==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 30-NOV-06 2O38 . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOPSEUDOMONAS PALUSTRIS; . AUTHOR Y.KIM,A.JOACHIMIAK,E.EVDOKIMOVA,O.KAGAN,A.EDWARDS,A.SAVCHENK . 179 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9941.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 138 77.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 6.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 5.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 12 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 79 44.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 4.5 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 0 0 0 4 0 2 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 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 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 1 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 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 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 28 A P > 0 0 108 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -34.4 5.5 23.5 36.4 2 29 A D H > + 0 0 96 2,-0.2 4,-1.5 1,-0.2 5,-0.2 0.871 360.0 46.7 -64.0 -39.1 5.2 21.1 33.4 3 30 A A H > S+ 0 0 71 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.918 110.1 51.3 -67.4 -48.1 3.0 23.9 31.9 4 31 A E H > S+ 0 0 59 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.868 108.6 52.8 -58.9 -39.4 5.5 26.7 32.7 5 32 A E H X S+ 0 0 48 -4,-1.9 4,-2.8 2,-0.2 -1,-0.2 0.900 109.1 45.9 -68.8 -43.6 8.4 24.8 31.2 6 33 A R H X S+ 0 0 148 -4,-1.5 4,-2.6 2,-0.2 -1,-0.2 0.901 113.0 53.2 -64.0 -35.7 6.7 24.2 27.8 7 34 A Q H X S+ 0 0 76 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.881 108.8 48.6 -67.0 -37.0 5.7 27.8 27.9 8 35 A T H X S+ 0 0 2 -4,-2.3 4,-2.3 2,-0.2 5,-0.2 0.930 111.8 49.0 -65.2 -49.2 9.4 28.8 28.5 9 36 A K H X S+ 0 0 23 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.907 109.7 51.8 -53.4 -46.6 10.5 26.6 25.6 10 37 A L H X S+ 0 0 71 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.904 110.9 47.8 -61.6 -41.4 7.9 28.1 23.3 11 38 A R H X S+ 0 0 105 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.898 112.5 47.5 -67.4 -42.4 9.0 31.7 24.2 12 39 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.911 113.2 50.1 -62.4 -41.6 12.7 30.9 23.6 13 40 A A H X S+ 0 0 0 -4,-2.5 4,-3.0 -5,-0.2 -2,-0.2 0.855 108.2 52.5 -67.0 -37.2 11.8 29.2 20.3 14 41 A Y H X S+ 0 0 160 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.952 111.5 46.2 -60.4 -49.6 9.7 32.2 19.3 15 42 A A H X S+ 0 0 20 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.927 114.7 48.5 -56.0 -48.1 12.8 34.5 20.0 16 43 A L