==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 14-JUL-08 3DST . COMPND 2 MOLECULE: GERANYLGERANYL TRANSFERASE TYPE-2 SUBUNIT ALPHA; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR Z.GUO,S.YU,R.S.GOODY,K.ALEXANDROV,W.BLANKENFELDT . 636 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26809.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 460 72.3 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 . 18 2.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.6 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 . 18 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 72 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 330 51.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.6 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 1 0 0 1 0 3 2 3 1 5 7 0 0 2 0 0 2 1 0 0 0 0 1 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 . 9 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 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 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 14 A A > 0 0 125 0, 0.0 4,-1.2 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -56.3 -9.5 13.3 48.3 2 15 A E H > + 0 0 78 2,-0.2 4,-3.8 3,-0.2 5,-0.3 0.947 360.0 47.1 -75.2 -52.7 -8.5 15.6 51.2 3 16 A A H > S+ 0 0 82 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.814 115.4 47.7 -60.6 -34.4 -5.4 13.8 52.4 4 17 A K H > S+ 0 0 69 2,-0.2 4,-1.2 3,-0.1 -1,-0.2 0.836 115.1 45.7 -72.3 -36.6 -4.2 13.5 48.8 5 18 A R H X S+ 0 0 51 -4,-1.2 4,-1.4 2,-0.2 -2,-0.2 0.912 113.5 48.3 -70.9 -45.5 -5.0 17.2 48.3 6 19 A L H X S+ 0 0 46 -4,-3.8 4,-1.6 1,-0.2 -2,-0.2 0.830 105.9 60.8 -62.7 -34.0 -3.3 18.3 51.6 7 20 A E H X S+ 0 0 51 -4,-1.3 4,-1.9 -5,-0.3 -1,-0.2 0.916 107.9 41.1 -60.4 -47.1 -0.3 16.1 50.7 8 21 A R H X S+ 0 0 110 -4,-1.2 4,-2.5 2,-0.2 -1,-0.2 0.735 108.5 60.9 -78.5 -21.8 0.5 18.1 47.5 9 22 A E H X S+ 0 0 36 -4,-1.4 4,-1.5 2,-0.2 -1,-0.2 0.840 108.8 44.9 -65.6 -35.1 -0.3 21.4 49.3 10 23 A Q H X S+ 0 0 115 -4,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.880 111.0 53.2 -71.3 -42.6 2.6 20.4 51.7 11 24 A K H X S+ 0 0 117 -4,-1.9 4,-2.8 1,-0.2 -2,-0.2 0.941 108.9 50.0 -55.8 -51.3 4.8 19.4 48.7 12 25 A L H X S+ 0 0 25 -4,-2.5 4,-3.9 2,-0.2 5,-0.2 0.927 106.5 53.1 -51.5 -55.1 4.3 22.8 47.1 13 26 A K H X S+ 0 0 143 -4,-1.5 4,-2.2 1,-0.3 -1,-0.2 0.894 114.8 42.1 -55.3 -42.1 5.1 24.8 50.1 14 27 A L H X S+ 0 0 106 -4,-1.8 4,-2.3 2,-0.2 -1,-0.3 0.873 115.2 49.9 -71.6 -39.6 8.4 23.0 50.5 15 28 A Y H X S+ 0 0 35 -4,-2.8 4,-2.1 -5,-0.2 -2,-0.2 0.884 112.9 48.7 -62.4 -40.2 9.0 23.1 46.7 16 29 A Q H X S+ 0 0 63 -4,-3.9 4,-2.2 2,-0.2 -2,-0.2 0.918 113.4 44.1 -67.6 -45.9 8.3 26.9 46.8 17 30 A S H X S+ 0 0 61 -4,-2.2 4,-2.8 -5,-0.2 -2,-0.2 0.890 113.8 50.2 -70.8 -40.1 10.6 27.6 