==== 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 ELECTRON TRANSPORT 14-MAR-04 1SOF . COMPND 2 MOLECULE: BACTERIOFERRITIN; . SOURCE 2 ORGANISM_SCIENTIFIC: AZOTOBACTER VINELANDII; . AUTHOR H.L.LIU,J.F.HUANG,R.C.BI . 1240 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 54947.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1064 85.8 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 . 0 0.0 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 . 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 . 44 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 72 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 888 71.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 27 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 0 0 6 1 1 0 0 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 8 4 2 16 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 . 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 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 M 0 0 135 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 113.0 14.5 8.9 91.8 2 2 A K - 0 0 177 64,-0.1 64,-0.2 1,-0.1 2,-0.1 -0.304 360.0-158.1 -52.3 115.7 10.7 9.0 92.6 3 3 A G - 0 0 19 62,-2.1 2,-0.2 59,-0.2 -1,-0.1 -0.442 30.1 -75.0 -94.0 172.0 10.6 10.5 96.1 4 4 A D > - 0 0 67 -2,-0.1 4,-2.6 1,-0.1 5,-0.2 -0.477 37.1-137.3 -68.7 128.9 7.8 10.3 98.7 5 5 A K H > S+ 0 0 173 -2,-0.2 4,-1.8 1,-0.2 -1,-0.1 0.896 103.0 45.7 -53.5 -49.8 4.8 12.5 97.9 6 6 A I H > S+ 0 0 71 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.864 110.9 54.9 -64.7 -35.2 4.2 13.8 101.4 7 7 A V H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.951 107.6 49.3 -61.3 -48.4 8.0 14.4 101.8 8 8 A I H X S+ 0 0 27 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.848 109.4 53.0 -59.0 -35.2 7.8 16.5 98.6 9 9 A Q H X S+ 0 0 112 -4,-1.8 4,-1.5 -5,-0.2 -1,-0.2 0.907 109.8 47.7 -67.3 -40.9 4.9 18.4 100.1 10 10 A H H X S+ 0 0 37 -4,-2.3 4,-2.5 2,-0.2 3,-0.3 0.930 109.9 52.6 -63.4 -47.4 6.8 19.1 103.3 11 11 A L H X S+ 0 0 2 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.871 108.2 51.4 -56.1 -39.8 9.8 20.3 101.2 12 12 A N H X S+ 0 0 35 -4,-1.9 4,-1.8 -5,-0.2 -1,-0.2 0.837 109.3 50.5 -68.0 -32.5 7.6 22.7 99.3 13 13 A K H X S+ 0 0 99 -4,-1.5 4,-1.5 -3,-0.3 -2,-0.2 0.920 110.1 48.1 -70.9 -44.8 6.2 24.1 102.5 14 14 A I H X S+ 0 0 3 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.899 111.1 54.2 -60.5 -39.5 9.7 24.7 104.0 15 15 A L H X S+ 0 0 0 -4,-2.0 4,-2.4 -5,-0.2 -1,-0.2 0.883 103.5 53.0 -62.7 -43.1 10.6 26.4 100.7 16 16 A G H X S+ 0 0 16 -4,-1.8 4,-1.0 1,-0.2 59,-0.5 0.866 108.6 51.9 -62.0 -34.3 7.7 28.8 100.7 17 17 A N H X S+ 0 0 49 -4,-1.5 4,-1.9 2,-0.2 3,-0.2 0.905 109.6 48.0 -67.5 -43.8 8.8 29.9 104.2 18 18 A E H X S+ 0 0 9 -4,-1.8 4,-3.1 1,-0.2 5,-0.2 0.919 104.5 59.2 -64.1 -45.0 12.4 30.6 103.1 19 19 A L H X S+ 0 0 15 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.834 107.4 48.8 -54.1 -33.1 11.3 32.5 100.1 20 20 A I H X S+ 0 0 23 -4,-1.0 4,-3.1 -3,-0.2 -1,-0.2 0.935 110.1 50.1 -70.8 -48.2 9.5 34.9 102.5 21 21 A A H X S+ 0 0 2 -4,-1.9 4,-3.4 1,-0.2 5,-0.4 0.953 107.7 54.7 -53.4 -54.2 12.6 35.2 104.7 22 22 A I H X S+ 0 0 21 -4,-3.1 4,-1.8 1,-0.2 -1,-0.2 0.912 114.2 39.5 -45.6 -55.3 14.8 36.0 101.7 23 23 A N H X S+ 0 0 34 -4,-1.6 4,-2.0 -5,-0.2 -1,-0.2 0.900 116.8 49.9 -65.9 -42.5 12.5 38.9 100.7 24 24 A Q H X S+ 0 0 1 -4,-3.1 4,-2.2 1,-0.2 -2,-0.2 0.952 113.6 44.0 -62.6 -50.3 11.9 40.1 104.2 25 25 A Y H X S+ 0 0 0 -4,-3.4 4,-2.5 1,-0.2 -1,-0.2 0.838 111.1 55.8 -65.3 -32.4 15.6 40.1 105.2 26 26 A F H X S+ 0 0 31 -4,-1.8 4,-2.0 -5,-0.4 -1,-0.2 0.908 109.8 44.8 -67.7 -39.6 16.5 41.7 102.0 27 27 A L H X S+ 0 0 10 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.880 114.5 48.6 -70.4 -39.6 14.1 44.7 102.5 28 28 A H H X S+ 0 0 0 -4,-2.2 4,-3.3 2,-0.2 5,-0.2 0.915 109.7 53.3 -65.9 -42.3 15.2 45.1 106.1 29 29 A A H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.946 112.5 43.0 -57.4 -50.3 18.8 45.0 105.1 30 30 A R H X S+ 0 0 18 -4,-2.0 4,-2.9 2,-0.2 -1,-0.2 0.824 113.0 53.5 -66.4 -31.3 18.3 47.8 102.6 31 31 A M H X S+ 0 0 22 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.954 110.8 45.7 -66.5 -48.6 16.2 49.7 105.0 32 32 A Y H X>S+ 0 0 0 -4,-3.3 5,-2.5 2,-0.2 4,-0.9 0.943 113.9 49.5 -56.4 -50.2 19.0 49.5 107.7 33 33 A E H ><5S+ 0 0 69 -4,-2.8 3,-2.1 1,-0.2 -2,-0.2 0.970 110.3 50.9 -52.3 -56.2 21.5 50.5 105.0 34 34 A D H 3<5S+ 0 0 48 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.837 108.3 52.4 -51.0 -39.2 19.3 53.4 104.0 35 35 A W H 3<5S- 0 0 48 -4,-2.3 -1,-0.3 -5,-0.1 -2,-0.2 0.606 120.6-107.7 -76.3 -11.2 19.0 54.6 107.6 36 36 A G T <<5S+ 0 0 18 -3,-2.1 2,-1.1 -4,-0.9 -3,-0.2 0.599 77.5 133.2 95.7 12.0 22.7 54.6 108.0 37 37 A L >< + 0 0 3 -5,-2.5 4,-2.4 1,-0.2 3,-0.3 -0.605 24.8 170.0 -98.5 74.4 23.0 51.5 110.2 38 38 A E H > S+ 0 0 113 -2,-1.1 4,-2.7 116,-1.0 5,-0.2 0.888 71.1 50.5 -47.5 -59.9 25.9 49.8 108.4 39 39 A K H > S+ 0 0 97 114,-1.8 4,-1.1 1,-0.2 -1,-0.2 0.852 115.4 45.4 -53.6 -37.2 26.6 47.0 110.9 40 40 A L H > S+ 0 0 0 113,-0.8 4,-1.9 -3,-0.3 -1,-0.2 0.870 111.4 50.8 -76.6 -38.2 23.0 46.1 111.0 41 41 A G H X S+ 0 0 0 -4,-2.4 4,-2.2 112,-0.3 -2,-0.2 0.913 107.6 54.5 -65.7 -40.4 22.5 46.2 107.3 42 42 A K H X S+ 0 0 122 -4,-2.7 4,-1.5 1,-0.2 -1,-0.2 0.861 109.1 47.6 -61.1 -37.9 25.5 43.9 106.7 43 43 A H H X S+ 0 0 53 -4,-1.1 4,-2.2 -5,-0.2 -1,-0.2 0.908 111.4 47.8 -73.1 -42.1 24.1 41.3 109.0 44 44 A E H X S+ 0 0 0 -4,-1.9 4,-2.8 1,-0.2 -2,-0.2 0.892 108.5 57.9 -63.6 -38.8 20.6 41.2 107.5 45 45 A Y H X S+ 0 0 82 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.898 108.1 45.0 -58.3 -43.2 22.2 41.0 104.1 46 46 A H H X S+ 0 0 111 -4,-1.5 4,-2.3 2,-0.2 -1,-0.2 0.896 110.9 51.5 -71.1 -38.9 24.1 37.8 105.0 47 47 A E H X S+ 0 0 20 -4,-2.2 4,-2.6 1,-0.2 5,-0.2 0.934 109.3 54.6 -60.3 -40.0 21.0 36.3 106.6 48 48 A S H X S+ 0 0 0 -4,-2.8 4,-1.6 1,-0.2 -2,-0.2 0.930 109.5 44.4 -55.6 -50.8 19.3 37.1 103.4 49 49 A I H X S+ 0 0 49 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.818 110.9 57.2 -64.1 -31.6 22.0 35.3 101.4 50 50 A D H X S+ 0 0 51 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.923 104.7 48.5 -66.3 -46.4 21.8 32.4 103.8 51 51 A E H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.871 108.3 56.6 -62.2 -34.7 18.0 31.9 103.3 52 52 A M H X S+ 0 0 46 -4,-1.6 4,-2.2 -5,-0.2 -1,-0.2 0.893 105.4 50.9 -62.6 -39.7 18.8 32.0 99.6 53 53 A K H X S+ 0 0 100 -4,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.875 109.6 50.3 -65.8 -37.7 21.3 29.1 100.1 54 54 A H H X S+ 0 0 9 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.929 110.6 48.5 -65.9 -45.5 18.6 27.1 102.0 55 55 A A H X S+ 0 0 5 -4,-2.5 4,-2.9 2,-0.2 -2,-0.2 0.913 108.8 53.9 -60.9 -43.0 16.0 27.6 99.3 56 56 A D H X S+ 0 0 25 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.934 110.0 48.2 -57.4 -46.3 18.6 26.5 96.7 57 57 A K H X S+ 0 0 106 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.890 111.1 49.4 -63.1 -40.0 19.2 23.3 98.6 58 58 A L H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.902 110.5 51.8 -65.8 -39.7 15.5 22.6 99.0 59 59 A I H X S+ 0 0 4 -4,-2.9 4,-2.4 2,-0.2 5,-0.3 0.961 108.4 49.6 -61.7 -51.5 15.0 23.2 95.3 60 60 A K H X S+ 0 0 97 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.916 111.3 49.3 -54.9 -44.8 17.8 20.8 94.3 61 61 A R H X S+ 0 0 37 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.891 110.5 51.5 -62.3 -39.8 16.4 18.0 96.6 62 62 A I H <>S+ 0 0 0 -4,-2.1 5,-3.2 2,-0.2 -2,-0.2 0.929 109.8 47.2 -63.8 -47.2 12.8 18.5 95.2 63 63 A L H ><5S+ 0 0 15 -4,-2.4 3,-1.2 3,-0.2 -1,-0.2 0.886 113.0 50.1 -63.2 -38.0 13.9 18.2 91.5 64 64 A F H 3<5S+ 0 0 87 -4,-2.0 -2,-0.2 -5,-0.3 -1,-0.2 0.944 107.9 51.4 -64.3 -47.3 15.9 15.1 92.3 65 65 A L T 3<5S- 0 0 2 -4,-2.5 -62,-2.1 -5,-0.2 -1,-0.3 0.341 121.8-116.2 -72.1 9.4 13.0 13.5 94.2 66 66 A E T < 5S+ 0 0 95 -3,-1.2 -3,-0.2 -64,-0.2 2,-0.1 0.771 71.0 132.4 60.5 35.8 11.2 14.4 90.9 67 67 A G < - 0 0 13 -5,-3.2 -1,-0.2 -6,-0.1 -62,-0.0 -0.416 60.2-105.1-103.4-177.7 8.7 16.9 92.4 68 68 A L - 0 0 132 -2,-0.1 -5,-0.0 2,-0.0 -9,-0.0 -0.919 32.8-125.5-116.5 110.6 7.8 20.4 91.2 69 69 A P - 0 0 17 0, 0.0 2,-0.4 0, 0.0 3,-0.2 0.044 12.3-140.7 -48.2 156.7 9.3 23.5 93.0 70 70 A N + 0 0 45 1,-0.2 3,-0.2 -58,-0.1 -11,-0.0 -0.592 47.1 139.8-122.4 78.3 6.9 26.0 94.3 71 71 A L + 0 0 7 -2,-0.4 -1,-0.2 1,-0.2 109,-0.1 0.913 60.7 78.5 -74.6 -41.3 8.5 29.4 93.8 72 72 A Q S S+ 0 0 64 -3,-0.2 2,-0.6 107,-0.1 -1,-0.2 0.660 77.7 73.3 -38.1 -42.5 5.1 30.9 92.7 73 73 A E - 0 0 137 -3,-0.2 2,-0.6 1,-0.0 -54,-0.1 -0.751 58.1-172.1 -94.6 121.0 3.5 31.3 96.1 74 74 A L - 0 0 33 -2,-0.6 156,-0.1 156,-0.1 -57,-0.1 -0.938 16.1-149.3-107.9 109.4 4.8 34.2 98.3 75 75 A G - 0 0 31 -2,-0.6 -1,-0.0 -59,-0.5 -58,-0.0 0.092 41.0 -55.3 -66.2-174.3 3.4 34.0 101.8 76 76 A K - 0 0 164 1,-0.1 2,-0.3 2,-0.0 -1,-0.1 0.014 52.0-143.9 -55.4 171.1 2.7 37.0 104.1 77 77 A L - 0 0 17 -3,-0.1 2,-0.9 -54,-0.1 -1,-0.1 -0.872 1.3-147.7-149.8 109.0 5.6 39.3 104.8 78 78 A L - 0 0 59 -2,-0.3 2,-0.5 11,-0.1 15,-0.1 -0.672 20.5-176.2 -82.0 106.9 6.2 41.1 108.1 79 79 A I - 0 0 65 -2,-0.9 2,-0.1 10,-0.0 7,-0.1 -0.903 13.0-145.7-106.6 128.3 7.8 44.4 107.5 80 80 A G - 0 0 4 -2,-0.5 3,-0.1 1,-0.1 4,-0.0 -0.441 9.1-149.8 -87.5 164.7 8.8 46.6 110.5 81 81 A E S S+ 0 0 167 1,-0.2 2,-0.3 -2,-0.1 -1,-0.1 0.680 81.0 20.2-103.6 -26.3 8.7 50.3 110.6 82 82 A H S > S- 0 0 101 1,-0.1 4,-2.4 0, 0.0 3,-0.3 -0.894 89.4 -95.4-137.7 167.1 11.6 50.8 113.1 83 83 A T H > S+ 0 0 10 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.915 119.0 52.0 -49.0 -56.8 14.6 48.8 114.3 84 84 A K H > S+ 0 0 81 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.879 115.4 42.3 -50.4 -43.8 13.0 47.3 117.4 85 85 A E H > S+ 0 0 62 -3,-0.3 4,-2.9 2,-0.2 -1,-0.2 0.829 111.1 55.0 -73.3 -34.2 10.0 46.1 115.4 86 86 A M H X S+ 0 0 0 -4,-2.4 4,-1.5 2,-0.2 -2,-0.2 0.829 107.9 50.5 -67.7 -33.4 12.1 44.8 112.5 87 87 A L H X S+ 0 0 0 -4,-2.3 4,-1.7 -5,-0.2 -2,-0.2 0.911 113.5 45.4 -70.6 -42.2 14.1 42.7 114.9 88 88 A E H X S+ 0 0 98 -4,-1.5 4,-2.7 -5,-0.2 -2,-0.2 0.924 110.5 51.1 -68.3 -46.6 10.9 41.3 116.4 89 89 A C H X S+ 0 0 18 