==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 13-NOV-03 1V4E . COMPND 2 MOLECULE: OCTOPRENYL-DIPHOSPHATE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOTOGA MARITIMA; . AUTHOR R.T.GUO,C.J.KUO,C.C.CHOU,T.P.KO,H.L.SHR,P.H.LIANG,A.H.- . 560 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26721.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 435 77.7 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 . 6 1.1 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 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 15 2.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 353 63.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 2.9 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 2 2 0 0 1 3 1 3 1 1 1 1 0 0 2 2 0 0 2 3 1 2 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 . 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 0 0 0 ANTIPARALLEL 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 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 9 A N > 0 0 99 0, 0.0 4,-1.2 0, 0.0 40,-0.1 0.000 360.0 360.0 360.0 67.7 -24.7 -25.8 61.9 2 10 A S H > + 0 0 95 2,-0.2 4,-2.0 1,-0.1 5,-0.2 0.719 360.0 71.6 -81.2 -22.4 -27.2 -24.8 64.6 3 11 A Y H > S+ 0 0 171 2,-0.2 4,-1.4 1,-0.2 3,-0.2 0.974 107.6 29.7 -56.3 -62.4 -24.4 -23.4 66.7 4 12 A E H > S+ 0 0 18 1,-0.2 4,-2.4 2,-0.2 3,-0.5 0.941 114.1 63.5 -64.5 -47.8 -23.7 -20.3 64.5 5 13 A L H X S+ 0 0 15 -4,-1.2 4,-1.7 1,-0.3 -1,-0.2 0.851 107.1 44.8 -43.6 -41.9 -27.3 -20.1 63.4 6 14 A E H X S+ 0 0 102 -4,-2.0 4,-1.4 2,-0.2 -1,-0.3 0.849 109.2 55.1 -72.7 -36.1 -28.2 -19.4 67.0 7 15 A K H X S+ 0 0 91 -4,-1.4 4,-1.3 -3,-0.5 -2,-0.2 0.805 108.8 49.6 -67.4 -29.0 -25.3 -16.9 67.5 8 16 A V H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.900 103.5 56.8 -76.2 -43.0 -26.6 -15.0 64.5 9 17 A K H X S+ 0 0 54 -4,-1.7 4,-2.1 -5,-0.3 -2,-0.2 0.877 110.0 48.5 -53.9 -36.8 -30.2 -14.8 65.7 10 18 A E H X S+ 0 0 108 -4,-1.4 4,-2.1 2,-0.2 -1,-0.3 0.863 106.8 54.0 -71.4 -38.8 -28.7 -13.2 68.8 11 19 A R H X S+ 0 0 62 -4,-1.3 4,-2.4 2,-0.2 -2,-0.2 0.916 109.8 49.7 -61.4 -43.0 -26.7 -10.8 66.7 12 20 A I H X S+ 0 0 2 -4,-2.7 4,-3.0 2,-0.2 5,-0.4 0.955 108.7 49.0 -60.7 -54.8 -29.9 -9.7 65.0 13 21 A E H X S+ 0 0 109 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.898 113.5 51.2 -52.4 -40.3 -31.9 -9.2 68.2 14 22 A Q H X S+ 0 0 115 -4,-2.1 4,-1.3 2,-0.2 -1,-0.2 0.892 112.2 43.5 -64.8 -44.2 -28.9 -7.1 69.3 15 23 A I H X S+ 0 0 7 -4,-2.4 4,-1.0 2,-0.2 3,-0.2 0.945 116.0 46.4 -69.2 -49.0 -28.7 -5.0 66.2 16 24 A L H >X S+ 0 0 0 -4,-3.0 4,-3.2 1,-0.2 3,-0.7 0.899 106.3 60.5 -59.9 -41.7 -32.5 -4.3 66.0 17 25 A S H 3< S+ 0 0 53 -4,-2.2 -1,-0.2 -5,-0.4 -2,-0.2 0.911 101.0 55.3 -50.7 -47.3 -32.6 -3.6 69.7 18 26 A Q H 3< S+ 0 0 155 -4,-1.3 -1,-0.2 -3,-0.2 -2,-0.2 0.818 118.2 32.0 -56.1 -37.7 -30.2 -0.7 69.2 19 27 A F H << S+ 0 0 38 -4,-1.0 -2,-0.2 -3,-0.7 -1,-0.2 0.802 112.1 63.4 -93.7 -34.4 -32.4 1.0 66.5 20 28 A F S < S- 0 0 9 -4,-3.2 2,-0.1 -5,-0.1 394,-0.0 -0.611 86.7-104.7 -96.7 153.9 -35.9 0.1 67.7 21 29 A P > - 0 0 33 0, 0.0 4,-1.5 0, 0.0 3,-0.4 -0.457 31.3-121.1 -70.3 146.8 -37.8 1.1 70.8 22 30 A E H > S+ 0 0 123 1,-0.2 4,-0.9 2,-0.2 3,-0.2 0.890 110.5 64.4 -56.9 -39.1 -38.0 -1.8 73.3 23 31 A Q H 4 S+ 0 0 92 1,-0.2 3,-0.4 2,-0.2 4,-0.3 0.918 108.5 38.7 -47.6 -52.3 -41.8 -1.5 73.2 24 32 A I H >> S+ 0 0 0 -3,-0.4 3,-1.4 1,-0.2 4,-0.5 0.729 96.1 84.4 -74.0 -24.5 -41.9 -2.5 69.5 25 33 A M H >< S+ 0 0 17 -4,-1.5 3,-1.3 1,-0.3 -1,-0.2 0.875 85.2 55.8 -45.3 -49.8 -39.1 -5.1 69.9 26 34 A K T 3< S+ 0 0 144 -4,-0.9 -1,-0.3 -3,-0.4 4,-0.2 0.790 107.2 51.5 -56.2 -30.7 -41.4 -7.9 71.0 27 35 A D T <4 S+ 0 0 30 -3,-1.4 -1,-0.2 -4,-0.3 -2,-0.2 0.450 74.7 112.4 -92.5 -1.8 -43.6 -7.5 67.9 28 36 A L S << S- 0 0 5 -3,-1.3 2,-2.8 -4,-0.5 59,-0.1 -0.589 80.8-112.3 -74.2 128.6 -41.1 -7.6 65.0 29 37 A P - 0 0 22 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.296 51.8-165.4 -58.9 77.1 -41.7 -10.8 62.9 30 38 A L - 0 0 43 -2,-2.8 -21,-0.0 -4,-0.2 -4,-0.0 -0.527 40.1 -7.9 -83.4 135.8 -38.4 -12.2 64.1 31 39 A Y - 0 0 63 -2,-0.3 -1,-0.1 32,-0.0 2,-0.1 0.906 59.5-178.9 53.3 112.7 -36.5 -15.2 62.6 32 40 A G - 0 0 49 -3,-0.1 -2,-0.0 0, 0.0 0, 0.0 0.212 66.7 -46.1-105.3-129.7 -38.3 -17.2 60.0 33 41 A K - 0 0 132 -2,-0.1 5,-0.1 1,-0.0 -2,-0.0 0.703 65.8-149.0 -81.1 -14.5 -36.7 -20.3 58.4 34 42 A M >> + 0 0 4 3,-0.1 4,-2.3 1,-0.1 3,-0.5 0.798 35.8 160.7 49.5 35.0 -33.5 -18.2 57.9 35 43 A L H 3> + 0 0 52 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.909 67.7 54.0 -48.5 -52.6 -32.7 -20.2 54.8 36 44 A R H 3> S+ 0 0 20 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.852 109.6 47.4 -53.8 -40.3 -30.3 -17.7 53.4 37 45 A V H <> S+ 0 0 0 -3,-0.5 4,-2.7 2,-0.2 -1,-0.2 0.934 111.8 50.2 -68.3 -45.5 -28.3 -17.7 56.6 38 46 A R H X S+ 0 0 131 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.925 112.1 47.6 -57.7 -46.4 -28.2 -21.5 56.7 39 47 A L H X S+ 0 0 37 -4,-3.0 4,-1.7 1,-0.2 -1,-0.2 0.853 112.7 49.4 -64.0 -35.3 -27.0 -21.6 53.1 40 48 A S H X S+ 0 0 0 -4,-1.8 4,-2.1 -5,-0.3 -2,-0.2 0.876 109.2 50.5 -72.6 -38.5 -24.4 -18.9 53.8 41 49 A I H X S+ 0 0 1 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.952 110.9 50.7 -61.6 -47.5 -23.1 -20.8 56.8 42 50 A L H X S+ 0 0 26 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.874 109.0 51.1 -56.3 -41.1 -22.9 -23.9 54.7 43 51 A S H X S+ 0 0 1 -4,-1.7 4,-1.2 1,-0.2 -1,-0.2 0.862 105.2 56.8 -66.4 -36.5 -20.9 -21.9 52.1 44 52 A F H X>S+ 0 0 0 -4,-2.1 5,-2.5 2,-0.2 4,-0.5 0.933 109.8 45.0 -59.2 -47.5 -18.5 -20.7 54.7 45 53 A K H ><5S+ 0 0 94 -4,-2.0 3,-2.2 1,-0.2 -2,-0.2 0.966 108.6 55.4 -60.6 -55.6 -17.7 -24.3 55.6 46 54 A N H 3<5S+ 0 0 87 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.720 112.6 44.1 -51.7 -25.3 -17.3 -25.5 52.0 47 55 A R H 3<5S- 0 0 99 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.494 111.2-121.0 -99.0 -6.5 -14.8 -22.7 51.4 48 56 A G T <<5 + 0 0 67 -3,-2.2 2,-0.5 -4,-0.5 -3,-0.2 0.907 60.3 148.7 67.8 41.2 -12.9 -23.3 54.7 49 57 A V < - 0 0 14 -5,-2.5 -1,-0.2 -6,-0.1 -2,-0.1 -0.942 48.2-120.1-111.4 124.9 -13.5 -19.8 56.0 50 58 A E - 0 0 175 -2,-0.5 2,-1.0 1,-0.1 5,-0.0 -0.323 15.7-135.5 -63.8 142.3 -13.8 -19.3 59.7 51 59 A I + 0 0 29 4,-0.1 -1,-0.1 3,-0.1 -10,-0.0 -0.719 44.8 151.3-101.8 82.4 -17.0 -17.8 60.9 52 60 A G > - 0 0 30 -2,-1.0 4,-2.1 4,-0.0 5,-0.1 0.247 62.0 -63.1 -88.0-145.8 -15.9 -15.2 63.5 53 61 A E H > S+ 0 0 169 2,-0.2 4,-2.5 1,-0.2 5,-0.1 0.916 132.0 48.7 -74.6 -46.1 -17.5 -11.9 64.5 54 62 A D H > S+ 0 0 89 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.807 113.5 52.1 -64.1 -26.2 -17.4 -10.0 61.3 55 63 A A H > S+ 0 0 5 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.957 108.2 48.0 -71.4 -52.8 -18.9 -13.1 59.7 56 64 A I H X S+ 0 0 19 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.876 112.2 52.7 -54.6 -38.3 -21.7 -13.3 62.3 57 65 A S H X S+ 0 0 10 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.953 109.1 47.2 -62.7 -51.0 -22.3 -9.6 61.5 58 66 A S H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.929 111.0 51.3 -56.1 -50.2 -22.5 -10.1 57.8 59 67 A L H X S+ 0 0 0 -4,-2.7 4,-1.4 1,-0.2 -1,-0.2 0.846 109.8 51.1 -56.9 -36.7 -24.9 -13.0 58.1 60 68 A A H X S+ 0 0 0 -4,-1.7 4,-1.7 -5,-0.3 -1,-0.2 0.900 109.2 49.0 -68.8 -41.8 -27.1 -10.9 60.4 61 69 A A H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.876 105.4 60.4 -63.7 -38.0 -27.2 -8.0 57.9 62 70 A L H X S+ 0 0 0 -4,-2.3 4,-1.0 1,-0.2 -1,-0.2 0.906 109.3 41.0 -54.5 -47.1 -28.1 -10.6 55.2 63 71 A E H X S+ 0 0 16 -4,-1.4 4,-2.7 1,-0.2 -1,-0.2 0.773 109.5 59.9 -74.6 -28.9 -31.3 -11.5 57.1 64 72 A L H X S+ 0 0 1 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.887 101.0 54.3 -67.0 -38.1 -32.0 -7.9 58.0 65 73 A V H X S+ 0 0 2 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.902 111.7 46.4 -60.1 -40.3 -32.2 -7.0 54.3 66 74 A H H X S+ 0 0 33 -4,-1.0 4,-1.9 2,-0.2 -2,-0.2 0.918 108.6 52.9 -67.9 -47.1 -34.8 -9.8 54.0 67 75 A L H X S+ 0 0 12 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.898 107.4 54.4 -56.1 -41.4 -36.8 -8.7 57.0 68 76 A A H X S+ 0 0 7 -4,-2.3 4,-1.3 1,-0.2 -1,-0.2 0.926 106.0 50.4 -59.1 -47.7 -37.0 -5.2 55.5 69 77 A S H X S+ 0 0 24 -4,-1.6 4,-1.7 1,-0.2 -1,-0.2 0.864 110.4 51.6 -60.4 -36.3 -38.5 -6.5 52.3 70 78 A L H X S+ 0 0 25 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.925 103.6 55.3 -67.5 -46.0 -41.1 -8.5 54.2 71 79 A L H X S+ 0 0 11 -4,-2.3 4,-0.8 1,-0.2 -1,-0.2 0.809 112.0 45.9 -58.0 -29.3 -42.3 -5.5 56.3 72 80 A H H X S+ 0 0 13 -4,-1.3 4,-1.0 -5,-0.2 -1,-0.2 0.823 106.7 56.2 -84.1 -32.6 -42.9 -3.7 53.1 73 81 A D H >X S+ 0 0 30 -4,-1.7 4,-1.9 1,-0.2 3,-0.8 0.972 108.4 