==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PHEROMONE BINDING PROTEIN 20-MAY-08 3D78 . COMPND 2 MOLECULE: PHEROMONE-BINDING PROTEIN ASP1; . SOURCE 2 ORGANISM_SCIENTIFIC: APIS MELLIFERA; . AUTHOR M.E.PESENTI,S.SPINELLI,V.BEZIRARD,L.BRIAND,J.C.PERNOLLET, . 238 2 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12265.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 165 69.3 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 . 7 2.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 116 48.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 3.4 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 1 2 2 0 0 3 0 2 1 2 0 0 0 0 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 A 0 0 65 0, 0.0 116,-0.1 0, 0.0 118,-0.0 0.000 360.0 360.0 360.0 165.6 16.9 12.6 11.0 2 2 A P > - 0 0 34 0, 0.0 3,-1.6 0, 0.0 115,-0.0 -0.193 360.0-110.8 -57.0 158.6 15.4 14.4 14.1 3 3 A D T 3 S+ 0 0 173 1,-0.3 0, 0.0 3,-0.0 0, 0.0 0.688 112.1 63.2 -69.4 -17.9 13.5 12.2 16.5 4 4 A W T 3 S+ 0 0 35 2,-0.1 -1,-0.3 71,-0.0 73,-0.1 0.593 71.4 116.7 -80.4 -14.3 10.1 13.8 15.6 5 5 A V S < S- 0 0 10 -3,-1.6 5,-0.1 1,-0.1 69,-0.1 -0.373 75.1-113.6 -63.6 124.4 10.1 12.7 11.9 6 6 A P >> - 0 0 39 0, 0.0 3,-1.8 0, 0.0 4,-0.5 -0.385 19.2-128.8 -56.6 131.5 7.2 10.3 11.3 7 7 A P H >> S+ 0 0 106 0, 0.0 3,-1.1 0, 0.0 4,-0.6 0.811 104.8 66.0 -47.9 -35.7 8.5 6.8 10.5 8 8 A E H >> S+ 0 0 124 1,-0.2 4,-2.8 2,-0.2 3,-0.8 0.796 87.3 68.5 -61.6 -28.8 6.3 6.7 7.4 9 9 A V H <> S+ 0 0 17 -3,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.864 91.5 60.5 -61.8 -30.7 8.3 9.4 5.7 10 10 A F H << S+ 0 0 87 -3,-1.1 -1,-0.2 -4,-0.5 4,-0.2 0.860 113.3 36.8 -66.5 -33.3 11.4 7.1 5.5 11 11 A D H X< S+ 0 0 127 -3,-0.8 3,-1.1 -4,-0.6 4,-0.5 0.881 113.0 56.8 -83.4 -41.2 9.3 4.8 3.3 12 12 A L H 3< S+ 0 0 78 -4,-2.8 4,-0.3 1,-0.3 3,-0.3 0.850 112.9 41.4 -58.2 -37.5 7.4 7.5 1.4 13 13 A V T 3X S+ 0 0 10 -4,-2.3 4,-3.0 -5,-0.2 -1,-0.3 0.517 87.2 95.9 -87.3 -7.0 10.6 9.1 0.2 14 14 A A H <> S+ 0 0 50 -3,-1.1 4,-2.0 1,-0.2 5,-0.2 0.873 84.5 46.1 -60.3 -42.2 12.5 6.0 -0.7 15 15 A E H > S+ 0 0 158 -4,-0.5 4,-2.0 -3,-0.3 -1,-0.2 0.949 119.0 40.5 -65.6 -49.7 11.7 5.9 -4.4 16 16 A D H > S+ 0 0 28 -4,-0.3 4,-3.1 1,-0.2 5,-0.3 0.822 110.1 59.1 -73.7 -29.6 12.4 9.6 -5.0 17 17 A K H X S+ 0 0 38 -4,-3.0 4,-2.7 2,-0.2 5,-0.3 0.951 108.8 45.2 -59.1 -48.0 15.5 9.6 -2.7 18 18 A A H X S+ 0 0 64 -4,-2.0 4,-2.1 -5,-0.2 -2,-0.2 0.935 116.6 45.3 -62.6 -47.5 17.1 7.0 -4.9 19 19 A R H X S+ 0 