H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 3,-0.2 0.926 112.0 47.5 -59.5 -46.9 15.0 32.1 18.1 17 44 A N H X S+ 0 0 4 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.894 109.9 53.6 -66.9 -35.4 12.7 31.8 15.1 18 45 A A H X S+ 0 0 30 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.834 108.0 50.0 -64.5 -35.9 12.4 35.7 15.0 19 46 A V H X S+ 0 0 28 -4,-1.8 4,-2.7 -3,-0.2 -2,-0.2 0.924 111.4 49.3 -68.5 -43.5 16.2 36.1 14.9 20 47 A I H <>S+ 0 0 0 -4,-2.2 5,-1.5 2,-0.2 4,-0.4 0.904 110.9 50.1 -62.2 -47.0 16.3 33.5 12.1 21 48 A D H ><5S+ 0 0 76 -4,-2.6 3,-2.4 2,-0.2 -2,-0.2 0.972 111.3 47.2 -50.7 -63.7 13.6 35.4 10.2 22 49 A R H 3<5S+ 0 0 210 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.895 109.8 53.9 -46.9 -47.7 15.4 38.8 10.6 23 50 A A T 3<5S- 0 0 49 -4,-2.7 -1,-0.3 -5,-0.1 -2,-0.2 0.580 102.8-139.3 -64.7 -10.9 18.7 37.1 9.5 24 51 A R T < 5 + 0 0 226 -3,-2.4 2,-0.3 -4,-0.4 -3,-0.2 0.729 42.8 164.9 56.4 24.2 16.7 35.9 6.4 25 52 A L < - 0 0 29 -5,-1.5 -1,-0.2 1,-0.1 -2,-0.1 -0.533 35.5-130.0 -74.4 134.7 18.5 32.6 6.7 26 53 A S > - 0 0 73 -2,-0.3 4,-2.7 1,-0.1 5,-0.1 -0.208 34.3-101.9 -62.9 169.0 17.3 29.5 4.8 27 54 A Q H > S+ 0 0 65 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.816 126.0 54.2 -64.9 -32.8 16.9 26.4 6.8 28 55 A A H > S+ 0 0 64 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.950 112.4 41.1 -65.1 -50.1 20.1 25.2 5.3 29 56 A A H > S+ 0 0 34 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.908 115.3 52.3 -64.5 -41.6 22.0 28.4 6.4 30 57 A A H X S+ 0 0 0 -4,-2.7 4,-2.9 2,-0.2 6,-0.2 0.912 107.5 51.9 -58.5 -45.2 20.2 28.3 9.8 31 58 A A H X>S+ 0 0 8 -4,-2.3 5,-2.1 1,-0.2 4,-1.1 0.932 113.1 45.2 -57.0 -47.7 21.3 24.6 10.4 32 59 A A H ><5S+ 0 0 79 -4,-1.9 3,-0.5 2,-0.2 -2,-0.2 0.932 114.6 46.1 -64.8 -45.8 24.9 25.5 9.7 33 60 A R H 3<5S+ 0 0 152 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.912 115.2 46.6 -67.3 -36.3 25.0 28.6 11.8 34 61 A L H 3<5S- 0 0 5 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.607 107.0-126.7 -79.1 -14.3 23.2 26.9 14.7 35 62 A G T <<5 + 0 0 59 -4,-1.1 2,-0.3 -3,-0.5 -3,-0.2 0.825 67.8 121.0 68.4 35.3 25.5 23.9 14.5 36 63 A I < - 0 0 21 -5,-2.1 -1,-0.3 -6,-0.2 -2,-0.1 -0.894 67.2 -84.3-126.3 160.8 22.5 21.5 14.3 37 64 A N > - 0 0 114 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.149 31.6-122.6 -50.3 142.3 21.0 18.9 12.0 38 65 A Q H > S+ 0 0 84 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.884 118.9 53.6 -56.1 -42.0 18.8 19.8 9.2 39 66 A P H > S+ 0 0 101 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.947 108.2 50.2 -56.1 -42.1 16.2 17.5 10.9 40 67 A K H > S+ 0 0 65 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.902 