48.7 -60.4 -53.4 -44.7 -6.5 51.2 74 82 A D H 3X>S+ 0 0 18 -4,-2.0 4,-3.0 1,-0.3 5,-1.2 0.762 104.7 55.5 -58.6 -34.5 -47.3 -6.8 54.0 75 83 A V H 3<5S+ 0 0 18 -4,-0.8 -1,-0.3 -5,-0.2 -2,-0.2 0.794 110.6 49.1 -71.0 -25.4 -48.2 -3.2 54.3 76 84 A I H <<5S+ 0 0 43 -4,-1.0 -2,-0.2 -3,-0.8 -1,-0.2 0.893 117.0 39.4 -76.8 -43.7 -49.0 -3.3 50.6 77 85 A D H <5S- 0 0 97 -4,-1.9 -2,-0.2 -5,-0.1 -3,-0.2 0.845 103.1-132.0 -75.3 -37.0 -51.1 -6.4 50.9 78 86 A G T <5 + 0 0 55 -4,-3.0 2,-0.3 1,-0.2 -3,-0.2 0.927 39.8 171.0 83.0 50.9 -52.8 -5.4 54.2 79 87 A A < - 0 0 33 -5,-1.2 11,-0.3 1,-0.1 -1,-0.2 -0.735 32.0-159.2 -98.9 143.3 -52.4 -8.6 56.2 80 88 A R S S+ 0 0 120 -2,-0.3 7,-1.6 1,-0.2 2,-0.4 0.704 78.7 50.1 -88.9 -24.1 -53.1 -9.0 59.9 81 89 A F E -A 86 0A 126 5,-0.3 2,-0.5 9,-0.0 5,-0.2 -0.969 54.7-177.2-126.2 133.9 -51.0 -12.1 60.4 82 90 A R E > S-A 85 0A 28 3,-3.5 3,-0.6 -2,-0.4 0, 0.0 -0.963 79.3 -29.1-127.2 108.6 -47.4 -12.8 59.4 83 91 A R T 3 S- 0 0 160 -2,-0.5 3,-0.1 1,-0.2 -1,-0.1 0.849 129.8 -39.3 51.9 43.4 -46.1 -16.4 60.2 84 92 A G T 3 S+ 0 0 79 1,-0.2 2,-0.3 0, 0.0 -1,-0.2 0.637 123.1 89.9 86.2 14.9 -48.5 -16.8 63.1 85 93 A K E < S-A 82 0A 50 -3,-0.6 -3,-3.5 -58,-0.0 2,-0.4 -0.981 83.8 -95.4-142.1 153.6 -48.2 -13.3 64.6 86 94 A E E -A 81 0A 65 -2,-0.3 -5,-0.3 -5,-0.2 -6,-0.1 -0.550 47.7-120.6 -71.9 122.0 -50.0 -10.0 64.2 87 95 A T > - 0 0 4 -7,-1.6 4,-1.7 -2,-0.4 3,-0.3 -0.060 18.2-112.4 -57.7 160.5 -48.2 -7.8 61.7 88 96 A I H >>S+ 0 0 2 1,-0.2 4,-3.4 2,-0.2 5,-0.6 0.901 115.3 55.5 -62.1 -43.2 -46.8 -4.4 62.6 89 97 A N H >5S+ 0 0 17 3,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.795 106.8 49.4 -64.1 -29.3 -49.3 -2.6 60.4 90 98 A F H 45S+ 0 0 96 -3,-0.3 -1,-0.2 -11,-0.3 -2,-0.2 0.923 119.5 37.3 -74.4 -43.8 -52.3 -4.2 62.1 91 99 A M H <5S+ 0 0 66 -4,-1.7 -2,-0.2 1,-0.1 -3,-0.2 0.949 137.8 14.6 -71.4 -51.7 -51.1 -3.4 65.6 92 100 A Y H <5S- 0 0 35 -4,-3.4 4,-0.2 1,-0.2 -3,-0.2 0.503 110.1-106.1-106.5 -5.1 -49.6 0.0 64.9 93 101 A G X< - 0 0 7 -4,-0.9 4,-1.6 -5,-0.6 3,-0.4 -0.155 39.1 -67.7 101.5 162.0 -50.9 1.1 61.5 94 102 A D H > S+ 0 0 82 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.873 126.1 51.3 -57.6 -45.7 -49.6 1.4 58.0 95 103 A K H > S+ 0 0 22 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.808 108.5 52.7 -66.1 -28.7 -47.1 4.3 58.5 96 104 A A H > S+ 0 0 0 -3,-0.4 4,-1.8 -4,-0.2 -1,-0.2 0.881 109.9 49.1 -72.2 -37.4 -45.5 2.5 61.5 97 105 A A H X S+ 0 0 0 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.905 111.3 48.3 -67.2 -44.0 -45.0 -0.6 59.4 98 106 A V H X S+ 0 0 4 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.911 112.8 48.5 -63.9 -42.6 -43.4 1.4 56.5 99 107 A A H X S+ 0 0 0 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.850 109.3 53.5 -66.1 -35.5 -41.1 3.2 58.9 100 108 A A H X S+ 0 0 0 -4,-1.8 4,-2.7 2,-0.2 -1,-0.2 0.909 107.6 50.0 -66.0 -43.2 -40.1 -0.0 60.5 101 109 A G H X S+ 0 0 2 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.891 112.4 48.4 -62.2 -39.0 -39.1 -1.5 57.2 102 110 A D H X S+ 0 0 14 -4,-1.8 4,-1.6 1,-0.2 -2,-0.2 0.895 111.9 49.0 -67.3 -40.6 -37.1 1.6 56.5 103 111 A L H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.878 108.1 54.1 -67.5 -38.3 -35.4 1.5 59.9 104 112 A V H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.948 107.7 49.3 -61.1 -48.6 -34.6 -2.2 59.5 105 113 A L H X S+ 0 0 20 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.867 109.2 54.1 -59.2 -35.5 -32.8 -1.6 56.2 106 114 A V H X S+ 0 0 3 -4,-1.6 4,-2.4 1,-0.2 -1,-0.2 0.917 104.6 53.5 -64.6 -42.2 -30.9 1.2 57.9 107 115 A S H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.883 107.9 51.6 -60.2 -37.0 -29.8 -1.1 60.6 108 116 A A H X S+ 0 0 2 -4,-1.9 4,-2.4 2,-0.2 5,-0.3 0.964 109.6 48.3 -63.1 -52.2 -28.4 -3.5 57.9 109 117 A F H X S+ 0 0 24 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.870 113.2 48.8 -54.8 -40.6 -26.5 -0.6 56.2 110 118 A H H X S+ 0 0 58 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.914 109.1 52.3 -67.0 -43.5 -25.1 0.4 59.6 111 119 A T 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50.9 -71.2 -27.7 -29.8 -11.9 47.8 163 171 A F H X S+ 0 0 4 -4,-0.8 4,-2.0 -3,-0.2 5,-0.2 0.911 108.0 53.9 -72.6 -41.8 -29.2 -15.6 47.6 164 172 A G H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.877 109.2 47.8 -57.6 -38.9 -26.2 -14.9 45.4 165 173 A