0 5 -5,-2.6 8,-2.7 16,-0.1 2,-0.5 0.597 60.5 70.9 -89.0 -12.9 9.2 -5.9 4.8 174 55 B I B S-B 180 0B 11 -6,-0.5 6,-0.2 -5,-0.3 -2,-0.1 -0.927 73.4-137.2-117.1 127.4 12.3 -5.2 6.9 175 56 B S > - 0 0 10 4,-2.9 3,-2.3 -2,-0.5 -2,-0.1 -0.193 32.2-102.8 -73.9 164.9 14.7 -2.3 6.2 176 57 B P T 3 S+ 0 0 113 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.753 125.5 58.5 -57.1 -23.3 18.5 -2.6 6.4 177 58 B E T 3 S- 0 0 158 2,-0.1 -2,-0.1 0, 0.0 -3,-0.0 0.238 122.0-109.6 -91.0 8.9 18.2 -0.9 9.8 178 59 B G S < S+ 0 0 32 -3,-2.3 2,-0.3 1,-0.2 -4,-0.0 0.720 75.8 128.6 72.2 22.5 15.9 -3.7 11.0 179 60 B A - 0 0 32 37,-0.1 -4,-2.9 38,-0.0 2,-0.4 -0.769 66.0-103.6-102.2 156.9 12.6 -1.7 11.1 180 61 B I B -B 174 0B 3 -2,-0.3 -6,-0.2 -6,-0.2 6,-0.1 -0.637 42.8-114.0 -75.2 130.1 9.3 -2.6 9.5 181 62 B Y - 0 0 65 -8,-2.7 2,-0.3 -2,-0.4 31,-0.1 -0.357 36.4-168.2 -62.1 143.9 8.7 -0.6 6.3 182 63 B T > + 0 0 43 30,-0.1 3,-1.4 -2,-0.1 4,-0.3 -0.802 45.1 0.5-126.7 168.9 5.8 1.9 6.3 183 64 B G G >> S- 0 0 18 1,-0.3 3,-1.6 -2,-0.3 4,-0.7 -0.194 130.7 -0.8 58.0-134.3 3.9 4.0 3.8 184 65 B D G >4 S+ 0 0 89 1,-0.3 3,-0.9 2,-0.2 -1,-0.3 0.831 130.6 61.7 -58.0 -35.3 5.1 3.6 0.2 185 66 B D G <4 S+ 0 0 98 -3,-1.4 4,-0.4 1,-0.2 -1,-0.3 0.708 99.5 57.4 -66.2 -20.1 7.8 1.1 1.2 186 67 B L G <> S+ 0 0 0 -3,-1.6 4,-2.2 -4,-0.3 3,-0.4 0.722 89.0 77.4 -80.7 -23.2 5.0 -1.2 2.5 187 68 B M H S+ 0 0 85 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.880 112.6 47.1 -61.1 -34.4 5.4 -3.9 -2.7 189 70 B V H > S+ 0 0 4 -3,-0.4 4,-2.9 -4,-0.4 5,-0.3 0.914 110.1 50.6 -72.1 -45.8 4.9 -6.3 0.2 190 71 B M H X>S+ 0 0 6 -4,-2.2 4,-2.5 1,-0.2 5,-1.4 0.902 112.6 49.0 -57.2 -41.4 1.1 -5.8 0.4 191 72 B N H <5S+ 0 0 57 -4,-2.5 -1,-0.2 3,-0.2 -2,-0.2 0.896 112.4 47.4 -62.2 -43.5 1.0 -6.5 -3.4 192 73 B R H <5S+ 0 0 132 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.942 120.4 36.6 -66.1 -46.0 3.1 -9.6 -3.1 193 74 B L H <5S- 0 0 7 -4,-2.9 -66,-0.2 1,-0.1 -2,-0.2 0.829 140.7 -0.2 -76.4 -36.3 1.2 -11.1 -0.2 194 75 B Y T <5S- 0 0 30 -4,-2.5 3,-0.4 -5,-0.3 -3,-0.2 0.637 82.6-141.8-131.6 -26.8 -2.4 -10.0 -1.0 195 76 B G < - 0 0 19 -5,-1.4 3,-0.2 -4,-0.2 -3,-0.1 -0.036 31.0 -92.9 69.6 175.2 -2.6 -8.1 -4.3 196 77 B F S