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.889 111.4 49.7 -58.4 -39.3 9.2 40.5 113.1 90 90 A D H X S+ 0 0 0 -4,-1.5 4,-1.7 1,-0.2 -1,-0.2 0.882 112.0 48.2 -66.0 -38.5 12.4 38.7 111.9 91 91 A L H X S+ 0 0 23 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.838 110.6 51.1 -70.3 -33.9 12.4 36.8 115.2 92 92 A K H X S+ 0 0 141 -4,-2.7 4,-1.4 2,-0.2 -2,-0.2 0.882 107.4 53.3 -71.2 -37.2 8.7 35.9 114.8 93 93 A L H X S+ 0 0 27 -4,-2.1 4,-1.2 2,-0.2 -2,-0.2 0.917 111.0 45.8 -63.6 -46.1 9.2 34.6 111.2 94 94 A E H >X S+ 0 0 8 -4,-1.7 4,-1.8 1,-0.2 3,-1.1 0.979 115.3 45.6 -61.8 -54.8 12.0 32.3 112.3 95 95 A Q H 3< S+ 0 0 92 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.702 108.2 58.3 -62.9 -20.4 10.1 30.9 115.3 96 96 A A H 3< S+ 0 0 67 -4,-1.4 4,-0.3 1,-0.2 -1,-0.3 0.781 113.1 39.5 -79.4 -26.2 6.9 30.6 113.2 97 97 A G H XX S+ 0 0 14 -4,-1.2 4,-1.5 -3,-1.1 3,-0.9 0.700 93.1 82.8 -94.6 -22.3 8.7 28.2 110.8 98 98 A L H >X S+ 0 0 20 -4,-1.8 4,-2.0 1,-0.3 3,-0.8 0.937 90.8 53.2 -47.9 -54.2 10.8 26.3 113.3 99 99 A P H 3> S+ 0 0 79 0, 0.0 4,-2.0 0, 0.0 -1,-0.3 0.851 104.3 57.6 -49.9 -36.0 7.8 24.0 114.0 100 100 A D H <> S+ 0 0 62 -3,-0.9 4,-1.5 -4,-0.3 -2,-0.2 0.877 107.0 46.5 -62.1 -41.8 7.5 23.3 110.3 101 101 A L H S+ 0 0 0 -4,-2.9 5,-2.3 1,-0.2 4,-0.4 0.882 111.6 51.1 -57.7 -39.5 11.2 12.0 106.8 109 109 A E H ><5S+ 0 0 77 -4,-2.0 3,-1.0 -5,-0.2 -1,-0.2 0.911 107.3 53.2 -63.5 -43.7 12.3 9.8 109.6 110 110 A S H 3<5S+ 0 0 105 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.775 114.8 39.7 -66.8 -27.9 9.0 7.9 109.7 111 111 A V T 3<5S- 0 0 54 -4,-1.6 -1,-0.2 -3,-0.2 -2,-0.2 0.316 115.6-107.4-105.3 9.0 9.1 7.1 105.9 112 112 A G T < 5S+ 0 0 38 -3,-1.0 2,-1.3 -4,-0.4 3,-0.2 0.659 72.3 136.9 79.8 14.4 12.8 6.3 105.7 113 113 A D >< + 0 0 23 -5,-2.3 4,-1.5 -6,-0.2 -1,-0.2 -0.678 17.3 161.1 -94.4 79.5 14.0 9.4 103.8 114 114 A Y H > + 0 0 135 -2,-1.3 4,-2.2 2,-0.2 -1,-0.2 0.757 68.2 58.6 -72.1 -26.2 17.2 9.9 105.9 115 115 A A H > S+ 0 0 53 2,-0.2 4,-2.2 -3,-0.2 -1,-0.2 0.944 107.1 46.6 -69.4 -46.2 18.9 12.0 103.3 116 116 A S H > S+ 0 0 1 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.888 110.7 54.8 -62.2 -36.8 16.1 14.6 103.3 117 117 A R H X S+ 0 0 74 -4,-1.5 4,-3.5 1,-0.2 -2,-0.2 0.959 108.6 46.5 -59.5 -52.9 16.2 14.5 107.1 118 118 A E H X S+ 0 0 99 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.861 110.6 53.4 -57.7 -39.8 19.9 15.3 107.3 119 119 A L H X S+ 0 0 36 -4,-2.2 4,-1.4 2,-0.2 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108.7 51.4 -55.6 -32.1 12.0 27.2 78.8 243 87 B L H X S+ 0 0 0 -4,-2.1 4,-1.3 -5,-0.3 -1,-0.2 0.892 111.3 46.7 -73.0 -41.0 14.0 29.3 76.4 244 88 B E H X S+ 0 0 73 -4,-1.4 4,-2.9 -5,-0.2 -2,-0.2 0.891 108.8 53.3 -69.4 -41.0 10.9 30.8 74.9 245 89 B C H X S+ 0 0 14 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.870 109.3 50.5 -62.8 -35.0 9.2 31.6 78.2 246 90 B D H X S+ 0 0 0 -4,-1.2 4,-1.4 -5,-0.3 -1,-0.2 0.827 110.5 49.5 -71.7 -30.9 12.4 33.4 79.3 247 91 B L H X S+ 0 0 23 -4,-1.3 4,-1.8 2,-0.2 -2,-0.2 0.924 109.9 50.8 -72.8 -43.5 12.3 35.4 76.1 248 92 B K H X S+ 0 0 113 -4,-2.9 4,-1.7 1,-0.2 3,-0.2 0.925 109.5 50.1 -58.7 -46.3 8.6 36.3 76.5 249 93 B L H < S+ 0 0 22 -4,-2.2 4,-0.3 1,-0.2 -1,-0.2 0.876 110.6 50.8 -59.8 -38.5 9.2 37.5 80.1 250 94 B E H < S+ 0 0 6 -4,-1.4 4,-0.4 1,-0.2 -1,-0.2 0.809 114.3 43.1 -70.3 -30.4 12.1 39.7 78.9 251 95 B Q H < S+ 0 0 80 -4,-1.8 -1,-0.2 -3,-0.2 -2,-0.2 0.646 106.8 59.2 -90.2 -17.5 10.0 41.2 76.1 252 96 B A S < S+ 0 0 68 -4,-1.7 4,-0.3 -5,-0.2 -1,-0.2 0.481 108.9 48.1 -87.1 -3.1 6.9 41.8 78.2 253 97 B G S > S+ 0 0 12 -4,-0.3 4,-1.9 -3,-0.2 -2,-0.2 0.568 92.6 75.0-108.6 -18.2 9.0 43.9 80.5 254 98 B L H > S+ 0 0 12 -4,-0.4 4,-2.3 2,-0.2 5,-0.2 0.893 92.6 55.4 -61.0 -41.3 10.7 46.1 77.8 255 99 B P H > S+ 0 0 84 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.955 107.5 51.1 -50.7 -53.1 7.5 48.1 77.3 256 100 B D H > S+ 0 0 34 -4,-0.3 4,-2.5 2,-0.2 -2,-0.2 0.870 108.6 47.7 -51.3 -54.3 7.5 48.9 80.9 257 101 B L H X S+ 0 0 8 -4,-1.9 4,-2.8 2,-0.2 5,-0.2 0.941 112.9 48.7 -59.1 -49.8 11.1 50.1 81.1 258 102 B K H X S+ 0 0 61 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.899 112.9 48.4 -57.8 -42.2 10.8 52.4 78.0 259 103 B A H X S+ 0 0 53 -4,-2.5 4,-2.0 -5,-0.2 -1,-0.2 0.897 112.7 48.3 -65.2 -41.4 7.5 53.8 79.4 260 104 B A H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.865 110.7 50.4 -67.9 -38.3 9.2 54.4 82.8 261 105 B I H X S+ 0 0 0 -4,-2.8 4,-1.5 2,-0.2 -2,-0.2 0.908 110.1 50.8 -65.3 -43.9 12.2 56.1 81.2 262 106 B A H X S+ 0 0 41 -4,-2.2 4,-1.8 -5,-0.2 -2,-0.2 0.912 109.0 52.2 -61.0 -41.7 10.0 58.4 79.2 263 107 B Y H X S+ 0 0 50 -4,-2.0 4,-1.1 1,-0.2 -2,-0.2 0.936 105.7 52.7 -61.4 -46.8 8.1 59.3 82.4 264 108 B C H <>S+ 0 0 0 -4,-2.1 5,-1.8 1,-0.2 4,-0.3 0.834 106.9 54.9 -58.7 -32.6 11.2 60.2 84.3 265 109 B E H ><5S+ 0 0 33 -4,-1.5 3,-1.4 1,-0.2 -1,-0.2 0.953 106.2 49.8 -63.9 -51.9 12.3 62.6 81.4 266 110 B S H 3<5S+ 0 0 92 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.670 116.2 42.5 -64.4 -17.8 9.0 64.5 81.5 267 111 B V T 3<5S- 0 0 48 -4,-1.1 -1,-0.3 -3,-0.2 -2,-0.2 0.273 