108.6 51.3 -63.1 -41.4 16.7 19.5 14.1 41 68 A V H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.882 105.8 54.9 -62.1 -40.8 16.2 22.9 12.3 42 69 A S H X S+ 0 0 41 -4,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.926 108.2 49.4 -58.6 -44.5 12.9 21.7 10.7 43 70 A A H <>S+ 0 0 23 -4,-1.7 5,-2.9 2,-0.2 3,-0.3 0.933 110.6 50.0 -58.0 -50.4 11.6 20.8 14.2 44 71 A L H ><5S+ 0 0 0 -4,-2.0 3,-2.1 1,-0.2 -2,-0.2 0.947 110.2 49.9 -51.4 -51.6 12.6 24.3 15.5 45 72 A R H 3<5S+ 0 0 71 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.763 114.7 45.8 -63.2 -26.4 10.9 26.1 12.6 46 73 A N T 3<5S- 0 0 105 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.205 113.5-116.3 -98.7 11.1 7.8 24.0 13.3 47 74 A Y T < 5 + 0 0 89 -3,-2.1 2,-0.9 1,-0.2 -3,-0.2 0.866 63.0 150.3 51.9 39.1 7.8 24.5 17.1 48 75 A K < + 0 0 121 -5,-2.9 3,-0.3 -6,-0.1 -1,-0.2 -0.877 13.4 162.2 -93.5 96.4 8.3 20.7 17.6 49 76 A L > + 0 0 12 -2,-0.9 3,-2.0 1,-0.2 -1,-0.1 0.347 33.1 107.8-111.2 7.8 10.2 21.2 20.8 50 77 A E T 3 S+ 0 0 162 1,-0.3 -1,-0.2 -7,-0.1 -2,-0.0 0.774 87.6 43.6 -60.1 -33.8 10.1 17.9 22.5 51 78 A G T 3 S+ 0 0 52 -3,-0.3 2,-0.5 -11,-0.1 -1,-0.3 0.134 98.5 85.5 -99.0 14.6 13.9 17.3 21.7 52 79 A F < - 0 0 4 -3,-2.0 2,-0.2 4,-0.0 -43,-0.0 -0.980 64.9-152.4-114.5 126.0 15.1 20.8 22.7 53 80 A S > - 0 0 41 -2,-0.5 4,-2.5 1,-0.1 5,-0.2 -0.524 30.6-111.9 -87.7 163.4 15.9 21.6 26.3 54 81 A V H > S+ 0 0 2 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.941 122.8 52.2 -55.9 -46.7 15.6 25.1 27.7 55 82 A E H > S+ 0 0 5 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.928 108.9 49.7 -53.5 -50.3 19.5 25.0 28.0 56 83 A R H > S+ 0 0 79 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.878 108.6 52.0 -56.9 -47.1 19.8 24.0 24.3 57 84 A L H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.884 110.6 49.5 -55.8 -42.3 17.4 26.8 23.1 58 85 A X H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.904 110.9 47.9 -66.9 -38.1 19.5 29.3 25.1 59 86 A T H X S+ 0 0 18 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.861 108.4 54.6 -74.6 -28.3 22.7 28.0 23.5 60 87 A L H X S+ 0 0 0 -4,-2.4 4,-1.2 2,-0.2 -1,-0.2 0.899 105.8 53.7 -67.5 -37.3 21.1 28.1 20.0 61 88 A L H ><>S+ 0 0 0 -4,-2.0 5,-2.0 1,-0.2 3,-0.8 0.944 107.2 51.3 -57.3 -44.6 20.3 31.8 20.8 62 89 A N H ><5S+ 0 0 11 -4,-1.9 3,-2.2 1,-0.3 111,-0.5 0.887 101.9 60.5 -60.6 -35.8 24.0 32.3 21.6 63 90 A A H 3<5S+ 0 0 36 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.789 104.7 50.1 -64.3 -30.6 24.9 30.7 18.2 64 91 A L T <<5S- 0 0 13 -4,-1.2 -1,-0.3 -3,-0.8 -2,-0.2 0.072 127.9-100.2 -95.9 25.5 23.0 33.5 16.6 65 92 A D T < 5S+ 0 0 71 -3,-2.2 101,-2.4 1,-0.2 