49.8 18 31 A A H X S+ 0 0 7 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.928 112.4 48.3 -58.5 -45.2 13.5 25.5 48.4 19 32 A T H X S+ 0 0 23 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.883 112.6 48.6 -61.6 -40.8 13.1 27.3 45.0 20 33 A Q H X S+ 0 0 145 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.904 110.4 51.8 -63.0 -43.5 13.1 30.6 46.9 21 34 A A H X S+ 0 0 38 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.889 109.2 49.7 -61.7 -42.3 16.2 29.5 48.8 22 35 A V H X S+ 0 0 1 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.933 112.4 46.1 -62.2 -47.9 18.1 28.6 45.6 23 36 A F H X S+ 0 0 43 -4,-2.0 4,-2.3 1,-0.2 5,-0.2 0.902 113.1 50.7 -65.7 -41.8 17.3 31.9 43.9 24 37 A Q H X S+ 0 0 55 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.903 112.6 46.1 -58.1 -46.3 18.3 33.8 47.1 25 38 A K H <>S+ 0 0 56 -4,-2.4 5,-2.4 2,-0.2 -2,-0.2 0.902 112.7 50.6 -64.4 -40.3 21.6 31.9 47.3 26 39 A R H ><5S+ 0 0 49 -4,-2.5 3,-1.9 1,-0.2 -2,-0.2 0.926 107.9 50.0 -67.6 -48.8 22.4 32.4 43.6 27 40 A Q H 3<5S+ 0 0 180 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.875 110.8 53.9 -51.8 -39.5 21.8 36.1 43.6 28 41 A A T 3<5S- 0 0 62 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.388 116.1-117.2 -79.6 0.9 24.1 36.2 46.6 29 42 A G T < 5 + 0 0 53 -3,-1.9 2,-1.7 1,-0.2 -3,-0.2 0.657 63.3 148.2 73.2 16.5 26.9 34.3 44.7 30 43 A E < + 0 0 84 -5,-2.4 2,-1.5 -6,-0.1 5,-0.3 -0.605 15.8 171.7 -85.5 77.7 26.8 31.3 47.1 31 44 A L + 0 0 43 -2,-1.7 2,-0.2 -3,-0.1 -1,-0.1 -0.644 32.3 127.9 -85.9 80.0 27.7 28.6 44.5 32 45 A D S >> S- 0 0 50 -2,-1.5 4,-1.0 30,-0.1 3,-0.6 -0.743 76.6 -81.1-133.8 176.9 28.1 25.7 47.1 33 46 A E H 3> S+ 0 0 144 -2,-0.2 4,-1.7 2,-0.2 -2,-0.1 0.546 117.4 66.4 -58.6 -5.8 26.9 22.2 47.8 34 47 A S H 3> S+ 0 0 36 2,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.852 93.3 54.6-105.3 -27.3 23.6 23.4 49.2 35 48 A V H <> S+ 0 0 5 -3,-0.6 4,-3.0 -5,-0.3 5,-0.3 0.789 109.3 52.4 6.5 -76.4 22.4 24.7 46.1 36 49 A L H X S+ 0 0 16 -4,-1.0 4,-1.7 2,-0.2 -2,-0.3 0.917 111.2 45.4 -62.1 -40.9 23.1 21.1 45.1 37 50 A E H X S+ 0 0 102 -4,-1.7 4,-1.2 2,-0.2 -2,-0.2 0.940 116.1 45.8 -66.5 -47.5 21.1 19.8 48.0 38 51 A L H X S+ 0 0 30 -4,-2.5 4,-1.1 1,-0.2 3,-0.5 0.932 113.2 48.3 -59.8 -51.1 18.2 22.2 47.4 39 52 A T H X S+ 0 0 0 -4,-3.0 4,-3.4 1,-0.2 5,-0.3 0.835 104.9 59.3 -63.6 -31.9 18.1 21.6 43.6 40 53 A S H X S+ 0 0 33 -4,-1.7 4,-1.4 -5,-0.3 -1,-0.2 0.877 104.4 52.0 -63.4 -34.5 18.1 17.8 44.0 41 54 A Q H < S+ 0 0 76 -4,-1.2 4,-0.5 -3,-0.5 -1,-0.2 0.806 118.8 35.6 -69.3 -31.2 14.9 18.2 46.1 42 55 A I H >X S+ 0 0 4 -4,-1.1 4,-2.0 -3,-0.2 3,-0.7 0.908 115.4 51.3 -89.0 -49.3 13.2 20.2 43.3 43 56 A L H 3< S+ 0 0 0 -4,-3.4 -3,-0.2 1,-0.2 -2,-0.2 0.755 96.4 72.6 -64.5 -26.5 14.6 18.6 40.2 44 