L H X S+ 0 0 0 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.888 105.8 59.9 -69.1 -38.0 -24.9 -12.6 48.1 166 174 A A H < S+ 0 0 0 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.901 112.6 36.8 -55.9 -44.8 -25.6 -15.3 50.7 167 175 A L H < S+ 0 0 2 -4,-2.0 4,-0.4 1,-0.2 -1,-0.2 0.834 115.2 56.0 -77.0 -33.7 -23.2 -17.8 49.0 168 176 A Q H X S+ 0 0 24 -4,-2.0 4,-2.0 -5,-0.2 3,-0.5 0.734 81.2 89.9 -71.4 -25.3 -20.8 -15.1 48.0 169 177 A L H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 5,-0.3 0.848 81.9 55.8 -40.0 -53.0 -20.2 -13.8 51.6 170 178 A P H > S+ 0 0 0 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.935 110.6 44.2 -48.0 -55.6 -17.3 -16.2 52.3 171 179 A A H >>>S+ 0 0 0 -3,-0.5 5,-2.6 -4,-0.4 4,-0.7 0.944 112.9 51.3 -54.8 -54.1 -15.3 -15.0 49.4 172 180 A L H 3<5S+ 0 0 14 -4,-2.0 3,-0.4 1,-0.3 -1,-0.2 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222 230 A F H > S+ 0 0 2 -2,-0.4 4,-2.3 1,-0.2 5,-0.2 0.941 103.7 42.5 -50.8 -56.6 -43.7 -19.0 36.6 223 231 A P H > S+ 0 0 0 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.882 116.7 49.7 -59.8 -37.8 -46.6 -21.3 35.6 224 232 A L H > S+ 0 0 2 1,-0.2 4,-1.7 2,-0.2 3,-0.3 0.941 112.5 45.1 -65.9 -49.9 -48.6 -18.3 34.4 225 233 A V H X S+ 0 0 0 -4,-3.4 4,-1.7 1,-0.2 5,-0.3 0.839 108.2 58.4 -63.9 -35.4 -45.8 -16.9 32.2 226 234 A T H X S+ 0 0 27 -4,-2.3 4,-1.3 -5,-0.3 -1,-0.2 0.855 106.7 48.9 -63.8 -35.1 -44.9 -20.4 30.8 227 235 A A H X S+ 0 0 1 -4,-1.3 4,-1.6 -3,-0.3 7,-0.3 0.949 109.6 48.5 -70.2 -51.3 -48.5 -20.7 29.5 228 236 A M H < S+ 0 0 2 -4,-1.7 7,-0.4 6,-0.2 -2,-0.2 0.833 113.0 45.8 -60.5 -39.1 -48.8 -17.4 27.7 229 237 A E H < S+ 0 0 101 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.902 115.9 45.5 -72.6 -41.0 -45.5 -17.5 25.8 230 238 A K H < S+ 0 0 102 -4,-1.3 -2,-0.2 -5,-0.3 -1,-0.2 0.714 125.7 30.4 -74.9 -22.4 -46.0 -21.1 24.7 231 239 A F >X - 0 0 44 -4,-1.6 3,-1.5 1,-0.1 4,-1.5 -0.856 58.0-167.3-141.9 104.6 -49.6 -20.5 23.6 232 240 A P H 3> S+ 0 0 83 0, 0.0 4,-3.2 0, 0.0 5,-0.3 0.904 93.1 66.5 -54.9 -38.5 -50.8 -17.1 22.4 233 241 A E H 3> S+ 0 0 103 1,-0.3 4,-1.9 2,-0.2 -5,-0.1 0.827 102.0 47.2 -49.1 -36.5 -54.3 -18.4 22.8 234 242 A A H <> S+ 0 0 0 -3,-1.5 4,-1.7 -7,-0.3 -1,-0.3 0.862 109.8 52.0 -74.8 -37.5 -53.6 -18.5 26.6 235 243 A R H X S+ 0 0 79 -4,-1.5 4,-1.9 -7,-0.4 -2,-0.2 0.909 110.3 49.0 -64.4 -42.2 -52.1 -14.9 26.5 236 244 A Q H X S+ 0 0 108 -4,-3.2 4,-2.0 1,-0.2 -2,-0.2 0.931 108.8 52.9 -62.0 -46.9 -55.3 -13.8 24.7 237 245 A M H <>S+ 0 0 23 -4,-1.9 5,-2.6 -5,-0.3 -1,-0.2 0.838 108.1 52.5 -57.8 -34.4 -57.4 -15.5 27.3 238 246 A F H ><5S+ 0 0 3 -4,-1.7 3,-1.6 3,-0.2 -1,-0.2 0.898 106.5 50.9 -69.2 -42.7 -55.5 -13.7 30.0 239 247 A E H 3<5S+ 0 0 93 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.876 108.9 51.8 -63.9 -37.1 -56.1 -10.2 28.5 240 248 A N T 3<5S- 0 0 108 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.306 112.1-124.1 -81.7 10.3 -59.8 -10.9 28.3 241 249 A R T < 5 + 0 0 107 -3,-1.6 2,-1.7 1,-0.2 -3,-0.2 0.790 54.1 160.0 51.9 29.9 -59.6 -11.9 32.0 242 250 A D >< + 0 0 70 -5,-2.6 4,-2.2 1,-0.2 -1,-0.2 -0.619 4.7 164.1 -85.2 82.9 -61.1 -15.2 31.0 243 251 A W H > + 0 0 31 -2,-1.7 4,-3.7 2,-0.2 5,-0.4 0.962 67.5 51.5 -65.4 -60.3 -60.0 -17.1 34.1 244 252 A S H > S+ 0 0 103 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.843 116.6 45.8 -49.0 -35.1 -62.2 -20.3 34.1 245 253 A G H > S+ 0 0 14 2,-0.2 4,-3.5 3,-0.2 -1,-0.2 0.923 113.1 46.9 -74.9 -45.7 -61.0 -20.7 30.5 246 254 A L H X S+ 0 0 2 -4,-2.2 4,-2.9 1,-0.2 -2,-0.2 0.937 112.2 50.8 -61.1 -46.9 -57.3 -20.0 31.3 247 255 A M H X S+ 0 0 66 -4,-3.7 4,-0.9 1,-0.2 -1,-0.2 0.840 115.3 44.7 -58.6 -34.6 -57.4 -22.4 34.3 248 256 A S H X S+ 0 0 64 -4,-1.1 4,-2.1 -5,-0.4 3,-0.5 0.922 111.6 50.6 -74.8 -48.0 -59.0 -25.0 32.0 249 257 A F H X S+ 0 0 14 -4,-3.5 4,-2.4 1,-0.2 -2,-0.2 0.893 109.1 53.4 -57.2 -42.0 -56.6 -24.4 29.1 250 258 A M H <>S+ 0 0 7 -4,-2.9 5,-2.1 1,-0.2 6,-0.5 0.788 110.8 43.8 -66.2 -30.6 -53.6 -24.7 31.5 251 259 A R H ><5S+ 0 0 178 -4,-0.9 3,-0.6 -3,-0.5 -1,-0.2 0.782 110.8 59.2 -81.9 -28.4 -54.7 -28.1 32.8 252 260 A E H 3<5S+ 0 0 124 -4,-2.1 -2,-0.2 1,-0.2 -3,-0.2 0.941 114.1 33.5 -62.8 -50.7 -55.5 -29.0 29.2 253 261 A K T 3<5S- 0 0 74 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.241 107.8-124.8 -90.9 12.6 -51.9 -28.4 28.1 254 