0 90 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.943 115.2 46.2 -62.3 -48.3 16.1 8.8 -8.1 20 20 A a H X S+ 0 0 0 -4,-3.1 4,-1.8 2,-0.2 6,-0.3 0.879 110.9 51.6 -65.1 -40.6 17.2 12.2 -6.9 21 21 A M H X>S+ 0 0 34 -4,-2.7 5,-1.3 -5,-0.3 4,-1.2 0.933 112.8 47.3 -62.2 -42.7 20.6 11.0 -5.5 22 22 A S H <5S+ 0 0 103 -4,-2.1 3,-0.4 -5,-0.3 -2,-0.2 0.928 111.9 49.5 -63.3 -43.8 21.3 9.3 -8.9 23 23 A E H <5S+ 0 0 64 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.823 121.3 33.7 -65.0 -32.3 20.3 12.4 -10.8 24 24 A H H <5S- 0 0 52 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.431 103.7-117.7-110.4 -0.9 22.4 14.8 -8.8 25 25 A G T <5 + 0 0 55 -4,-1.2 -3,-0.2 -3,-0.4 -4,-0.1 0.723 54.7 169.4 71.8 22.7 25.4 12.6 -7.9 26 26 A T < - 0 0 12 -5,-1.3 2,-0.3 -6,-0.3 -1,-0.2 -0.371 22.7-148.8 -73.4 140.4 24.5 13.0 -4.2 27 27 A T > - 0 0 69 1,-0.1 4,-1.3 -2,-0.1 3,-0.2 -0.795 23.1-123.6-103.8 152.8 26.2 10.8 -1.5 28 28 A Q H > S+ 0 0 81 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.868 112.7 62.7 -58.3 -34.0 24.7 9.6 1.7 29 29 A A H > S+ 0 0 58 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.908 101.2 49.8 -60.2 -40.8 27.7 11.4 3.5 30 30 A Q H > S+ 0 0 29 -3,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.853 111.6 49.3 -62.3 -37.1 26.6 14.8 2.1 31 31 A I H X S+ 0 0 0 -4,-1.3 4,-1.6 1,-0.2 3,-0.3 0.927 106.6 54.4 -69.1 -44.8 23.1 14.1 3.4 32 32 A D H X S+ 0 0 78 -4,-2.7 4,-0.6 1,-0.2 -2,-0.2 0.834 106.9 55.2 -57.0 -34.3 24.4 13.0 6.8 33 33 A D H ><>S+ 0 0 61 -4,-1.7 5,-3.2 2,-0.2 3,-0.6 0.866 100.3 54.6 -69.0 -41.1 26.2 16.5 7.0 34 34 A V H ><5S+ 0 0 4 -4,-1.4 3,-2.1 -3,-0.3 5,-0.2 0.951 107.2 54.2 -56.2 -43.7 23.1 18.7 6.4 35 35 A N H 3<5S+ 0 0 59 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.683 106.5 50.2 -67.8 -18.9 21.6 16.9 9.3 36 36 A K T <<5S- 0 0 131 -3,-0.6 -1,-0.3 -4,-0.6 -2,-0.2 0.184 126.0-100.3-102.7 15.9 24.5 17.7 11.5 37 37 A G T < 5S+ 0 0 30 -3,-2.1 2,-0.4 1,-0.1 -3,-0.2 0.724 86.7 124.2 83.5 17.9 24.3 21.4 10.5 38 38 A N < + 0 0 96 -5,-3.2 2,-0.4 -6,-0.1 -3,-0.1 -0.557 32.6 165.2-113.0 71.7 27.0 21.3 8.0 39 39 A L - 0 0 14 -2,-0.4 2,-0.4 -5,-0.2 -8,-0.0 -0.649 12.8-172.5 -94.5 132.1 25.4 22.6 4.8 40 40 A V - 0 0 72 -2,-0.4 2,-1.8 2,-0.1 6,-0.2 -0.935 33.0-114.0-120.4 149.4 27.5 23.7 1.8 41 41 A N + 0 0 58 -2,-0.4 58,-0.1 4,-0.1 3,-0.0 -0.574 65.2 132.8 -85.4 78.1 26.3 25.4 -1.3 42 42 A E >> - 0 0 95 -2,-1.8 4,-2.5 1,-0.1 3,-2.1 -1.000 59.4-131.8-127.3 127.3 27.1 22.7 -3.8 43 43 