2,-0.6 0.746 78.9 135.7 67.3 30.1 24.9 36.1 18.6 66 93 A Q E < -A 165 0A 17 -5,-2.0 99,-0.3 99,-0.2 -1,-0.2 -0.953 47.0-141.7-111.1 116.9 22.2 36.7 21.2 67 94 A D E -A 164 0A 10 97,-2.4 97,-1.9 -2,-0.6 2,-0.4 -0.353 11.1-152.4 -61.2 148.9 23.3 37.0 24.9 68 95 A V E -Ab 163 175A 0 106,-2.1 108,-2.6 95,-0.2 2,-0.5 -0.985 10.5-171.8-132.3 118.1 21.0 35.4 27.4 69 96 A E E -Ab 162 176A 34 93,-2.9 93,-3.7 -2,-0.4 2,-0.8 -0.970 10.1-155.0-116.2 122.4 21.0 36.8 30.9 70 97 A I E -Ab 161 177A 0 106,-3.4 108,-2.7 -2,-0.5 2,-0.5 -0.850 13.5-166.7 -99.6 106.5 19.1 34.9 33.5 71 98 A V E -Ab 160 178A 12 89,-3.3 89,-3.0 -2,-0.8 2,-0.5 -0.854 4.2-159.3-101.0 128.0 18.1 37.3 36.3 72 99 A I E +Ab 159 179A 5 106,-3.1 108,-2.8 -2,-0.5 2,-0.3 -0.901 18.7 167.6-110.6 125.9 16.8 36.0 39.6 73 100 A R E -A 158 0A 102 85,-2.0 85,-3.6 -2,-0.5 2,-0.1 -0.982 40.7-104.2-138.6 142.8 14.7 38.3 41.8 74 101 A K E -A 157 0A 116 106,-0.5 83,-0.3 -2,-0.3 82,-0.1 -0.439 48.0-109.8 -61.2 137.4 12.5 37.9 44.9 75 102 A K - 0 0 28 81,-3.2 7,-0.1 1,-0.1 4,-0.1 -0.349 44.4 -86.5 -60.2 149.6 8.9 38.1 43.9 76 103 A P > - 0 0 60 0, 0.0 3,-0.9 0, 0.0 -1,-0.1 -0.341 27.9-126.4 -52.1 143.0 7.1 41.3 45.0 77 104 A R T 3 S+ 0 0 228 1,-0.3 2,-0.5 -3,-0.1 -2,-0.1 0.819 113.4 61.3 -54.7 -32.3 5.6 41.0 48.5 78 105 A S T 3 S+ 0 0 120 2,-0.0 2,-0.3 0, 0.0 -1,-0.3 -0.331 93.8 72.9 -97.1 46.4 2.4 42.1 46.6 79 106 A R < - 0 0 68 -3,-0.9 3,-0.1 -2,-0.5 -4,-0.0 -0.944 65.4-150.7-153.2 144.9 2.3 39.1 44.3 80 107 A A S S+ 0 0 98 -2,-0.3 2,-0.4 1,-0.2 -1,-0.1 0.772 77.3 38.4 -91.7 -29.3 1.3 35.5 45.2 81 108 A A - 0 0 57 75,-0.0 -1,-0.2 0, 0.0 2,-0.2 -0.978 69.0-136.1-129.5 136.8 3.3 33.5 42.7 82 109 A A - 0 0 11 71,-0.5 2,-0.3 -2,-0.4 76,-0.1 -0.510 30.1-165.5 -77.6 158.3 6.8 33.8 41.2 83 110 A R - 0 0 122 -2,-0.2 76,-2.7 73,-0.1 2,-0.5 -0.944 24.5-123.8-145.0 156.7 7.2 33.3 37.4 84 111 A I E -c 159 0A 8 -2,-0.3 2,-0.3 74,-0.2 76,-0.2 -0.903 36.4-178.2 -98.3 130.7 9.7 32.7 34.6 85 112 A S E -c 160 0A 41 74,-2.7 76,-3.2 -2,-0.5 2,-0.5 -0.936 22.1-141.5-127.6 157.3 9.5 35.3 31.9 86 113 A V E -c 161 0A 37 -2,-0.3 2,-0.3 74,-0.2 76,-0.2 -0.988 27.4-178.8-121.6 124.8 11.3 35.8 28.6 87 114 A V E -c 162 0A 50 74,-3.0 76,-3.2 -2,-0.5 2,-0.4 -0.946 23.7-134.8-130.3 145.9 12.2 39.3 27.7 88 115 A A E c 163 0A 89 -2,-0.3 76,-0.2 74,-0.2 74,-0.1 -0.829 360.0 360.0 -98.6 134.6 14.0 41.2 24.8 89 116 A A 0 0 82 74,-2.7 76,-0.5 -2,-0.4 0, 0.0 -0.760 360.0 360.0-142.9 360.0 16.6 43.9 25.6 90 !