112.0-112.0-112.8 11.0 9.2 65.0 85.3 268 112 B G T < 5S+ 0 0 12 -3,-1.4 2,-1.5 -4,-0.3 3,-0.3 0.573 71.3 135.6 74.2 10.8 12.9 65.9 85.6 269 113 B D >< + 0 0 12 -5,-1.8 4,-1.7 1,-0.2 -1,-0.2 -0.503 17.8 156.9 -89.5 67.3 14.0 62.7 87.5 270 114 B Y H > + 0 0 14 -2,-1.5 4,-2.3 1,-0.2 -1,-0.2 0.818 66.0 59.2 -63.8 -33.1 17.1 62.2 85.3 271 115 B A H > S+ 0 0 3 -3,-0.3 4,-1.4 1,-0.2 -1,-0.2 0.964 106.8 47.2 -61.6 -48.9 19.0 60.2 87.9 272 116 B S H > S+ 0 0 1 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.890 110.0 54.8 -59.0 -38.9 16.2 57.6 88.0 273 117 B R H X S+ 0 0 0 -4,-1.7 4,-3.4 1,-0.2 -1,-0.2 0.933 104.2 52.6 -60.1 -45.9 16.3 57.6 84.2 274 118 B E H X S+ 0 0 14 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.810 108.9 52.4 -59.6 -29.8 20.0 56.8 84.1 275 119 B L H X S+ 0 0 40 -4,-1.4 4,-1.2 -3,-0.2 -1,-0.2 0.898 113.1 41.2 -73.9 -41.0 19.3 53.9 86.4 276 120 B L H X S+ 0 0 1 -4,-2.0 4,-2.9 2,-0.2 -2,-0.2 0.879 107.8 64.8 -72.2 -37.1 16.6 52.5 84.1 277 121 B E H X S+ 0 0 5 -4,-3.4 4,-1.7 1,-0.2 -2,-0.2 0.905 106.1 42.2 -50.2 -48.1 18.8 53.3 81.1 278 122 B D H X S+ 0 0 96 -4,-1.5 4,-1.8 2,-0.2 -1,-0.2 0.793 111.3 53.2 -74.8 -28.1 21.4 50.8 82.3 279 123 B I H X S+ 0 0 3 -4,-1.2 4,-1.9 2,-0.2 -2,-0.2 0.896 108.1 54.7 -70.9 -36.7 18.9 48.1 83.3 280 124 B L H X S+ 0 0 1 -4,-2.9 4,-2.1 2,-0.2 5,-0.2 0.922 105.6 49.8 -59.7 -48.7 17.5 48.5 79.8 281 125 B E H X S+ 0 0 75 -4,-1.7 4,-0.9 1,-0.2 -1,-0.2 0.949 112.1 49.0 -56.7 -48.0 20.9 47.9 78.1 282 126 B S H X S+ 0 0 24 -4,-1.8 4,-1.4 1,-0.2 -1,-0.2 0.824 108.5 54.2 -61.6 -33.4 21.3 44.7 80.2 283 127 B E H X S+ 0 0 5 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.869 105.1 50.9 -70.4 -39.9 17.8 43.5 79.3 284 128 B E H X S+ 0 0 8 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.705 106.1 61.2 -69.1 -16.9 18.4 43.7 75.6 285 129 B D H X S+ 0 0 105 -4,-0.9 4,-1.9 -5,-0.2 -2,-0.2 0.909 103.6 45.2 -73.4 -46.2 21.5 41.7 76.3 286 130 B H H X S+ 0 0 1 -4,-1.4 4,-2.6 1,-0.2 -2,-0.2 0.939 112.6 52.9 -63.6 -44.2 19.6 38.8 77.7 287 131 B I H X S+ 0 0 0 -4,-2.1 4,-3.0 1,-0.2 5,-0.3 0.888 106.3 53.0 -57.7 -41.7 17.2 39.0 74.8 288 132 B D H X S+ 0 0 45 -4,-1.7 4,-2.4 1,-0.2 -1,-0.2 0.942 111.9 44.5 -59.8 -48.2 20.0 38.8 72.3 289 133 B W H X S+ 0 0 52 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.883 114.2 50.9 -63.1 -40.5 21.5 35.7 73.9 290 134 B L H X S+ 0 0 0 -4,-2.6 4,-2.0 2,-0.2 3,-0.2 0.941 110.7 46.1 -64.9 -50.0 18.0 34.1 74.1 291 135 B E H X S+ 0 0 35 -4,-3.0 4,-2.3 1,-0.2 5,-0.2 0.935 111.4 54.5 -58.9 -44.2 17.1 34.7 70.5 292 136 B T H X S+ 0 0 20 -4,-2.4 4,-2.0 -5,-0.3 -1,-0.2 0.836 105.8 52.0 -59.2 -34.2 20.5 33.4 69.5 293 137 B Q H X S+ 0 0 14 -4,-1.7 4,-1.8 -3,-0.2 -1,-0.2 0.923 109.8 48.9 -68.2 -43.4 20.0 30.2 71.4 294 138 B L H X S+ 0 0 31 -4,-2.0 4,-1.2 1,-0.2 -2,-0.2 0.885 113.4 46.3 -64.0 -39.2 16.6 29.6 69.7 295 139 B D H X S+ 0 0 82 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.873 108.5 56.3 -69.9 -37.9 18.2 30.3 66.2 296 140 B L H X S+ 0 0 6 -4,-2.0 4,-2.1 -5,-0.2 5,-0.4 0.869 102.8 56.4 -61.0 -36.7 21.1 28.0 67.0 297 141 B I H X S+ 0 0 5 -4,-1.8 4,-1.4 1,-0.2 -1,-0.2 0.888 106.6 50.1 -62.3 -40.3 18.7 25.2 67.8 298 142 B D H < S+ 0 0 126 -4,-1.2 -1,-0.2 2,-0.2 -2,-0.2 0.859 112.8 45.4 -67.6 -37.4 17.2 25.6 64.3 299 143 B K H < S+ 0 0 65 -4,-1.7 -2,-0.2 1,-0.1 -1,-0.1 0.950 127.4 21.8 -74.4 -50.8 20.5 25.5 62.5 300 144 B I H < S- 0 0 2 -4,-2.1 4,-0.4 -5,-0.1 -2,-0.2 0.558 112.3-109.9 -95.4 -10.4 22.3 22.5 64.2 301 145 B G X - 0 0 28 -4,-1.4 4,-2.4 -5,-0.4 3,-0.4 0.330 26.6 -87.7 90.3 139.9 19.3 20.7 65.6 302 146 B L H > S+ 0 0 68 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.840 122.4 53.5 -47.0 -47.7 18.0 20.3 69.1 303 147 B E H > S+ 0 0 171 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.921 111.6 43.5 -58.9 -47.8 20.1 17.1 69.8 304 148 B N H > S+ 0 0 31 -4,-0.4 4,-1.5 -3,-0.4 -1,-0.2 0.907 112.4 55.6 -64.6 -39.7 23.4 18.7 68.8 305 149 B Y H < S+ 0 0 0 -4,-2.4 4,-0.4 1,-0.2 -2,-0.2 0.897 109.8 44.1 -58.9 -43.8 22.5 21.8 70.7 306 150 B L H >< S+ 0 0 47 -4,-2.3 3,-1.0 1,-0.2 -1,-0.2 0.835 107.5 58.6 -70.2 -35.1 21.9 19.9 74.0 307 151 B Q H >< S+ 0 0 114 -4,-1.9 3,-0.8 1,-0.3 4,-0.3 0.835 104.6 54.2 -62.3 -30.2 25.0 17.9 73.5 308 152 B S T 3< S+ 0 0 29 -4,-1.5 -1,-0.3 1,-0.2 3,-0.2 0.646 103.0 56.2 -77.9 -16.4 26.8 21.3 73.5 309 153 B Q T < S+ 0 0 9 -3,-1.0 -114,-2.3 -4,-0.4 -113,-0.6 0.315 82.3 90.3-100.0 9.6 25.3 22.3 76.8 310 154 B M < 0 0 92 -3,-0.8 -116,-0.9 -117,-0.2 -1,-0.2 0.856 360.0 360.0 -75.9 -37.7 26.5 19.3 78.8 311 155 B D 0 0 149 -4,-0.3 -2,-0.1 -3,-0.2 -3,-0.1 0.753 360.0 360.0-122.6 360.0 29.9 20.5 80.1 312 !