A P H 3>>S+ 0 0 11 0, 0.0 4,-2.0 0, 0.0 5,-0.7 0.793 101.6 70.3 -51.8 -31.2 24.5 21.6 -6.4 44 44 A S H 345S+ 0 0 22 1,-0.2 -18,-0.1 3,-0.2 -20,-0.1 0.800 117.8 22.1 -59.5 -25.5 25.0 17.9 -5.7 45 45 A I H <>5S+ 0 0 2 -3,-2.1 4,-2.0 -5,-0.1 -1,-0.2 0.789 125.4 49.5-105.8 -40.1 23.3 18.5 -2.3 46 46 A T H X5S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.916 115.1 44.3 -70.4 -38.3 21.2 21.7 -2.9 47 47 A b H X5S+ 0 0 1 -4,-2.0 4,-2.6 -5,-0.3 -1,-0.2 0.790 108.9 59.3 -75.5 -27.1 19.6 20.4 -6.1 48 48 A Y H ><>S+ 0 0 33 -4,-2.6 5,-2.4 -5,-0.2 3,-1.0 0.940 110.5 50.4 -59.4 -46.6 10.9 18.7 -2.3 54 54 A E H ><5S+ 0 0 73 -4,-2.9 3,-1.9 -5,-0.3 -1,-0.2 0.883 101.3 63.2 -62.3 -36.0 9.6 18.9 -5.9 55 55 A A H 3<5S+ 0 0 27 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.773 109.7 39.9 -57.3 -29.6 8.7 15.2 -5.8 56 56 A F T <<5S- 0 0 58 -3,-1.0 -1,-0.3 -4,-0.9 -2,-0.2 0.219 115.2-114.5-105.2 13.0 6.2 15.9 -3.0 57 57 A S T < 5S+ 0 0 72 -3,-1.9 -3,-0.2 2,-0.2 12,-0.2 0.661 76.0 134.4 60.5 21.5 5.0 19.1 -4.6 58 58 A L S - 0 0 73 4,-1.5 3,-2.3 -2,-0.3 -6,-0.1 -0.209 48.7 -71.6 -91.1-172.5 6.9 24.5 -7.6 61 61 A D T 3 S+ 0 0 85 1,-0.3 36,-0.1 2,-0.1 96,-0.0 0.571 133.9 46.6 -62.3 -14.6 9.0 25.0 -10.8 62 62 A E T 3 S- 0 0 111 2,-0.1 -1,-0.3 34,-0.1 38,-0.0 0.095 119.4-107.2-111.0 18.1 10.6 28.2 -9.4 63 63 A A < + 0 0 0 -3,-2.3 2,-0.5 1,-0.2 -2,-0.1 0.769 66.6 151.0 64.3 30.6 11.3 26.7 -6.0 64 64 A N - 0 0 52 27,-0.1 -4,-1.5 26,-0.0 -1,-0.2 -0.812 46.8-119.8 -90.3 127.9 8.6 28.6 -4.0 65 65 A V B -A 59 0A 24 -2,-0.5 2,-0.8 -6,-0.2 -6,-0.3 -0.439 9.6-138.3 -68.6 138.2 7.4 26.6 -1.1 66 66 A D > - 0 0 62 -8,-2.7 4,-2.3 1,-0.2 5,-0.2 -0.899 15.9-164.2 -92.6 105.9 3.7 25.6 -0.9 67 67 A E H > S+ 0 0 74 -2,-0.8 4,-2.8 1,-0.2 5,-0.2 0.853 84.7 54.2 -63.1 -38.3 3.0 26.3 2.8 68 68 A D H > S+ 0 0 132 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.927 111.6 43.2 -60.6 -46.6 -0.3 24.2 2.8 69 69 A I H > S+ 0 0 65 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.899 114.1 51.9 -70.6 -39.1 1.4 21.1 1.4 70 70 A M H X S+ 0 0 40 -4,-2.3 4,-1.9 2,-0.2 3,-0.4 0.941 111.7 45.8 -60.6 -48.8 4.4 21.6 3.8 71 71 A L H < S+ 0 0 19 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.870 108.9 57.9 -63.6 -37.4 2.1 21.9 6.8 72 72 A G H < S+ 0 0 66 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.858 109.8 42.8 -55.1 -38.0 0.1 18.8 5.6 73 73 A L H < S+ 0 0 75 -4,-1.5 -2,-0.2 -3,-0.4 -1,-0.2 0.840 99.6 84.2 -83.0 -34.0 3.2 16.7 5.6 74 74 A L S < S- 