* 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 91 27 B X 0 0 190 0, 0.0 3,-0.3 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 137.6 30.6 24.4 24.8 92 28 B P > - 0 0 111 0, 0.0 4,-1.4 0, 0.0 3,-0.3 -0.263 360.0 -1.8 -90.8 -56.7 28.8 22.1 24.9 93 29 B D H > S+ 0 0 84 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.846 126.9 63.8 -66.0 -29.8 28.1 20.2 28.2 94 30 B A H > S+ 0 0 41 -3,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.891 101.3 49.3 -60.0 -41.9 30.6 22.4 29.9 95 31 B E H > S+ 0 0 44 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.900 111.5 49.9 -65.1 -37.8 28.4 25.5 29.3 96 32 B E H X S+ 0 0 50 -4,-1.4 4,-2.5 2,-0.2 -2,-0.2 0.924 108.7 51.4 -67.1 -42.2 25.4 23.6 30.6 97 33 B R H X S+ 0 0 140 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.898 109.9 51.3 -59.5 -40.8 27.2 22.6 33.8 98 34 B Q H X S+ 0 0 104 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.916 109.3 48.6 -62.8 -47.4 28.2 26.2 34.4 99 35 B T H X S+ 0 0 1 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.930 112.2 49.5 -57.7 -50.2 24.6 27.4 34.0 100 36 B K H X S+ 0 0 26 -4,-2.5 4,-2.9 1,-0.2 -1,-0.2 0.887 109.3 51.9 -55.3 -44.4 23.4 24.8 36.4 101 37 B L H X S+ 0 0 87 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.892 111.8 46.6 -63.5 -40.2 26.1 25.7 39.0 102 38 B R H X S+ 0 0 98 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.900 114.2 46.4 -68.9 -42.8 25.1 29.3 38.9 103 39 B L H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.894 113.2 50.7 -63.2 -41.7 21.4 28.6 39.1 104 40 B A H X S+ 0 0 0 -4,-2.9 4,-2.6 2,-0.2 -2,-0.2 0.872 108.3 51.8 -65.6 -37.1 22.2 26.2 42.0 105 41 B Y H X S+ 0 0 137 -4,-2.4 4,-3.0 2,-0.2 5,-0.2 0.953 110.4 49.1 -62.1 -46.0 24.2 28.8 43.8 106 42 B A H X S+ 0 0 4 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.922 113.1 46.7 -61.0 -41.6 21.3 31.2 43.4 107 43 B L H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.895 113.5 48.1 -64.5 -43.3 18.9 28.6 44.8 108 44 B N H X S+ 0 0 4 -4,-2.6 4,-2.9 1,-0.2 -2,-0.2 0.900 109.4 53.7 -66.0 -38.3 21.2 27.7 47.7 109 45 B A H X S+ 0 0 8 -4,-3.0 4,-2.7 2,-0.2 -1,-0.2 0.886 108.4 49.6 -64.7 -36.7 21.7 31.4 48.5 110 46 B V H X S+ 0 0 11 -4,-1.8 4,-2.6 -5,-0.2 -2,-0.2 0.927 111.5 48.3 -66.6 -46.6 17.9 31.8 48.7 111 47 B I H X>S+ 0 0 3 -4,-2.3 5,-1.7 2,-0.2 4,-0.5 0.931 112.3 51.3 -55.1 -43.9 17.6 28.8 51.1 112 48 B D H ><5S+ 0 0 84 -4,-2.9 3,-1.2 2,-0.2 -2,-0.2 0.950 111.7 44.2 -59.6 -53.9 20.5 30.3 53.1 113 49 B R H 3<5S+ 0 0 163 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.896 112.2 52.0 -62.1 -42.0 18.9 33.7 53.5 114 50 B A H 3<5S- 0 0 58 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.559 104.7-136.6 -68.3 -9.1 15.5 32.1 54.3 115 51 B R T <<5 + 0 0 223 -3,-1.2 2,-0.3 -4,-0.5 -3,-0.2 0.809 40.4 171.3 56.6 33.5 17.4 30.1 57.0 116 52 B L < - 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