S+ 0 0 4 1,-0.1 -1,-0.2 -5,-0.1 -124,-0.1 -0.190 93.5 99.8-123.8 43.5 -5.0 -5.2 -4.6 197 78 B N S S+ 0 0 130 -3,-0.4 2,-0.4 1,-0.1 -129,-0.2 0.660 74.9 66.2 -92.9 -21.9 -8.1 -6.7 -6.1 198 79 B D S > S- 0 0 76 -3,-0.2 3,-1.3 -4,-0.2 4,-0.5 -0.877 73.8-141.7-107.3 136.2 -10.0 -6.9 -2.8 199 80 B F T >> S+ 0 0 28 -2,-0.4 3,-1.4 1,-0.3 4,-1.2 0.812 100.1 71.9 -63.1 -32.7 -11.1 -3.9 -0.8 200 81 B K H 3> S+ 0 0 57 1,-0.3 4,-2.2 2,-0.2 -1,-0.3 0.841 87.9 62.8 -48.0 -38.3 -10.1 -5.8 2.4 201 82 B T H <> S+ 0 0 7 -3,-1.3 4,-2.3 1,-0.2 -1,-0.3 0.797 96.7 58.6 -61.2 -31.3 -6.4 -5.3 1.4 202 83 B V H <> S+ 0 0 2 -3,-1.4 4,-1.5 -4,-0.5 -1,-0.2 0.963 109.9 41.4 -60.4 -53.6 -6.9 -1.5 1.7 203 84 B M H X S+ 0 0 70 -4,-1.2 4,-1.8 1,-0.2 -2,-0.2 0.828 112.3 56.8 -63.2 -34.2 -8.0 -1.9 5.4 204 85 B K H X S+ 0 0 63 -4,-2.2 4,-2.5 -5,-0.2 -1,-0.2 0.917 104.8 52.3 -61.4 -44.7 -5.2 -4.4 5.9 205 86 B A H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.870 108.1 49.5 -63.4 -39.0 -2.6 -1.9 4.7 206 87 B K H X S+ 0 0 89 -4,-1.5 4,-2.7 2,-0.2 -1,-0.2 0.927 112.6 47.0 -65.7 -44.2 -3.7 0.8 7.1 207 88 B A H X S+ 0 0 15 -4,-1.8 4,-2.9 2,-0.2 5,-0.2 0.927 113.3 49.1 -62.7 -46.4 -3.6 -1.5 10.1 208 89 B V H X S+ 0 0 7 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.927 112.4 48.5 -58.8 -47.3 -0.2 -2.8 9.0 209 90 B N H X S+ 0 0 19 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.934 113.4 46.2 -57.6 -46.4 1.1 0.7 8.6 210 91 B D H X S+ 0 0 67 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.912 113.3 49.4 -67.1 -41.8 -0.2 1.8 12.0 211 92 B f H X S+ 0 0 2 -4,-2.9 4,-2.0 2,-0.2 5,-0.2 0.882 108.6 52.8 -64.0 -42.1 1.1 -1.3 13.8 212 93 B A H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -32,-0.2 0.938 111.1 47.2 -56.3 -47.3 4.6 -0.8 12.2 213 94 B N H < S+ 0 0 97 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.862 111.0 53.4 -62.8 -32.4 4.6 2.8 13.5 214 95 B Q H < S+ 0 0 138 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.873 119.6 29.7 -71.7 -37.0 3.5 1.5 16.9 215 96 B V H >X S+ 0 0 4 -4,-2.0 3,-2.4 -5,-0.1 4,-0.6 0.723 89.3 106.7 -98.1 -24.2 6.2 -1.1 17.3 216 97 B N T 3< S+ 0 0 45 -4,-2.5 -37,-0.1 1,-0.3 -38,-0.0 -0.340 89.6 19.1 -61.8 133.2 9.2 0.4 15.4 217 98 