0 0 24 -4,-1.9 5,-0.1 -5,-0.2 -69,-0.0 -0.381 90.0-102.3 -70.8 145.4 4.5 17.9 8.9 75 75 A P > - 0 0 27 0, 0.0 3,-1.9 0, 0.0 4,-0.4 -0.227 30.3-108.7 -65.2 159.6 3.2 16.2 12.1 76 76 A D G > S+ 0 0 150 1,-0.3 3,-1.5 2,-0.2 4,-0.4 0.871 117.5 66.3 -55.6 -36.0 0.6 18.1 14.2 77 77 A Q G 3 S+ 0 0 151 1,-0.3 4,-0.3 2,-0.1 -1,-0.3 0.691 104.1 42.6 -55.7 -27.6 3.3 18.6 16.8 78 78 A L G <> S+ 0 0 2 -3,-1.9 4,-3.0 1,-0.1 5,-0.3 0.388 83.7 99.6-104.3 2.0 5.3 20.9 14.5 79 79 A Q H <> S+ 0 0 60 -3,-1.5 4,-2.5 -4,-0.4 5,-0.2 0.928 86.5 42.0 -59.4 -49.9 2.5 23.0 13.0 80 80 A E H > S+ 0 0 172 -4,-0.4 4,-1.7 2,-0.2 -1,-0.2 0.947 119.0 43.7 -63.3 -50.0 2.9 26.0 15.3 81 81 A R H > S+ 0 0 98 -4,-0.3 4,-2.4 1,-0.2 -2,-0.2 0.918 115.4 49.2 -62.0 -43.0 6.7 26.1 15.1 82 82 A A H X S+ 0 0 2 -4,-3.0 4,-2.7 1,-0.2 5,-0.2 0.904 107.9 53.0 -66.4 -39.9 6.7 25.4 11.3 83 83 A Q H X S+ 0 0 114 -4,-2.5 4,-1.8 -5,-0.3 -1,-0.2 0.894 110.3 49.0 -63.5 -36.5 4.2 28.2 10.6 84 84 A S H X S+ 0 0 73 -4,-1.7 4,-1.7 2,-0.2 -2,-0.2 0.943 111.3 48.9 -66.2 -50.1 6.4 30.6 12.5 85 85 A V H X S+ 0 0 12 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.895 110.4 51.0 -55.6 -43.9 9.5 29.5 10.6 86 86 A M H X S+ 0 0 14 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.865 105.7 56.1 -62.7 -39.1 7.7 29.9 7.3 87 87 A G H < S+ 0 0 54 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.914 114.2 40.3 -56.8 -40.7 6.6 33.4 8.2 88 88 A K H < S+ 0 0 108 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.742 124.5 34.0 -81.7 -26.5 10.3 34.3 8.8 89 89 A c H < S+ 0 0 13 -4,-1.7 -2,-0.2 -5,-0.1 -1,-0.2 0.418 92.9 123.4-115.4 -10.1 11.9 32.5 5.8 90 90 A L < + 0 0 30 -4,-1.9 2,-0.1 -5,-0.2 -26,-0.0 -0.928 43.1 51.8-113.0 150.5 9.4 32.7 3.0 91 91 A P S S- 0 0 109 0, 0.0 -27,-0.1 0, 0.0 -1,-0.0 0.317 84.8-128.4 -73.7 153.6 9.1 33.6 0.2 92 92 A T - 0 0 13 -2,-0.1 2,-0.3 -29,-0.1 8,-0.1 -0.290 29.9-175.7 -61.5 150.7 12.2 31.8 -1.1 93 93 A S + 0 0 82 7,-0.3 2,-0.3 6,-0.1 10,-0.1 -0.990 20.2 110.4-152.4 148.3 14.7 34.0 -3.1 94 94 A G - 0 0 23 -2,-0.3 29,-0.2 1,-0.1 6,-0.1 -0.937 69.8 -82.0 160.8 169.0 17.9 33.3 -5.0 95 95 A S S S- 0 0 51 -2,-0.3 29,-0.8 28,-0.1 2,-0.3 0.792 105.2 -0.7 -73.4 -33.3 19.6 33.1 -8.4 96 96 A D S > S- 0 0 5 27,-0.2 4,-2.4 28,-0.1 5,-0.2 -0.878 86.2 -87.1-146.0 178.6 18.3 29.6 -9.3 97 97 A N H > S+ 0 0 3 -2,-0.3 4,-1.7 2,-0.2 5,-0.2 0.899 123.9 48.2 -62.7 -39.5 16.2 26.8 -7.8 98 98 A b H > S+ 0 0 2 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.931 