262 A G T <>5 + 0 0 15 -3,-0.6 4,-2.3 -5,-0.1 -3,-0.2 0.836 52.4 158.8 46.7 40.0 -50.5 -29.6 31.5 255 263 A I H > S+ 0 0 45 -6,-0.5 4,-2.4 1,-0.2 -1,-0.2 0.906 110.3 50.3 -51.5 -46.3 -48.3 -26.8 35.7 257 265 A K H > S+ 0 0 106 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.917 108.5 51.3 -60.1 -45.5 -47.0 -30.3 35.2 258 266 A E H X S+ 0 0 76 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.895 109.9 50.7 -59.2 -40.6 -44.3 -29.1 32.7 259 267 A C H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.929 106.1 54.8 -62.2 -46.1 -43.2 -26.4 35.2 260 268 A E H X S+ 0 0 98 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.866 111.7 45.8 -55.7 -38.0 -42.9 -29.0 38.0 261 269 A E H X S+ 0 0 128 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.908 108.9 52.2 -73.7 -44.7 -40.6 -31.0 35.7 262 270 A T H X S+ 0 0 70 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.922 109.1 52.9 -57.5 -43.6 -38.4 -28.1 34.5 263 271 A L H X S+ 0 0 12 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.940 106.8 52.4 -55.1 -50.8 -37.9 -27.2 38.2 264 272 A K H X S+ 0 0 110 -4,-1.6 4,-2.2 1,-0.2 5,-0.2 0.858 106.7 52.1 -55.9 -40.2 -36.8 -30.7 39.0 265 273 A V H X S+ 0 0 95 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.960 111.2 47.3 -61.6 -49.9 -34.2 -30.7 36.2 266 274 A L H X S+ 0 0 64 -4,-2.1 4,-0.9 1,-0.2 -2,-0.2 0.848 111.7 51.5 -58.9 -38.2 -32.7 -27.5 37.5 267 275 A V H X S+ 0 0 31 -4,-2.3 4,-1.4 2,-0.2 -1,-0.2 0.889 112.1 43.7 -69.4 -41.8 -32.7 -28.8 41.1 268 276 A K H X S+ 0 0 125 -4,-2.2 4,-4.6 1,-0.2 5,-0.3 0.931 111.2 54.2 -69.7 -44.6 -30.9 -32.0 40.3 269 277 A N H X S+ 0 0 70 -4,-2.5 4,-1.1 1,-0.3 -1,-0.2 0.753 106.7 53.0 -60.9 -24.2 -28.4 -30.3 38.0 270 278 A V H X S+ 0 0 14 -4,-0.9 4,-0.8 -5,-0.2 -1,-0.3 0.866 116.4 39.1 -76.0 -36.9 -27.6 -27.9 40.9 271 279 A I H < S+ 0 0 18 -4,-1.4 3,-0.3 -3,-0.2 -2,-0.2 0.880 111.9 56.7 -77.4 -41.5 -27.0 -31.0 43.0 272 280 A I H < S+ 0 0 127 -4,-4.6 3,-0.3 1,-0.2 -3,-0.2 0.830 118.7 33.8 -59.2 -32.6 -25.2 -32.9 40.2 273 281 A E H < S+ 0 0 128 -4,-1.1 -1,-0.2 -5,-0.3 -2,-0.2 0.528 123.7 42.0-102.3 -9.2 -22.7 -30.1 39.9 274 282 A N >< + 0 0 37 -4,-0.8 3,-3.2 -3,-0.3 -1,-0.2 -0.497 62.5 178.1-139.1 67.6 -22.5 -28.9 43.5 275 283 A S G > S+ 0 0 75 1,-0.3 3,-2.3 -3,-0.3 -1,-0.1 0.794 76.0 67.9 -35.6 -49.0 -22.3 -32.0 45.7 276 284 A W G 3 S+ 0 0 53 1,-0.3 3,-0.3 2,-0.1 -1,-0.3 0.670 92.6 62.5 -52.7 -17.7 -21.9 -30.0 48.9 277 285 A L G < + 0 0 11 -3,-3.2 -1,-0.3 1,-0.2 -2,-0.2 0.211 65.7 103.6 -95.1 16.4 -25.5 -28.7 48.4 278 286 A R < + 0 0 150 -3,-2.3 2,-1.1 1,-0.1 -1,-0.2 0.302 55.7 101.7 -78.1 12.2 -27.0 -32.2 48.7 279 287 A D 0 0 128 -3,-0.3 -1,-0.1 -4,-0.1 -3,-0.0 -0.729 360.0 360.0 -98.1 83.1 -28.0 -30.9 52.2 280 288 A F 0 0 170 -2,-1.1 -3,-0.0 0, 0.0 -2,-0.0 -0.947 360.0 360.0-156.6 360.0 -31.6 -30.1 51.5 281 !* 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 0.0 282 9 B N > 0 0 104 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 151.2 -27.9 30.7 43.6 283 10 B S H > + 0 0 95 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.829 360.0 48.8 -49.2 -48.7 -29.8 29.9 40.3 284 11 B Y H > S+ 0 0 157 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.942 112.6 46.6 -63.6 -48.9 -26.9 28.4 38.3 285 12 B E H > S+ 0 0 33 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.925 111.6 54.1 -57.7 -43.6 -25.7 26.0 41.1 286 13 B L H X S+ 0 0 17 -4,-2.3 4,-1.9 1,-0.2 3,-0.4 0.923 106.4 50.9 -56.4 -47.3 -29.3 25.0 41.6 287 14 B E H X S+ 0 0 95 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.860 105.5 56.7 -60.1 -36.4 -29.7 24.1 37.9 288 15 B K H X S+ 0 0 65 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.868 107.5 48.7 -63.8 -35.9 -26.5 22.0 38.1 289 16 B V H X S+ 0 0 0 -4,-1.6 4,-3.2 -3,-0.4 -1,-0.2 0.866 107.7 52.7 -73.3 -36.7 -28.1 20.0 40.9 290 17 B K H X S+ 0 0 57 -4,-1.9 4,-2.9 2,-0.2 5,-0.2 0.940 110.5 50.0 -61.4 -44.7 -31.4 19.4 39.0 291 18 B E H X S+ 0 0 140 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.913 112.7 46.0 -57.9 -45.3 -29.3 18.2 36.1 292 19 B R H X S+ 0 0 59 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.907 111.9 51.7 -64.9 -43.7 -27.4 15.8 38.5 293 20 B I H X S+ 0 0 2 -4,-3.2 4,-2.5 1,-0.2 5,-0.3 0.970 109.3 48.8 -56.7 -56.7 -30.6 14.6 40.1 294 21 B E H X S+ 0 0 78 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.857 