B G T 34 S+ 0 0 84 2,-0.2 -1,-0.3 -2,-0.0 -2,-0.1 0.186 110.4 79.6 93.2 -17.7 11.8 1.6 17.8 218 99 B A T <4 S+ 0 0 58 -3,-2.4 -2,-0.2 1,-0.2 -3,-0.1 0.577 93.9 40.7 -96.8 -16.2 10.5 -0.4 20.8 219 100 B Y < - 0 0 81 -4,-0.6 6,-0.2 1,-0.1 -1,-0.2 -0.773 55.0-178.5-140.3 88.4 12.0 -3.8 19.9 220 101 B P S S+ 0 0 132 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.828 70.2 80.1 -57.3 -33.7 15.6 -3.9 18.5 221 102 B D S > S- 0 0 55 1,-0.1 4,-2.8 2,-0.0 5,-0.2 -0.634 78.2-144.1 -79.0 126.9 15.5 -7.7 18.2 222 103 B R H > S+ 0 0 92 -2,-0.4 4,-2.7 2,-0.2 5,-0.2 0.809 98.6 54.9 -63.9 -30.4 13.6 -8.5 14.9 223 104 B e H > S+ 0 0 6 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.956 113.0 42.7 -66.9 -45.3 11.9 -11.6 16.4 224 105 B D H > S+ 0 0 64 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.902 113.9 52.7 -61.1 -44.3 10.6 -9.5 19.3 225 106 B L H X S+ 0 0 2 -4,-2.8 4,-2.6 -6,-0.2 -2,-0.2 0.935 112.3 43.8 -59.0 -46.4 9.6 -6.8 16.8 226 107 B I H X S+ 0 0 0 -4,-2.7 4,-2.9 2,-0.2 5,-0.3 0.878 110.2 56.4 -70.6 -36.3 7.7 -9.2 14.6 227 108 B K H X S+ 0 0 53 -4,-2.7 4,-2.1 -5,-0.2 -2,-0.2 0.968 114.7 38.5 -54.5 -53.7 6.0 -10.9 17.6 228 109 B N H X S+ 0 0 48 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.866 115.0 53.5 -68.7 -36.8 4.7 -7.5 18.7 229 110 B F H X S+ 0 0 14 -4,-2.6 4,-2.4 -5,-0.2 -2,-0.2 0.942 111.7 45.1 -61.0 -49.4 3.9 -6.3 15.2 230 111 B T H X S+ 0 0 21 -4,-2.9 4,-2.6 2,-0.2 -2,-0.2 0.879 111.6 51.5 -68.3 -34.8 1.8 -9.4 14.4 231 112 B D H X S+ 0 0 32 -4,-2.1 4,-2.1 -5,-0.3 -1,-0.2 0.935 111.3 49.6 -63.0 -42.9 0.0 -9.3 17.7 232 113 B f H X S+ 0 0 9 -4,-2.2 4,-0.7 2,-0.2 -2,-0.2 0.901 111.3 48.3 -61.0 -44.8 -0.8 -5.6 16.9 233 114 B V H >< S+ 0 0 24 -4,-2.4 3,-1.0 1,-0.2 -1,-0.2 0.933 112.4 48.8 -64.5 -41.8 -2.1 -6.5 13.4 234 115 B R H 3< S+ 0 0 101 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.845 109.7 52.5 -63.4 -36.0 -4.2 -9.4 14.8 235 116 B N H 3< S+ 0 0 134 -4,-2.1 2,-0.3 -5,-0.2 -1,-0.2 0.574 91.3 95.8 -75.5 -14.3 -5.7 -7.1 17.5 236 117 B S << 0 0 44 -3,-1.0 -29,-0.0 -4,-0.7 -28,-0.0 -0.635 360.0 360.0 -83.8 134.8 -6.7 -4.5 14.9 237 118 B Y 0 0 284 -2,-0.3 -1,-0.2 -30,-0.0 -34,-0.0 0.983 360.0 360.0 -61.4 360.0 -10.2 -4.6 13.6