111.8 48.9 -69.4 -44.4 19.0 25.1 -6.0 99 99 A N H > S+ 0 0 13 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.875 107.3 57.0 -57.9 -40.2 20.3 28.4 -4.5 100 100 A K H X S+ 0 0 24 -4,-2.4 4,-2.2 2,-0.2 -7,-0.3 0.919 109.7 44.7 -58.7 -41.6 16.7 29.2 -3.4 101 101 A I H X S+ 0 0 5 -4,-1.7 4,-3.1 2,-0.2 5,-0.2 0.917 112.3 51.5 -72.3 -40.0 16.6 25.9 -1.4 102 102 A Y H X S+ 0 0 44 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.964 111.9 47.4 -54.6 -48.0 20.1 26.5 0.0 103 103 A N H X S+ 0 0 63 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.895 112.2 50.0 -63.6 -40.1 19.0 30.0 1.1 104 104 A L H X S+ 0 0 24 -4,-2.2 4,-2.5 -5,-0.2 5,-0.2 0.946 110.3 49.5 -62.3 -48.4 15.8 28.6 2.6 105 105 A A H X S+ 0 0 6 -4,-3.1 4,-2.7 1,-0.2 -2,-0.2 0.913 111.1 49.6 -59.6 -44.3 17.7 25.9 4.5 106 106 A K H X S+ 0 0 86 -4,-2.6 4,-1.3 -5,-0.2 -1,-0.2 0.907 110.8 50.7 -61.7 -41.0 20.2 28.5 5.9 107 107 A c H X S+ 0 0 35 -4,-2.1 4,-0.8 -5,-0.2 3,-0.3 0.924 112.5 45.0 -62.6 -43.7 17.2 30.6 7.0 108 108 A V H >X S+ 0 0 12 -4,-2.5 4,-2.9 1,-0.2 3,-0.7 0.944 108.9 58.3 -68.8 -39.8 15.5 27.8 8.8 109 109 A Q H 3< S+ 0 0 55 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.790 96.6 64.0 -58.2 -31.4 18.8 26.7 10.4 110 110 A E H 3< S+ 0 0 169 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.893 122.7 11.4 -61.9 -46.4 19.3 30.0 12.1 111 111 A S H << S+ 0 0 61 -4,-0.8 -2,-0.2 -3,-0.7 -1,-0.2 0.776 141.1 26.8 -97.2 -40.9 16.2 29.9 14.4 112 112 A A >X + 0 0 5 -4,-2.9 3,-2.2 -5,-0.3 4,-0.7 -0.568 57.5 165.9-137.4 64.1 15.1 26.3 14.1 113 113 A P T 34 S+ 0 0 63 0, 0.0 3,-0.4 0, 0.0 -1,-0.1 0.798 79.8 55.8 -58.5 -28.0 17.9 23.9 13.3 114 114 A D T 34 S+ 0 0 66 1,-0.2 -5,-0.1 -6,-0.1 -2,-0.0 0.486 95.1 67.1 -82.7 -4.8 15.8 20.9 14.2 115 115 A V T <4 S+ 0 0 17 -3,-2.2 2,-0.3 -7,-0.2 -1,-0.2 0.744 96.2 57.1 -88.4 -30.5 12.9 21.7 11.9 116 116 A W < + 0 0 29 -4,-0.7 2,-0.3 -3,-0.4 -11,-0.0 -0.777 63.7 155.4-103.4 148.0 14.8 21.2 8.7 117 117 A F - 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0 0 12 -2,-0.8 2,-0.3 -5,-0.2 -9,-0.0 -0.828 9.6-175.2 -99.7 125.7 6.0 25.0 -24.0 160 40 B V - 0 0 78 -2,-0.5 2,-1.8 -10,-0.1 6,-0.1 -0.909 34.7-112.5-122.1 153.7 3.8 24.1 -27.0 161 41 B N + 0 0 74 -2,-0.3 58,-0.1 4,-0.1 3,-0.0 -0.531 64.0 136.2 -89.2 71.7 4.9 22.5 -30.2 162 42 B E >> - 0 0 104 -2,-1.8 4,-2.7 1,-0.1 3,-1.9 -0.982 55.0-137.9-115.5 127.4 4.1 25.4 -32.5 163 43 B P H 3>>S+ 0 0 76 0, 0.0 4,-2.0 0, 0.0 5,-0.6 0.816 100.1 69.4 -60.8 -27.1 6.8 26.1 -35.2 164 44 B S H 345S+ 0 0 29 1,-0.2 -18,-0.1 3,-0.2 -20,-0.1 0.797 117.2 23.9 -59.2 -27.0 6.5 29.9 -34.5 165 45 B I H <>5S+ 0 0 3 -3,-1.9 4,-2.1 -5,-0.1 -1,-0.2 0.762 124.3 49.7-100.2 -39.7 8.1 29.3 -31.1 166 46 B T H X5S+ 0 0 1 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.926 114.0 45.9 -70.6 -41.7 10.1 26.0 -31.7 167 47 B e H X5S+ 0 0 16 -4,-2.0 4,-2.5 -5,-0.3 -1,-0.2 0.822 108.2 58.9 -67.5 -28.3 11.7 27.3 -34.9 168 48 B Y H ><>S+ 0 0 21 -4,-2.4 5,-2.7 -5,-0.2 3,-0.5 0.920 110.1 50.3 -57.9 -45.4 20.6 28.7 -31.1 174 54 B E H ><5S+ 0 0 79 -4,-2.9 3,-1.7 1,-0.2 -1,-0.2 0.878 103.9 58.9 -60.8 -38.4 21.9 28.8 -34.6 175 55 B A H 3<5S+ 0 0 28 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.807 108.5 44.9 -58.7 -35.2 22.7 32.5 -34.3 176 56 B F T <<5S- 0 0 66 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.233 117.9-114.8 -90.8 10.6 25.1 31.6 -31.4 177 57 B S T < 5S+ 0 0 91 -3,-1.7 -3,-0.2 2,-0.1 -2,-0.1 0.762 80.4 128.3 59.4 29.7 26.5 28.6 -33.4 178 58 B L < + 0 0 15 -5,-2.7 8,-2.9 -6,-0.2 2,-0.3 0.578 68.3 36.1 -92.1 -12.6 25.0 26.2 -30.9 179 59 B V B S-B 185 0B 10 -6,-0.5 6,-0.2 6,-0.2 -2,-0.1 -0.968 70.1-145.1-135.6 154.3 23.3 24.1 -33.6 180 60 B D > - 0 0 69 4,-1.3 3,-1.8 -2,-0.3 -6,-0.1 -0.256 50.5 -72.8-100.1-169.2 24.1 23.1 -37.1 181 61 B D T 3 S+ 0 0 136 1,-0.3 36,-0.1 2,-0.1 -7,-0.0 0.601 133.2 46.6 -67.6 -13.3 21.8 22.6 -40.1 182 62 B E T 3 S- 0 0 121 2,-0.1 -1,-0.3 35,-0.1 3,-0.1 0.142 119.3-105.1-111.2 15.8 20.3 19.3 -38.6 183 63 B A < + 0 0 0 -3,-1.8 2,-0.4 1,-0.3 29,-0.2 0.762 64.8 158.4 62.5 26.8 19.7 20.8 -35.1 184 64 B N - 0 0 65 27,-0.1 -4,-1.3 26,-0.0 2,-0.3 -0.708 38.5-130.0 -71.3 126.7 22.8 18.8 -33.7 185 65 B V B -B 179 0B 28 -2,-0.4 2,-1.4 -6,-0.2 -6,-0.2 -0.654 3.6-132.0 -87.1 137.6 23.8 20.7 -30.5 186 66 B D > - 0 0 70 -8,-2.9 4,-2.5 -2,-0.3 5,-0.2 -0.688 29.3-176.5 -80.9 90.7 27.3 21.9 -29.7 187 67 B E H > S+ 0 0 67 -2,-1.4 4,-2.6 1,-0.2 5,-0.3 0.873 74.6 54.6 -61.8 -38.1 27.2 20.5 -26.2 188 68 B D H > S+ 0 0 132 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.920 113.4 38.4 -70.0 -40.5 30.6 21.8 -25.3 189 69 B I H > S+ 0 0 87 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.898 114.8 54.8 -76.9 -36.6 30.0 25.5 -26.2 190 70 B M H X S+ 0 0 19 -4,-2.5 4,-0.5 1,-0.2 3,-0.4 0.960 114.6 40.8 -59.4 -48.5 26.4 25.4 -24.9 191 71 B L H >< S+ 0 0 21 -4,-2.6 3,-1.3 1,-0.2 -2,-0.2 0.920 112.0 57.0 -63.7 -42.3 27.8 24.2 -21.5 192 72 B G H 3< S+ 0 0 48 