* 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 0.0 313 1 C M 0 0 23 0, 0.0 2,-0.1 0, 0.0 -25,-0.0 0.000 360.0 360.0 360.0 115.5 15.1 41.8 68.0 314 2 C K - 0 0 187 1,-0.1 2,-0.2 64,-0.0 64,-0.2 -0.314 360.0-161.7 -55.2 122.7 13.1 43.8 65.3 315 3 C G - 0 0 29 62,-1.4 2,-0.1 59,-0.1 -1,-0.1 -0.604 31.3 -77.5-105.4 167.8 14.3 47.4 65.4 316 4 C D > - 0 0 63 -2,-0.2 4,-2.0 1,-0.1 5,-0.1 -0.405 36.2-136.8 -63.0 134.6 12.7 50.5 64.1 317 5 C K H > S+ 0 0 154 1,-0.2 4,-1.3 2,-0.2 -1,-0.1 0.878 104.3 45.9 -61.7 -40.4 13.1 50.8 60.3 318 6 C I H > S+ 0 0 62 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.875 107.5 56.9 -72.2 -37.2 14.0 54.5 60.4 319 7 C V H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.922 105.3 53.6 -56.7 -44.6 16.4 54.0 63.4 320 8 C I H X S+ 0 0 22 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.890 106.3 51.7 -57.1 -42.7 18.2 51.5 61.2 321 9 C Q H X S+ 0 0 122 -4,-1.3 4,-2.7 2,-0.2 -1,-0.2 0.943 109.0 50.3 -60.9 -48.4 18.6 54.2 58.4 322 10 C H H X S+ 0 0 48 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.925 110.8 48.8 -54.6 -48.8 20.0 56.7 60.8 323 11 C L H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.890 112.5 47.7 -60.4 -41.4 22.6 54.2 62.1 324 12 C N H X S+ 0 0 36 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.881 110.4 53.0 -65.9 -38.6 23.6 53.2 58.5 325 13 C K H X S+ 0 0 100 -4,-2.7 4,-1.4 2,-0.2 -2,-0.2 0.948 112.4 44.6 -60.4 -48.9 23.8 56.9 57.6 326 14 C I H X S+ 0 0 3 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.877 111.4 52.6 -63.2 -39.5 26.1 57.4 60.6 327 15 C L H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.842 105.0 57.8 -64.6 -33.5 28.1 54.3 59.7 328 16 C G H X S+ 0 0 16 -4,-2.1 4,-1.0 1,-0.2 59,-0.5 0.858 106.7 46.7 -65.2 -36.6 28.5 55.8 56.2 329 17 C N H X S+ 0 0 31 -4,-1.4 4,-1.9 1,-0.2 -2,-0.2 0.867 110.5 53.5 -72.4 -37.0 30.2 58.9 57.6 330 18 C E H X S+ 0 0 9 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.878 101.6 58.1 -65.5 -38.6 32.4 56.8 59.8 331 19 C L H X S+ 0 0 16 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.878 107.6 48.2 -59.2 -37.6 33.7 54.7 56.9 332 20 C I H X S+ 0 0 17 -4,-1.0 4,-2.6 2,-0.2 5,-0.3 0.918 109.3 52.0 -67.7 -46.1 34.9 57.9 55.2 333 21 C A H X S+ 0 0 1 -4,-1.9 4,-2.3 1,-0.2 5,-0.3 0.889 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-4,-1.9 4,-2.8 1,-0.2 5,-0.4 0.866 107.8 56.4 -54.6 -40.5 38.2 41.9 51.3 490 22 D I H X S+ 0 0 24 -4,-2.5 4,-1.8 2,-0.2 -1,-0.2 0.946 114.0 37.0 -57.0 -52.9 38.6 44.1 54.4 491 23 D N H X S+ 0 0 30 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.926 118.3 50.6 -67.1 -46.6 34.9 45.2 54.4 492 24 D Q H X S+ 0 0 0 -4,-3.0 4,-2.7 1,-0.2 5,-0.2 0.946 114.1 41.7 -58.6 -53.7 33.5 41.9 53.3 493 25 D Y H X S+ 0 0 0 -4,-2.8 4,-2.0 -5,-0.2 -1,-0.2 0.864 112.2 55.0 -65.0 -36.0 35.4 39.8 55.9 494 26 D F H X S+ 0 0 24 -4,-1.8 4,-1.8 -5,-0.4 -1,-0.2 0.926 112.0 44.9 -62.6 -42.6 34.7 42.3 58.7 495 27 D L H X S+ 0 0 11 -4,-2.2 4,-1.7 2,-0.2 3,-0.2 0.955 112.4 48.1 -68.7 -49.9 31.0 42.1 57.9 496 28 D H H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.856 109.7 59.1 -57.6 -30.6 30.8 38.3 57.6 497 29 D A H X S+ 0 0 0 -4,-2.0 4,-2.0 -5,-0.2 -1,-0.2 0.919 107.5 41.5 -64.9 -44.8 32.8 38.3 60.9 498 30 D R H X S+ 0 0 21 -4,-1.8 4,-1.9 -3,-0.2 -1,-0.2 0.736 112.0 57.7 -76.2 -19.5 30.2 40.2 62.8 499 31 D M H X S+ 0 0 26 -4,-1.7 4,-1.2 2,-0.2 -2,-0.2 0.910 108.1 45.5 -74.0 -42.8 27.5 38.1 61.2 500 32 D Y H ><>S+ 0 0 0 -4,-2.3 5,-2.1 2,-0.2 3,-0.6 0.949 115.0 47.9 -62.8 -48.9 29.0 34.9 62.4 501 33 D E H ><5S+ 0 0 86 -4,-2.0 3,-1.2 1,-0.3 -2,-0.2 0.871 108.6 54.3 -59.2 -40.0 29.4 36.4 65.9 502 34 D D H 3<5S+ 0 0 37 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.774 108.2 50.7 -66.2 -27.7 25.8 37.7 65.9 503 35 D W T <<5S- 0 0 47 -4,-1.2 -1,-0.3 -3,-0.6 -2,-0.2 0.379 121.1-106.5 -90.9 1.3 24.6 34.2 65.1 504 36 D G T < 5S+ 0 0 16 -3,-1.2 2,-1.7 -4,-0.3 3,-0.2 0.468 80.4 130.7 89.5 -0.5 26.6 32.6 68.0 505 37 D L >< + 0 0 2 -5,-2.1 4,-2.6 1,-0.2 117,-0.2 -0.554 24.6 164.6 -88.5 73.0 29.3 31.0 65.8 506 38 D E H > + 0 0 111 -2,-1.7 4,-2.8 116,-0.9 5,-0.2 0.854 67.6 55.8 -56.6 -45.4 32.2 32.4 67.8 507 39 D K H > S+ 0 0 110 114,-1.8 4,-1.6 -3,-0.2 -1,-0.2 0.982 114.7 39.4 -53.1 -61.0 34.9 30.1 66.4 508 40 D L H > S+ 0 0 0 113,-0.7 4,-2.5 1,-0.2 5,-0.2 0.893 113.6 55.4 -57.0 -44.9 34.1 31.1 62.9 509 41 D G H X S+ 0 0 4 -4,-2.6 4,-2.7 112,-0.3 -1,-0.2 0.928 106.3 51.1 -55.2 -47.3 33.6 34.8 63.8 510 42 D K H X S+ 0 0 133 -4,-2.8 4,-1.6 1,-0.2 -1,-0.2 0.862 111.0 48.4 -58.7 -40.5 37.0 34.9 65.4 511 43 D H H X S+ 0 0 61 -4,-1.6 4,-2.2 -5,-0.2 5,-0.2 0.929 111.5 47.7 -69.7 -46.7 38.7 33.5 62.3 512 44 D E H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 5,-0.2 0.956 109.3 55.5 -57.6 -51.1 36.9 35.9 59.8 513 45 D Y H X S+ 0 0 80 -4,-2.7 4,-1.2 -5,-0.2 -1,-0.2 0.880 109.4 46.9 -48.2 -45.0 37.8 38.8 62.0 514 46 D H H >X S+ 0 0 91 -4,-1.6 4,-2.3 2,-0.2 3,-0.5 0.931 108.6 51.1 -67.4 -48.5 41.5 37.9 61.9 515 47 D E H 3X S+ 0 0 23 -4,-2.2 4,-1.7 1,-0.3 -1,-0.2 0.845 110.1 54.4 -57.1 -31.1 41.7 37.4 58.1 516 48 D S H 3X S+ 0 0 0 -4,-2.1 4,-1.5 -5,-0.2 -1,-0.3 0.833 107.0 49.2 -70.0 -34.2 40.1 40.8 57.9 517 49 D I H S+ 0 0 0 -4,-2.4 5,-2.8 1,-0.2 -2,-0.2 0.913 109.8 50.7 -57.2 -47.8 52.9 53.6 46.9 531 63 D L H ><5S+ 0 0 20 -4,-2.1 3,-1.5 3,-0.2 -1,-0.2 0.922 111.0 48.6 -56.5 -48.7 53.7 56.8 49.0 532 64 D F H 3<5S+ 0 0 86 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.910 108.3 52.6 -58.6 -46.2 57.5 56.0 48.8 533 65 D L T 3<5S- 0 0 2 -4,-2.4 -62,-2.3 -5,-0.2 -1,-0.3 0.322 121.2-115.6 -73.5 8.8 57.3 55.4 45.1 534 66 D E T < 5S+ 0 0 100 -3,-1.5 -3,-0.2 -64,-0.2 2,-0.2 0.767 71.8 127.8 61.4 34.6 55.7 58.8 45.0 535 67 D G < - 0 0 11 -5,-2.8 -1,-0.2 -6,-0.1 -62,-0.0 -0.507 63.4-101.3-107.9-179.8 52.2 57.8 43.8 536 68 D L - 0 0 153 -2,-0.2 2,-0.1 2,-0.0 -5,-0.0 -0.902 29.9-132.1-110.7 111.2 48.7 58.5 45.1 537 69 D P - 0 0 13 0, 0.0 2,-1.0 0, 0.0 -10,-0.0 -0.348 18.0-140.1 -56.6 132.1 47.0 55.6 47.2 538 70 D N + 0 0 48 1,-0.1 -2,-0.0 2,-0.1 -11,-0.0 -0.800 41.7 151.1-103.4 100.0 43.5 55.2 46.0 539 71 D L + 0 0 8 -2,-1.0 -1,-0.1 1,-0.1 -204,-0.1 0.014 60.1 79.7-108.8 23.7 41.2 54.5 48.9 540 72 D Q S S+ 0 0 64 1,-0.1 2,-0.5 -205,-0.0 -154,-0.1 0.856 74.5 70.1 -97.0 -46.4 38.2 56.1 47.1 541 73 D E - 0 0 143 1,-0.0 2,-0.5 0, 0.0 -54,-0.1 -0.645 61.9-170.6 -81.2 122.7 37.0 53.3 44.8 542 74 D L - 0 0 35 -2,-0.5 -156,-0.1 -158,-0.1 3,-0.1 -0.952 13.3-140.1-117.1 121.1 35.4 50.4 46.5 543 75 D G - 0 0 28 -2,-0.5 2,-0.4 -59,-0.5 -1,-0.0 0.150 38.8 -63.4 -68.2-174.8 34.5 47.3 44.6 544 76 D K - 0 0 149 1,-0.0 2,-0.3 2,-0.0 -1,-0.2 -0.609 49.6-137.2 -78.2 123.9 31.5 45.0 44.7 545 77 D L - 0 0 8 -2,-0.4 2,-0.8 -3,-0.1 -56,-0.1 -0.585 2.4-146.2 -81.3 140.8 31.0 43.2 48.0 546 78 D L + 0 0 49 -2,-0.3 2,-0.6 -58,-0.1 15,-0.1 -0.779 26.3 178.1-108.5 84.9 30.1 39.5 48.0 547 79 D I - 0 0 64 -2,-0.8 7,-0.1 10,-0.1 -54,-0.0 -0.801 12.3-154.5 -95.1 116.5 27.9 39.2 51.1 548 80 D G - 0 0 2 -2,-0.6 3,-0.1 1,-0.1 4,-0.0 -0.215 13.6-142.3 -80.6 175.2 26.3 35.8 51.8 549 81 D E S S+ 0 0 158 1,-0.3 2,-0.3 -2,-0.0 -1,-0.1 0.507 81.2 19.6-114.9 -13.8 23.2 35.1 53.7 550 82 D H S > S- 0 0 102 1,-0.1 4,-2.7 0, 0.0 3,-0.3 -0.956 90.7 -90.5-150.0 165.9 24.2 31.9 55.5 551 83 D T H > S+ 0 0 9 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.877 117.7 48.1 -47.0 -59.9 27.4 30.1 56.4 552 84 D K H > S+ 0 0 80 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.890 117.1 44.9 -53.0 -41.6 28.0 27.9 53.4 553 85 D E H > S+ 0 0 66 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.914 109.7 53.6 -69.6 -44.1 27.4 30.8 51.0 554 86 D M H X S+ 0 0 0 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.875 109.9 49.9 -57.4 -38.1 29.5 33.3 53.0 555 87 D L H X S+ 0 0 0 -4,-2.3 4,-2.0 -5,-0.2 -1,-0.2 0.902 111.0 48.1 -67.4 -42.4 32.4 30.8 52.8 556 88 D E H X S+ 0 0 99 -4,-1.7 4,-1.6 -5,-0.2 -2,-0.2 0.776 109.5 54.8 -70.7 -25.1 31.9 30.4 49.0 557 89 D C H X S+ 0 0 22 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.889 108.2 46.5 -75.8 -37.9 31.8 34.2 48.6 558 90 D D H X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.912 113.4 49.0 -68.8 -41.8 35.2 34.8 50.4 559 91 D L H X S+ 0 0 20 -4,-2.0 4,-2.6 1,-0.2 5,-0.2 0.900 109.1 53.7 -62.9 -40.6 36.8 32.0 48.4 560 92 D K H X S+ 0 0 135 -4,-1.6 4,-1.8 1,-0.2 -1,-0.2 0.891 109.5 48.8 -60.4 -39.4 35.4 33.5 45.2 561 93 D L H X S+ 0 0 17 -4,-1.7 4,-1.5 2,-0.2 -2,-0.2 0.942 111.3 48.0 -65.8 -50.4 36.9 36.9 46.2 562 94 D E H >X S+ 0 0 11 -4,-2.6 4,-1.0 1,-0.2 3,-0.6 0.943 111.0 50.4 -56.4 -51.6 40.4 35.4 46.9 563 95 D Q H >< S+ 0 0 100 -4,-2.6 3,-0.9 1,-0.2 -1,-0.2 0.903 107.4 55.7 -54.4 -43.5 40.4 33.5 43.6 564 96 D A H 3X S+ 0 0 66 -4,-1.8 4,-0.5 1,-0.2 -1,-0.2 0.840 109.9 44.9 -60.2 -35.4 39.5 36.6 41.7 565 97 D G H S+ 0 0 79 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.925 107.7 55.6 -57.3 -45.0 45.6 36.6 38.9 568 100 D D H X S+ 0 0 33 -4,-0.5 4,-2.3 1,-0.2 -2,-0.2 0.903 107.6 48.7 -54.5 -44.9 46.0 40.3 39.6 569 101 D L H X S+ 0 0 8 -4,-1.6 4,-2.3 1,-0.2 -1,-0.2 0.905 111.2 49.5 -62.4 -44.2 48.8 39.7 42.1 570 102 D K H X S+ 0 0 109 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.870 110.8 50.3 -64.4 -37.4 50.7 37.3 39.8 571 103 D A H X S+ 0 0 48 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.933 111.0 48.5 -66.6 -45.7 50.4 39.9 36.9 572 104 D A H X S+ 0 0 0 -4,-2.3 4,-2.4 -5,-0.2 -2,-0.2 0.897 111.2 50.6 -62.5 -39.7 51.8 42.7 39.2 573 105 D I H X S+ 0 0 16 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.944 110.0 49.8 -63.5 -46.4 54.6 40.5 40.3 574 106 D A H X S+ 0 0 61 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.883 111.8 48.8 -59.4 -39.7 55.6 39.6 36.8 575 107 D Y H X S+ 0 0 55 -4,-2.3 4,-1.3 2,-0.2 -1,-0.2 0.918 108.3 51.8 -69.1 -42.8 55.6 43.2 35.7 576 108 D C H ><>S+ 0 0 0 -4,-2.4 5,-2.4 1,-0.2 3,-0.5 0.916 110.4 51.3 -57.5 -41.8 57.7 44.4 38.7 577 109 D E H ><5S+ 0 0 81 -4,-2.2 3,-1.2 1,-0.2 -1,-0.2 0.927 105.8 54.3 -60.5 -46.8 60.2 41.7 37.7 578 110 D S H 3<5S+ 0 0 86 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.731 116.1 38.2 -61.6 -25.0 60.2 42.9 34.1 579 111 D V T <<5S- 0 0 60 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.289 113.2-110.4-110.9 8.8 61.1 46.4 35.2 580 112 D G T < 5 + 0 0 36 -3,-1.2 2,-1.1 -4,-0.5 3,-0.2 0.772 68.3 140.6 71.8 27.8 63.5 45.6 38.0 581 113 D D >< + 0 0 24 -5,-2.4 4,-1.6 1,-0.2 3,-0.2 -0.594 17.5 160.3-100.3 70.4 61.4 46.8 41.0 582 114 D Y H > + 0 0 138 -2,-1.1 4,-2.2 1,-0.2 -1,-0.2 0.806 65.2 58.0 -62.3 -35.6 62.5 43.9 43.1 583 115 D A H > S+ 0 0 58 1,-0.2 4,-1.7 -3,-0.2 -1,-0.2 0.914 109.6 