112.5 50.9 -51.6 -39.2 -32.2 13.8 36.8 295 22 B Q H X S+ 0 0 97 -4,-1.7 4,-1.3 -5,-0.2 -1,-0.2 0.909 109.1 48.2 -67.6 -45.3 -29.1 11.9 35.8 296 23 B I H X S+ 0 0 6 -4,-2.5 4,-0.7 1,-0.2 3,-0.3 0.930 114.1 46.1 -62.8 -46.5 -28.9 9.8 39.0 297 24 B L H >X S+ 0 0 0 -4,-2.5 4,-3.4 1,-0.2 3,-1.4 0.907 106.7 58.8 -63.5 -42.2 -32.5 8.8 38.8 298 25 B S H 3< S+ 0 0 29 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.834 101.4 55.8 -56.2 -34.1 -32.3 8.0 35.1 299 26 B Q H 3< S+ 0 0 138 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.747 120.6 30.4 -70.6 -22.4 -29.6 5.4 35.9 300 27 B F H << S+ 0 0 45 -3,-1.4 -2,-0.2 -4,-0.7 -1,-0.2 0.734 111.0 63.6-108.1 -30.4 -31.9 3.7 38.3 301 28 B F S < S- 0 0 6 -4,-3.4 2,-0.1 -5,-0.1 -1,-0.0 -0.758 85.8-106.2-102.5 145.3 -35.5 4.2 37.0 302 29 B P > - 0 0 37 0, 0.0 4,-1.9 0, 0.0 3,-0.3 -0.415 35.0-116.0 -64.6 142.0 -37.0 2.9 33.8 303 30 B E H > S+ 0 0 131 1,-0.2 4,-1.2 2,-0.2 -2,-0.0 0.864 109.6 63.7 -44.3 -47.2 -37.4 5.8 31.3 304 31 B Q H >4 S+ 0 0 102 1,-0.2 3,-0.7 2,-0.2 4,-0.3 0.924 112.0 31.3 -43.5 -65.3 -41.2 5.4 31.3 305 32 B I H >> S+ 0 0 0 -3,-0.3 3,-1.4 1,-0.2 4,-0.8 0.734 102.4 84.0 -69.8 -22.9 -41.8 6.3 35.0 306 33 B M H >< S+ 0 0 9 -4,-1.9 3,-0.9 1,-0.3 -1,-0.2 0.881 91.4 47.1 -46.4 -47.6 -38.8 8.6 34.9 307 34 B K T << S+ 0 0 138 -4,-1.2 -1,-0.3 -3,-0.7 -2,-0.2 0.701 107.7 57.8 -71.1 -19.6 -41.0 11.4 33.5 308 35 B D T <4 S+ 0 0 22 -3,-1.4 -1,-0.2 -4,-0.3 -2,-0.2 0.539 78.5 110.8 -89.8 -7.3 -43.7 10.8 36.0 309 36 B L S << S- 0 0 1 -3,-0.9 2,-2.3 -4,-0.8 3,-0.2 -0.367 78.9-117.9 -68.7 146.7 -41.6 11.3 39.1 310 37 B P + 0 0 29 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.511 51.0 168.9 -81.9 68.8 -42.3 14.5 41.2 311 38 B L + 0 0 29 -2,-2.3 2,-0.5 1,-0.2 37,-0.1 0.831 45.5 32.7 -60.0 -41.9 -38.8 15.7 40.5 312 39 B Y + 0 0 91 -3,-0.2 -1,-0.2 2,-0.0 2,-0.0 -0.865 54.8 158.5-133.4 116.7 -38.4 19.3 41.6 313 40 B G S S- 0 0 57 -2,-0.5 -2,-0.0 -3,-0.1 51,-0.0 0.066 71.5 -55.4 -99.2-148.9 -40.1 21.2 44.5 314 41 B K - 0 0 149 1,-0.1 5,-0.1 -2,-0.0 -2,-0.0 0.779 61.2-146.9 -64.7 -27.0 -38.9 24.3 46.2 315 42 B M > + 0 0 6 3,-0.1 4,-1.9 29,-0.1 3,-0.2 0.872 34.3 164.3 59.6 40.1 -35.6 22.6 46.9 316 43 B L H > + 0 0 51 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.874 68.8 50.5 -53.0 -47.2 -35.3 24.5 50.2 317 44 B R H > S+ 0 0 21 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.869 109.2 50.5 -63.7 -39.6 -32.5 22.3 51.6 318 45 B V H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.878 110.2 51.8 -66.7 -36.6 -30.4 22.5 48.5 319 46 B R H X S+ 0 0 126 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.926 110.7 45.7 -66.3 -46.5 -30.7 26.3 48.6 320 47 B L H X S+ 0 0 27 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.920 113.0 51.2 -63.2 -42.8 -29.6 26.7 52.2 321 48 B S H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.888 108.7 50.4 -62.3 -40.6 -26.7 24.3 51.6 322 49 B I H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.954 110.6 50.5 -61.3 -46.4 -25.5 26.2 48.6 323 50 B L H X S+ 0 0 30 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.834 109.7 51.3 -58.9 -33.1 -25.7 29.3 50.8 324 51 B S H X S+ 0 0 0 -4,-1.9 4,-2.0 2,-0.2 6,-0.2 0.914 105.8 54.3 -71.1 -43.3 -23.7 27.5 53.4 325 52 B F H <>S+ 0 0 0 -4,-2.6 5,-2.6 1,-0.2 4,-0.4 0.946 113.5 42.1 -53.5 -52.9 -21.0 26.5 50.9 326 53 B K H ><5S+ 0 0 88 -4,-2.2 3,-1.4 1,-0.2 -1,-0.2 0.917 110.9 54.2 -63.0 -46.9 -20.5 30.1 49.9 327 54 B N H 3<5S+ 0 0 83 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.847 114.0 43.8 -57.1 -33.1 -20.6 31.5 53.4 328 55 B R T 3<5S- 0 0 101 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.471 112.3-121.9 -90.8 -4.0 -17.9 29.1 54.3 329 56 B G T < 5 + 0 0 66 -3,-1.4 2,-0.5 -4,-0.4 -3,-0.2 0.739 59.9 149.1 70.6 22.0 -15.9 29.8 51.2 330 57 B V < - 0 0 13 -5,-2.6 -1,-0.2 -6,-0.2 2,-0.1 -0.795 48.0-121.7 -92.0 127.1 -16.0 26.2 50.1 331 58 B E - 0 0 177 -2,-0.5 2,-1.0 -3,-0.1 5,-0.1 -0.420 16.4-131.6 -68.6 138.8 -16.0 25.7 46.3 332 59 B I + 0 0 16 -2,-0.1 -1,-0.1 4,-0.1 2,-0.1 -0.746 45.6 150.1 -96.3 92.2 -18.9 23.8 44.8 333 60 B G > - 0 0 39 -2,-1.0 4,-2.4 4,-0.0 5,-0.2 -0.042 62.5 -58.6-101.5-154.8 -17.4 21.2 42.5 334 61 B E H > S+ 0 0 170 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.952 133.5 46.2 -53.5 -59.4 -18.5 17.7 41.3 335 62 B D H > S+ 0 