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.771 103.0 53.3 -62.3 -28.2 30.8 26.6 -21.7 193 73 B L H 3< S+ 0 0 106 -4,-1.9 -1,-0.3 -3,-0.4 -2,-0.2 0.603 90.8 94.4 -82.4 -14.5 28.6 29.7 -22.0 194 74 B L S << S- 0 0 27 -3,-1.3 5,-0.1 -4,-0.5 -69,-0.0 -0.536 88.8 -99.0 -74.9 145.5 26.5 28.8 -18.9 195 75 B P > - 0 0 41 0, 0.0 4,-3.0 0, 0.0 3,-0.4 -0.274 46.2 -96.5 -57.6 155.9 27.5 30.3 -15.5 196 76 B D H > S+ 0 0 127 1,-0.3 4,-2.2 2,-0.2 5,-0.2 0.830 122.1 44.5 -47.8 -50.5 29.5 27.9 -13.3 197 77 B Q H > S+ 0 0 70 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.914 116.7 44.7 -66.9 -39.2 26.6 26.6 -11.3 198 78 B L H > S+ 0 0 4 -3,-0.4 4,-2.9 2,-0.2 -2,-0.2 0.866 109.3 57.4 -69.4 -35.9 24.3 26.1 -14.2 199 79 B Q H X S+ 0 0 68 -4,-3.0 4,-1.6 2,-0.2 -2,-0.2 0.941 108.4 47.5 -59.2 -44.4 27.1 24.5 -16.2 200 80 B E H X S+ 0 0 98 -4,-2.2 4,-0.7 -5,-0.3 3,-0.2 0.937 115.4 43.8 -62.8 -47.3 27.5 21.9 -13.5 201 81 B R H X S+ 0 0 22 -4,-2.1 4,-1.4 1,-0.2 3,-0.4 0.891 113.4 52.5 -61.9 -40.3 23.8 21.2 -13.3 202 82 B A H X S+ 0 0 0 -4,-2.9 4,-3.4 1,-0.2 5,-0.4 0.739 91.6 74.2 -74.9 -21.0 23.4 21.2 -17.0 203 83 B Q H X S+ 0 0 131 -4,-1.6 4,-1.6 -3,-0.2 -1,-0.2 0.926 105.1 37.2 -59.3 -44.9 26.2 18.6 -17.6 204 84 B S H X S+ 0 0 59 -4,-0.7 4,-1.8 -3,-0.4 -1,-0.2 0.916 118.0 49.6 -74.2 -42.5 24.0 15.8 -16.3 205 85 B V H X S+ 0 0 15 -4,-1.4 4,-2.8 1,-0.2 -2,-0.2 0.914 114.8 44.3 -63.2 -42.7 20.8 17.2 -17.9 206 86 B M H X S+ 0 0 6 -4,-3.4 4,-1.7 2,-0.2 -1,-0.2 0.824 107.3 60.1 -73.6 -30.0 22.5 17.6 -21.3 207 87 B G H < S+ 0 0 47 -4,-1.6 -1,-0.2 -5,-0.4 -2,-0.2 0.908 114.5 37.3 -53.7 -43.9 24.1 14.2 -20.9 208 88 B K H < S+ 0 0 131 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.925 121.5 42.0 -76.8 -45.5 20.5 12.8 -20.7 209 89 B f H < S+ 0 0 12 -4,-2.8 -2,-0.2 -5,-0.2 -3,-0.2 0.512 96.1 112.8 -88.4 -9.0 18.8 15.1 -23.2 210 90 B L < + 0 0 19 -4,-1.7 2,-0.1 -5,-0.2 -26,-0.0 -0.902 44.7 53.0-113.7 147.1 21.5 15.1 -26.0 211 91 B P S S- 0 0 116 0, 0.0 -27,-0.1 0, 0.0 -4,-0.0 0.444 89.5-122.5 -76.9 160.0 21.8 14.2 -28.7 212 92 B T - 0 0 15 -29,-0.2 2,-0.3 -2,-0.1 8,-0.1 -0.242 30.4-173.9 -66.0 151.0 18.7 15.7 -30.1 213 93 B S + 0 0 84 7,-0.3 2,-0.3 6,-0.1 10,-0.1 -0.990 23.2 106.5-147.6 147.2 16.1 13.6 -31.9 214 94 B G S S- 0 0 37 -2,-0.3 6,-0.1 1,-0.1 3,-0.0 -0.920 70.9 -83.5 162.5 172.4 12.9 14.4 -33.8 215 95 B S S S+ 0 0 105 -2,-0.3 2,-0.3 1,-0.0 -1,-0.1 0.761 104.9 0.7 -78.3 -30.7 11.2 14.6 -37.1 216 96 B D S > S- 0 0 78 -3,-0.1 4,-2.4 1,-0.1 5,-0.2 -0.894 