45.8 -64.1 -41.1 61.5 45.5 46.5 584 116 D S H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.853 110.6 53.7 -68.8 -34.2 57.9 45.8 45.3 585 117 D R H X S+ 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119.8 30.7 84.4 94.7 855 75 F G - 0 0 30 -59,-0.5 2,-1.0 -2,-0.4 -58,-0.0 0.159 40.0 -59.4 -72.8-168.0 27.2 83.9 96.2 856 76 F K - 0 0 149 2,-0.0 -1,-0.1 1,-0.0 2,-0.1 -0.649 51.1-145.8 -80.5 98.8 25.9 83.9 99.8 857 77 F L - 0 0 3 -2,-1.0 2,-0.8 -3,-0.1 -56,-0.1 -0.391 4.4-145.4 -62.9 138.4 27.7 81.3 101.8 858 78 F L + 0 0 45 1,-0.2 15,-0.1 11,-0.1 -1,-0.1 -0.832 27.8 173.8-107.7 91.4 25.4 79.7 104.4 859 79 F I - 0 0 55 -2,-0.8 -1,-0.2 10,-0.1 10,-0.1 0.949 13.0-157.1 -66.2 -97.0 27.8 79.1 107.3 860 80 F G - 0 0 9 1,-0.1 3,-0.1 9,-0.1 6,-0.0 0.024 20.7-128.7 118.7 132.1 26.4 77.8 110.6 861 81 F E S S+ 0 0 161 1,-0.1 2,-0.3 -2,-0.1 -1,-0.1 0.313 85.0 21.0 -95.6 6.0 27.6 77.9 114.2 862 82 F H S > S- 0 0 91 1,-0.1 4,-2.7 0, 0.0 3,-0.5 -0.974 86.4 -91.4-168.0 158.0 27.2 74.3 115.1 863 83 F T H > S+ 0 0 8 -2,-0.3 4,-2.6 1,-0.2 5,-0.3 0.838 117.9 47.9 -39.2 -61.2 26.9 70.8 113.6 864 84 F K H > S+ 0 0 81 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.908 117.7 43.8 -52.9 -44.0 23.2 70.4 113.3 865 85 F E H > S+ 0 0 69 -3,-0.5 4,-3.8 2,-0.2 -1,-0.2 0.899 111.4 53.1 -67.6 -43.0 23.0 73.8 111.7 866 86 F M H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.853 109.2 50.0 -61.7 -37.0 26.0 73.2 109.4 867 87 F L H X S+ 0 0 0 -4,-2.6 4,-2.1 -5,-0.3 -1,-0.2 0.947 113.8 45.6 -66.4 -47.5 24.4 70.0 108.2 868 88 F E H X S+ 0 0 102 -4,-2.0 4,-3.1 -5,-0.3 3,-0.4 0.972 111.2 51.5 -59.6 -55.6 21.1 71.9 107.5 869 89 F C H X S+ 0 0 22 -4,-3.8 4,-2.4 1,-0.2 -1,-0.2 0.869 111.4 48.8 -48.8 -42.1 22.9 74.8 105.8 870 90 F D H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.866 112.1 47.2 -67.7 -37.5 24.7 72.3 103.5 871 91 F L H X S+ 0 0 27 -4,-2.1 4,-2.0 -3,-0.4 -2,-0.2 0.944 111.2 52.3 -66.2 -49.3 21.5 70.4 102.7 872 92 F K H >X S+ 0 0 134 -4,-3.1 4,-2.8 1,-0.2 3,-0.5 0.942 110.8 47.9 -48.4 -56.4 19.8 73.7 102.0 873 93 F L H 3X S+ 0 0 25 -4,-2.4 4,-0.8 1,-0.3 -1,-0.2 0.886 109.8 51.6 -54.4 -47.0 22.6 74.7 99.6 874 94 F E H 3< S+ 0 0 6 -4,-2.2 4,-0.5 1,-0.2 -1,-0.3 0.804 114.0 46.0 -63.2 -29.7 22.6 71.4 97.8 875 95 F Q H X< S+ 0 0 77 -4,-2.0 3,-1.4 -3,-0.5 -2,-0.2 0.929 103.0 57.0 -81.1 -48.7 18.8 71.7 97.2 876 96 F A H 3< S+ 0 0 77 -4,-2.8 4,-0.4 1,-0.3 -1,-0.2 0.749 111.6 51.6 -54.9 -18.0 18.6 75.3 96.1 877 97 F G T 3X S+ 0 0 14 -4,-0.8 4,-1.7 -5,-0.3 -1,-0.3 0.675 89.4 74.2 -94.1 -20.2 21.0 74.1 93.4 878 98 F L H <> S+ 0 0 13 -3,-1.4 4,-2.3 -4,-0.5 5,-0.2 0.924 91.5 56.9 -60.9 -44.9 19.2 71.0 92.1 879 99 F P H > S+ 0 0 77 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.919 105.9 51.0 -53.3 -43.8 16.6 73.1 90.2 880 100 F D H > S+ 0 0 36 -4,-0.4 4,-2.4 1,-0.2 5,-0.2 0.935 108.6 51.0 -60.7 -46.0 19.3 74.8 88.2 881 101 F L H X S+ 0 0 6 -4,-1.7 4,-2.1 1,-0.2 -1,-0.2 0.929 113.7 44.5 -55.0 -49.5 21.0 71.5 87.3 882 102 F K H X S+ 0 0 59 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.868 111.5 52.0 -65.4 -39.8 17.7 70.1 86.0 883 103 F A H X S+ 0 0 51 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.920 112.3 46.3 -63.7 -44.4 16.6 73.2 84.1 884 104 F A H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.872 110.5 51.9 -66.7 -38.3 20.0 73.3 82.3 885 105 F I H X S+ 0 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-4,-2.4 4,-1.3 1,-0.2 -1,-0.2 0.891 108.0 49.7 -53.1 -45.0 24.0 62.2 90.5 906 126 F S H X S+ 0 0 48 -4,-1.8 4,-2.2 1,-0.2 3,-0.3 0.902 108.4 53.5 -62.9 -40.0 26.8 63.2 92.9 907 127 F E H X S+ 0 0 10 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.890 105.9 52.5 -63.1 -38.5 24.6 66.0 94.3 908 128 F E H X S+ 0 0 4 -4,-2.1 4,-1.4 1,-0.2 -1,-0.2 0.793 109.1 51.9 -68.7 -25.3 21.8 63.5 95.0 909 129 F D H X S+ 0 0 106 -4,-1.3 4,-2.6 -3,-0.3 -2,-0.2 0.916 108.1 48.6 -74.5 -45.4 24.3 61.3 96.9 910 130 F H H X S+ 0 0 2 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.888 111.8 50.8 -61.7 -38.0 25.6 64.2 99.1 911 131 F I H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 5,-0.3 0.884 108.8 51.9 -65.9 -37.5 21.9 65.1 99.9 912 132 F D H X S+ 0 0 45 -4,-1.4 4,-1.7 1,-0.2 -2,-0.2 0.923 110.0 48.6 -64.7 -42.9 21.3 61.4 100.8 913 133 F W H X S+ 0 0 49 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.876 112.8 48.7 -64.3 -37.4 24.3 61.5 103.1 914 134 F L H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.914 109.6 48.8 -70.1 -45.1 23.1 64.8 104.7 915 135 F E H X S+ 0 0 30 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.860 110.9 55.3 -62.8 -33.6 19.5 63.7 105.3 916 136 F T H X S+ 0 0 19 -4,-1.7 4,-2.5 -5,-0.3 -1,-0.2 0.921 107.2 46.1 -65.3 -46.7 20.9 60.5 106.8 917 137 F Q H X S+ 0 0 11 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.952 112.9 50.8 -61.6 -49.6 23.1 62.4 109.4 918 138 F L H X S+ 0 0 27 -4,-2.4 4,-1.1 1,-0.2 -1,-0.2 0.898 112.4 46.4 -55.2 -43.4 20.2 64.6 110.3 919 139 F D H X S+ 0 0 82 -4,-2.2 4,-1.7 1,-0.2 3,-0.4 0.897 108.5 56.4 -66.8 -39.1 17.9 61.6 110.8 920 140 F L H X S+ 0 0 5 -4,-2.5 4,-2.6 