0 83 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.881 111.7 53.4 -53.4 -41.9 -18.6 16.1 44.7 336 63 B A H > S+ 0 0 3 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.924 110.0 46.9 -60.9 -45.7 -20.5 19.1 46.1 337 64 B I H X S+ 0 0 13 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.918 111.7 50.6 -63.1 -44.2 -23.1 18.8 43.3 338 65 B S H X S+ 0 0 9 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.901 112.1 48.0 -60.4 -41.3 -23.5 15.0 43.9 339 66 B S H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.929 111.2 49.0 -65.0 -46.9 -23.9 15.6 47.6 340 67 B L H X S+ 0 0 0 -4,-2.6 4,-1.5 1,-0.2 -1,-0.2 0.853 112.0 51.4 -60.8 -34.7 -26.5 18.3 47.1 341 68 B A H X S+ 0 0 0 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.928 110.8 45.5 -68.1 -46.9 -28.3 16.0 44.7 342 69 B A H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 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-2,-0.2 0.895 113.4 45.6 -58.0 -39.7 -43.2 9.2 47.8 353 80 B H H X S+ 0 0 8 -4,-1.5 4,-1.8 2,-0.2 -1,-0.2 0.876 109.1 53.6 -72.2 -38.8 -43.8 7.3 50.9 354 81 B D H X S+ 0 0 39 -4,-1.9 4,-1.5 1,-0.2 6,-0.2 0.893 108.1 53.0 -62.4 -38.2 -45.9 10.0 52.6 355 82 B D H X>S+ 0 0 8 -4,-2.3 5,-1.8 2,-0.2 4,-0.8 0.805 106.5 49.7 -68.2 -32.7 -48.1 10.1 49.5 356 83 B V H <5S+ 0 0 14 -4,-1.1 -1,-0.2 2,-0.2 -2,-0.2 0.909 113.0 47.8 -72.1 -41.0 -48.9 6.4 49.4 357 84 B I H <5S+ 0 0 53 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.785 116.0 43.6 -68.6 -28.9 -49.8 6.4 53.1 358 85 B D H <5S- 0 0 110 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.591 104.9-130.3 -90.8 -13.2 -52.0 9.5 52.6 359 86 B G T <5 + 0 0 54 -4,-0.8 -3,-0.2 1,-0.2 -4,-0.1 0.786 42.6 179.2 67.4 26.0 -53.5 8.0 49.4 360 87 B A < - 0 0 24 -5,-1.8 11,-0.3 -6,-0.2 -1,-0.2 -0.364 25.1-168.8 -64.4 135.0 -52.7 11.3 47.8 361 88 B R S S+ 0 0 113 1,-0.2 7,-3.0 -3,-0.1 2,-0.4 0.761 72.0 47.4 -93.4 -31.5 -53.6 11.6 44.1 362 89 B F E -B 367 0B 120 5,-0.3 2,-0.4 9,-0.1 5,-0.2 -0.929 51.2-173.1-119.8 137.9 -51.7 14.9 43.5 363 90 B R E > S-B 366 0B 49 3,-3.1 3,-0.6 -2,-0.4 4,-0.0 -0.758 73.5 -64.9-123.7 79.0 -48.2 16.0 44.4 364 91 B R T 3 S- 0 0 187 -2,-0.4 3,-0.1 1,-0.2 -1,-0.0 0.896 122.3 -3.0 37.7 91.4 -48.3 19.7 43.3 365 92 B G T 3 S+ 0 0 86 1,-0.1 2,-0.3 -55,-0.0 -1,-0.2 0.067 125.2 64.8 94.8 -25.6 -48.8 19.8 39.5 366 93 B K E < S-B 363 0B 96 -3,-0.6 -3,-3.1 -56,-0.0 2,-0.3 -0.942 82.5-108.0-134.2 155.1 -48.7 16.0 38.9 367 94 B E E -B 362 0B 62 -2,-0.3 -5,-0.3 -5,-0.2 -6,-0.1 -0.606 50.8-107.3 -76.8 137.5 -50.6 12.9 39.7 368 95 B T > - 0 0 6 -7,-3.0 4,-2.0 -2,-0.3 5,-0.2 -0.153 17.4-115.7 -65.0 159.5 -48.7 10.8 42.2 369 96 B I H >>S+ 0 0 2 1,-0.2 4,-3.3 2,-0.2 5,-0.6 0.871 117.0 54.5 -62.6 -37.0 -46.9 7.5 41.4 370 97 B N H >5S+ 0 0 12 3,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.857 108.5 47.1 -67.6 -34.6 -49.4 5.7 43.7 371 98 B F H 45S+ 0 0 98 -11,-0.3 -1,-0.2 2,-0.2 -2,-0.2 0.872 121.2 38.0 -73.6 -35.6 -52.4 7.0 41.8 372 99 B M H <5S+ 0 0 73 -4,-2.0 -2,-0.2 2,-0.1 -3,-0.2 0.915 136.2 14.6 -80.9 -48.2 -50.9 6.2 38.4 373 100 B Y H <5S- 0 0 32 -4,-3.3 4,-0.3 1,-0.3 -3,-0.2 0.478 110.1-108.8-109.2 -4.0 -49.2 2.9 39.1 374 101 B G X< - 0 0 7 -4,-1.0 4,-1.7 -5,-0.6 -1,-0.3 -0.209 38.8 -64.4 100.0 167.5 -50.7 1.8 42.4 375 102 B D H > S+ 0 0 85 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.921 126.9 48.4 -60.0 -53.5 -49.5 1.5 46.0 376 103 B K H > S+ 0 0 19 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.842 110.6 54.9 -59.6 -31.9 -46.8 -1.2 45.7 377 104 B A H > S+ 0 0 0 -4,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.923 109.8 46.6 -65.3 -43.4 -45.3 0.7 42.8 378 105 B A H X S+ 0 0 0 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.894 111.2 49.4 -66.1 -43.9 -45.1 3.9 44.9 379 106 B V H X S+ 0 0 11 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.881 112.3 49.4 -64.6 -37.1 -43.5 2.2 47.9 380 107 B A H X S+ 0 0 4 -4,-1.9 4,-2.6 -5,-0.2 -2,-0.2 0.911 108.7 52.3 -67.1 -42.9 -40.9 0.5 45.7 381 108 B A H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.868 106.9 54.5 -60.7 -37.5 -40.1 3.8 44.0 382 109 B G H X S+ 0 0 1 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.900 111.0 43.6 -64.2 -42.2 -39.6 5.4 47.4 383 110 B D H X S+ 0 0 23 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.887 112.6 52.6 -70.2 -39.6 -37.0 2.7 