85.8 -87.9-145.8-179.4 12.6 18.1 -38.1 217 97 B N H > S+ 0 0 44 -2,-0.3 4,-1.7 1,-0.2 5,-0.2 0.900 124.4 47.6 -63.2 -40.0 14.8 20.8 -36.7 218 98 B e H > S+ 0 0 17 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.910 112.4 48.7 -70.6 -42.5 12.0 22.6 -34.8 219 99 B N H > S+ 0 0 34 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.881 107.7 56.4 -64.0 -37.4 10.7 19.3 -33.3 220 100 B K H X S+ 0 0 37 -4,-2.4 4,-2.0 2,-0.2 -7,-0.3 0.914 110.2 44.0 -59.1 -41.7 14.2 18.4 -32.2 221 101 B I H X S+ 0 0 0 -4,-1.7 4,-2.9 2,-0.2 5,-0.2 0.914 113.0 51.9 -75.4 -35.6 14.5 21.6 -30.3 222 102 B Y H X S+ 0 0 45 -4,-2.4 4,-2.9 2,-0.2 5,-0.2 0.955 111.0 47.7 -57.1 -49.1 11.0 21.2 -28.8 223 103 B N H X S+ 0 0 65 -4,-3.1 4,-2.1 1,-0.2 -2,-0.2 0.898 112.6 49.5 -62.8 -39.3 11.9 17.7 -27.7 224 104 B L H X S+ 0 0 3 -4,-2.0 4,-2.5 -5,-0.2 -1,-0.2 0.939 111.7 47.4 -61.1 -52.8 15.2 19.0 -26.1 225 105 B A H X S+ 0 0 0 -4,-2.9 4,-3.0 1,-0.2 5,-0.2 0.917 112.5 49.8 -56.7 -46.3 13.4 21.8 -24.3 226 106 B K H X S+ 0 0 81 -4,-2.9 4,-1.6 -5,-0.2 -1,-0.2 0.901 111.6 49.2 -57.7 -45.1 10.7 19.4 -23.0 227 107 B f H X S+ 0 0 28 -4,-2.1 4,-1.2 -5,-0.2 5,-0.2 0.910 114.1 44.7 -61.1 -43.6 13.5 17.0 -21.8 228 108 B V H >X S+ 0 0 0 -4,-2.5 4,-3.5 1,-0.2 3,-0.6 0.948 111.9 52.0 -68.7 -47.3 15.4 19.8 -20.0 229 109 B Q H 3< S+ 0 0 24 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.804 102.8 60.1 -63.0 -29.1 12.3 21.3 -18.4 230 110 B E H 3< S+ 0 0 153 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.896 120.8 24.0 -65.2 -40.6 11.2 17.9 -17.0 231 111 B S H << S+ 0 0 35 -4,-1.2 -2,-0.2 -3,-0.6 -3,-0.1 0.913 140.0 23.0 -85.2 -45.9 14.4 17.6 -14.9 232 112 B A >X + 0 0 6 -4,-3.5 3,-2.1 -5,-0.2 4,-0.8 -0.713 60.3 176.9-137.9 79.6 15.3 21.2 -14.6 233 113 B P T 34 S+ 0 0 21 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.732 84.5 50.0 -52.8 -38.0 12.5 23.8 -15.0 234 114 B D T 34 S+ 0 0 15 1,-0.2 -5,-0.1 -5,-0.1 3,-0.0 0.411 100.9 66.0 -99.9 3.8 14.7 26.8 -14.3 235 115 B V T <4 S+ 0 0 8 -3,-2.1 2,-0.8 -7,-0.2 -1,-0.2 0.891 86.3 65.8 -93.9 -46.4 17.5 25.9 -16.8 236 116 B W < + 0 0 24 -4,-0.8 2,-0.3 -11,-0.1 -1,-0.1 -0.716 68.2 160.6 -81.7 111.6 15.8 26.1 -20.2 237 117 B F - 0 0 55 -2,-0.8 2,-0.3 -116,-0.0 -3,-0.0 -0.881 26.5-148.4-129.5 162.4 14.9 29.7 -20.9 238 118 B V 0 0 6 -2,-0.3 -83,-0.1 -87,-0.2 -69,-0.0 -0.965 360.0 360.0-130.4 142.6 14.0 31.8 -23.9 239 119 B I 0 0 24 -2,-0.3 -67,-0.1 -118,-0.0 -2,-0.0 -0.922 360.0 360.0-116.8 360.0 14.6 35.5 -24.7