1,-0.3 5,-0.4 0.886 101.4 56.9 -59.2 -40.0 20.7 59.8 112.8 921 141 F I H X S+ 0 0 9 -4,-2.2 4,-1.4 1,-0.2 -1,-0.3 0.855 107.3 50.3 -60.1 -34.3 20.8 62.8 115.2 922 142 F D H < S+ 0 0 126 -4,-1.1 -1,-0.2 -3,-0.4 -2,-0.2 0.864 113.5 44.1 -72.3 -36.7 17.1 62.2 115.8 923 143 F K H < S+ 0 0 66 -4,-1.7 -2,-0.2 1,-0.1 -1,-0.2 0.828 128.8 19.9 -80.8 -33.8 17.4 58.5 116.5 924 144 F I H < S- 0 0 4 -4,-2.6 4,-0.3 -5,-0.1 -3,-0.2 0.523 108.3-104.8-116.3 -6.3 20.5 58.4 118.8 925 145 F G X - 0 0 20 -4,-1.4 4,-2.7 -5,-0.4 5,-0.2 0.159 25.4 -94.4 95.6 146.1 20.9 61.9 120.2 926 146 F L H > S+ 0 0 74 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.913 123.2 52.4 -62.4 -45.1 23.2 64.8 119.4 927 147 F E H > S+ 0 0 102 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.914 113.8 44.2 -57.8 -43.7 25.7 63.9 122.2 928 148 F N H > S+ 0 0 12 -4,-0.3 4,-2.0 2,-0.2 -2,-0.2 0.918 113.3 50.7 -65.8 -45.7 25.8 60.3 120.9 929 149 F Y H < S+ 0 0 0 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.889 113.2 45.2 -60.3 -43.2 26.2 61.4 117.3 930 150 F L H >< S+ 0 0 8 -4,-2.9 3,-1.9 1,-0.2 4,-0.3 0.895 107.7 57.3 -69.6 -40.8 29.0 63.8 118.1 931 151 F Q H >< S+ 0 0 12 -4,-2.2 3,-1.3 -5,-0.3 4,-0.3 0.926 106.0 51.7 -55.6 -42.0 30.8 61.3 120.2 932 152 F S T 3< S+ 0 0 21 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.427 101.2 62.3 -75.9 1.7 30.8 59.0 117.2 933 153 F Q T < S+ 0 0 16 -3,-1.9 -114,-1.9 1,-0.1 -113,-0.7 0.365 78.9 89.4-106.2 3.6 32.4 61.7 115.0 934 154 F M < 0 0 11 -3,-1.3 -116,-0.8 -4,-0.3 -2,-0.1 0.851 360.0 360.0 -70.8 -39.3 35.6 62.0 117.0 935 155 F D 0 0 112 -4,-0.3 -1,-0.1 -117,-0.1 -118,-0.0 -0.954 360.0 360.0-120.0 360.0 37.8 59.4 115.3 936 !* 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 0.0 937 1 G M 0 0 131 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 118.6 81.2 80.1 123.4 938 2 G K - 0 0 186 64,-0.1 2,-0.2 1,-0.1 64,-0.2 -0.302 360.0-158.3 -53.5 120.2 80.4 82.7 126.1 939 3 G G - 0 0 25 62,-1.9 -1,-0.1 59,-0.1 2,-0.0 -0.584 31.8 -79.9 -99.5 164.7 76.7 83.4 125.8 940 4 G D > - 0 0 62 -2,-0.2 4,-1.6 1,-0.1 -1,-0.1 -0.395 39.2-134.3 -60.5 139.2 74.9 86.5 127.1 941 5 G K H > S+ 0 0 153 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.898 103.7 47.7 -63.8 -44.4 74.4 86.2 130.8 942 6 G I H > S+ 0 0 54 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.790 106.7 58.4 -69.5 -28.0 70.7 87.3 130.8 943 7 G V H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.925 103.7 52.3 -65.7 -43.1 70.0 84.9 127.9 944 8 G I H X S+ 0 0 23 -4,-1.6 4,-2.4 1,-0.2 -2,-0.2 0.878 107.7 52.3 -57.8 -42.1 71.2 82.0 130.1 945 9 G Q H X S+ 0 0 117 -4,-1.4 4,-2.1 2,-0.2 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108.0 56.5 -67.9 -42.1 65.6 47.4 140.9 1216 124 H L H X S+ 0 0 27 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.864 105.2 51.6 -54.9 -40.8 68.3 46.6 143.5 1217 125 H E H X S+ 0 0 114 -4,-1.9 4,-1.3 2,-0.2 -1,-0.2 0.907 109.5 49.2 -64.6 -42.4 70.0 44.3 141.0 1218 126 H S H >X S+ 0 0 26 -4,-1.5 4,-1.7 1,-0.2 3,-0.6 0.923 110.1 50.5 -62.9 -46.0 70.1 47.0 138.3 1219 127 H E H 3X S+ 0 0 3 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.848 107.3 55.9 -61.2 -34.1 71.5 49.6 140.8 1220 128 H E H 3X S+ 0 0 100 -4,-1.7 4,-1.3 -5,-0.2 -1,-0.2 0.804 104.7 51.7 -70.5 -27.7 74.2 47.0 141.8 1221 129 H D H S+ 0 0 59 -4,-2.5 4,-3.1 2,-0.2 5,-0.6 0.924 105.6 53.4 -60.8 -44.0 90.7 51.9 134.9 1233 141 H I H X5S+ 0 0 10 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.926 109.9 48.6 -57.1 -44.6 91.6 55.5 135.5 1234 142 H D H <5S+ 0 0 122 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.887 115.8 43.8 -63.1 -39.1 94.1 54.4 138.2 1235 143 H K H <5S+ 0 0 156 -4,-2.3 -2,-0.2 1,-0.1 -1,-0.2 0.878 130.0 19.5 -76.4 -39.5 95.6 51.7 135.9 1236 144 H I H <5S- 0 0 78 -4,-3.1 4,-0.4 -5,-0.2 -3,-0.2 0.639 108.7-107.6-107.9 -14.9 95.9 53.6 132.6 1237 145 H G X< - 0 0 26 -4,-2.2 4,-2.7 -5,-0.6 5,-0.2 0.103 26.5 -90.7 100.6 144.7 95.8 57.3 133.6 1238 146 H L H > S+ 0 0 63 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.909 123.6 57.1 -56.5 -44.1 93.2 60.0 133.2 1239 147 H E H > S+ 0 0 156 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.920 112.8 39.5 -52.7 -50.2 94.7 61.0 129.8 1240 148 H N H > S+ 0 0 77 -4,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.915 113.8 53.0 -67.6 -45.8 94.3 57.5 128.3 1241 149 H Y H X S+ 0 0 3 -4,-2.7 4,-0.7 1,-0.2 -2,-0.2 0.937 112.2 46.4 -55.2 -48.0 90.9 56.9 129.9 1242 150 H L H < S+ 0 0 50 -4,-2.9 3,-0.3 1,-0.2 -1,-0.2 0.806 108.7 54.5 -64.9 -32.3 89.6 60.1 128.5 1243 151 H Q H >< S+ 0 0 130 -4,-1.4 3,-1.1 -5,-0.3 4,-0.4 0.865 106.9 52.9 -68.8 -34.5 91.1 59.4 125.0 1244 152 H S H 3< S+ 0 0 56 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.665 102.9 58.9 -73.4 -18.5 89.2 56.1 125.1 1245 153 H Q T 3< S+ 0 0 20 -4,-0.7 -114,-1.2 -3,-0.3 -113,-0.8 0.326 86.2 83.8 -94.7 6.7 86.0 57.9 125.8 1246 154 H M < 0 0 97 -3,-1.1 -116,-0.9 -117,-0.2 -115,-0.5 0.996 360.0 360.0 -73.6 -73.8 86.0 60.0 122.7 1247 155 H D 0 0 148 -4,-0.4 -1,-0.1 -117,-0.2 -116,-0.1 -0.628 360.0 360.0 -88.4 360.0 84.6 58.0 119.8