48.4 384 111 B L H X S+ 0 0 1 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.852 106.2 54.3 -65.5 -34.2 -35.3 2.9 45.0 385 112 B V H X S+ 0 0 0 -4,-2.1 4,-1.3 1,-0.2 -1,-0.2 0.937 108.5 48.7 -64.3 -44.6 -35.0 6.6 45.3 386 113 B L H X S+ 0 0 19 -4,-1.6 4,-2.4 1,-0.2 -2,-0.2 0.880 109.1 53.6 -61.9 -38.8 -33.2 6.1 48.7 387 114 B V H X S+ 0 0 3 -4,-2.1 4,-2.9 1,-0.2 5,-0.2 0.928 104.7 53.3 -62.1 -45.1 -30.9 3.5 47.1 388 115 B S H X S+ 0 0 0 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.819 109.3 51.6 -59.5 -29.2 -29.9 6.0 44.4 389 116 B A H X S+ 0 0 4 -4,-1.3 4,-2.2 2,-0.2 5,-0.2 0.943 109.4 47.6 -71.5 -48.7 -29.0 8.3 47.2 390 117 B F H X S+ 0 0 30 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.890 111.9 51.3 -58.5 -41.2 -26.9 5.8 49.0 391 118 B H H X S+ 0 0 61 -4,-2.9 4,-2.2 2,-0.2 -1,-0.2 0.905 108.2 52.4 -63.3 -42.5 -25.1 4.9 45.7 392 119 B T H X S+ 0 0 1 -4,-1.7 4,-1.0 -5,-0.2 -2,-0.2 0.946 111.9 43.4 -60.1 -52.0 -24.4 8.6 45.1 393 120 B V H X S+ 0 0 4 -4,-2.2 4,-0.6 1,-0.2 3,-0.4 0.862 111.6 56.0 -63.5 -35.3 -22.8 9.2 48.5 394 121 B E H >< S+ 0 0 17 -4,-2.0 3,-1.1 -5,-0.2 -1,-0.2 0.915 101.7 57.1 -62.1 -43.4 -20.9 5.9 48.2 395 122 B E H 3< S+ 0 0 126 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.788 94.6 67.0 -58.5 -31.5 -19.4 7.0 44.8 396 123 B I H 3< S- 0 0 25 -4,-1.0 -1,-0.2 -3,-0.4 -2,-0.2 0.813 93.1-142.0 -62.7 -32.3 -17.8 10.1 46.4 397 124 B G << + 0 0 49 -3,-1.1 2,-0.8 -4,-0.6 -1,-0.1 0.353 53.6 134.9 87.5 -7.7 -15.4 8.1 48.6 398 125 B N > - 0 0 38 -5,-0.4 4,-2.0 1,-0.2 -1,-0.2 -0.681 38.9-163.9 -80.4 110.1 -15.7 10.3 51.7 399 126 B N H > S+ 0 0 79 -2,-0.8 4,-1.8 1,-0.2 -1,-0.2 0.866 87.0 46.0 -62.6 -42.0 -16.1 7.9 54.6 400 127 B K H > S+ 0 0 113 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.895 112.5 51.4 -69.2 -38.9 -17.3 10.5 57.2 401 128 B L H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.877 108.3 53.3 -63.1 -38.4 -19.7 12.0 54.6 402 129 B R H X S+ 0 0 25 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.908 111.6 44.2 -63.6 -43.7 -21.1 8.5 54.0 403 130 B R H X S+ 0 0 107 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.820 107.8 58.4 -72.6 -31.1 -21.7 7.9 57.7 404 131 B A H X S+ 0 0 19 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.907 108.0 47.5 -64.2 -41.0 -23.3 11.4 58.2 405 132 B F H X S+ 0 0 6 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.922 111.7 49.3 -65.2 -45.9 -25.9 10.5 55.6 406 133 B L H X S+ 0 0 13 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.923 109.0 52.4 -59.8 -46.7 -26.6 7.1 57.1 407 134 B N H X S+ 0 0 88 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.873 111.7 47.4 -58.6 -37.8 -27.0 8.6 60.6 408 135 B V H X S+ 0 0 3 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.911 108.5 52.7 -71.1 -42.9 -29.5 11.1 59.2 409 136 B I H X S+ 0 0 9 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.900 111.4 49.7 -58.9 -38.9 -31.5 8.5 57.3 410 137 B G H X S+ 0 0 8 -4,-2.4 4,-2.8 1,-0.2 5,-0.2 0.937 107.7 50.8 -65.1 -48.8 -31.7 6.6 60.5 411 138 B K H X S+ 0 0 70 -4,-2.1 4,-2.5 1,-0.2 5,-0.2 0.878 109.5 52.5 -57.1 -40.5 -32.9 9.5 62.6 412 139 B M H X S+ 0 0 26 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.945 113.6 41.7 -61.3 -50.5 -35.6 10.3 60.1 413 140 B S H X S+ 0 0 12 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.862 114.8 51.3 -66.4 -38.0 -37.0 6.7 60.1 414 141 B E H X S+ 0 0 79 -4,-2.8 4,-2.6 2,-0.2 5,-0.2 0.944 111.1 47.2 -64.3 -48.5 -36.7 6.4 63.9 415 142 B A H X S+ 0 0 3 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.867 109.9 54.1 -60.0 -39.3 -38.6 9.7 64.5 416 143 B E H X S+ 0 0 22 -4,-1.9 4,-1.1 -5,-0.2 -1,-0.2 0.859 111.4 45.5 -64.5 -37.1 -41.3 8.6 62.1 417 144 B L H X S+ 0 0 0 -4,-1.7 4,-2.1 2,-0.2 3,-0.4 0.937 111.3 50.4 -71.9 -49.4 -41.8 5.4 64.0 418 145 B I H X S+ 0 0 57 -4,-2.6 4,-1.2 1,-0.2 -2,-0.2 0.889 105.8 57.7 -55.9 -42.8 -41.8 6.9 67.4 419 146 B E H < S+ 0 0 8 -4,-2.2 -1,-0.2 1,-0.2 3,-0.2 0.882 108.4 46.2 -56.7 -41.1 -44.4 9.5 66.3 420 147 B Q H >< S+ 0 0 25 -4,-1.1 3,-2.3 -3,-0.4 -1,-0.2 0.890 105.3 57.8 -70.9 -39.7 -46.8 6.7 65.3 421 148 B L H 3< S+ 0 0 24 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.772 111.0 45.5 -60.9 -22.6 -46.2 4.7 68.5 422 149 B S T >< S+ 0 0 27 -4,-1.2 3,-2.0 -3,-0.2 -1,-0.3 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