57 A G T 3< S+ 0 0 30 -4,-1.4 -1,-0.2 -5,-0.3 -2,-0.1 0.934 114.9 21.3 -49.0 -52.6 13.6 15.1 41.5 45 58 A A T <4 S+ 0 0 53 -3,-0.7 -2,-0.2 -4,-0.5 -1,-0.2 0.723 135.7 37.8 -89.2 -26.0 9.9 15.8 40.8 46 59 A N >< + 0 0 21 -4,-2.0 3,-1.8 1,-0.1 -1,-0.2 -0.542 57.9 159.7-132.5 66.6 10.3 18.6 38.3 47 60 A P T 3 S+ 0 0 3 0, 0.0 -1,-0.1 0, 0.0 48,-0.1 0.605 71.0 71.3 -66.3 -11.2 13.3 17.9 36.0 48 61 A D T 3 + 0 0 65 1,-0.1 2,-2.0 -3,-0.1 3,-0.1 0.414 64.0 107.0 -86.1 2.7 11.9 20.3 33.3 49 62 A F X> - 0 0 14 -3,-1.8 3,-1.4 1,-0.2 4,-0.8 -0.580 53.9-177.1 -75.4 78.4 12.8 23.2 35.6 50 63 A A H >> + 0 0 44 -2,-2.0 4,-1.7 1,-0.3 3,-0.5 0.784 69.3 63.6 -56.3 -36.7 15.7 24.1 33.2 51 64 A T H 3> S+ 0 0 7 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.839 98.2 57.2 -61.5 -33.1 17.1 27.0 35.3 52 65 A L H <> S+ 0 0 0 -3,-1.4 4,-2.1 2,-0.2 -1,-0.2 0.857 102.4 52.4 -69.1 -33.7 17.9 24.6 38.1 53 66 A W H X S+ 0 0 64 -4,-2.3 4,-0.8 1,-0.2 3,-0.7 0.938 112.7 49.3 -61.9 -48.3 32.8 26.9 40.6 63 76 A L H 3X S+ 0 0 18 -4,-3.0 4,-2.7 1,-0.2 3,-0.3 0.800 99.5 67.3 -65.2 -30.9 33.7 24.0 42.8 64 77 A E H 3< S+ 0 0 94 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.894 105.0 43.3 -50.7 -44.5 36.0 22.6 40.1 65 78 A T H << S+ 0 0 117 -4,-1.0 -1,-0.2 -3,-0.7 -2,-0.2 0.721 120.8 41.1 -77.2 -21.6 38.3 25.5 40.7 66 79 A E H < S+ 0 0 135 -4,-0.8 2,-0.2 -3,-0.3 -2,-0.2 0.676 105.5 65.6-103.8 -23.7 38.1 25.4 44.5 67 80 A K S < S- 0 0 87 -4,-2.7 0, 0.0 1,-0.1 0, 0.0 -0.626 85.5 -97.3-103.8 162.3 38.2 21.6 45.2 68 81 A S > - 0 0 51 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.209 42.5 -98.0 -69.2 162.4 40.9 19.0 44.8 69 82 A P H > S+ 0 0 101 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.891 123.5 40.3 -43.9 -50.3 41.1 16.7 41.8 70 83 A E H > S+ 0 0 140 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.712 110.3 55.4 -87.0 -21.0 39.5 13.8 43.7 71 84 A E H > S+ 0 0 91 2,-0.2 4,-1.7 -3,-0.2 -1,-0.2 0.882 111.9 48.1 -64.4 -41.0 36.9 15.9 45.5 72 85 A S H X S+ 0 0 11 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.911 109.9 50.4 -64.1 -44.0 36.0 17.0 42.0 73 86 A A H X S+ 0 0 30 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.852 109.7 51.8 -62.0 -35.5 35.9 13.4 40.7 74 87 A A H X S+ 0 0 61 -4,-1.6 4,-1.9 1,-0.2 -1,-0.2 0.871 107.0 53.3 -67.2 -37.5 33.6 12.5 43.7 75 88 A L H X S+ 0 0 42 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.873 108.4 49.3 -66.9 -38.1 31.3 15.3 42.7 76 89 A V H X S+ 0 0 27 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.908 109.7 50.6 -70.2 -40.3 31.0 14.1 39.1 77 90 A K H X S+ 0 0 155 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.884 110.5 50.0 -65.1 -36.1 30.2 10.5 40.2 78 91 A A H X S+ 0 0 64 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.905 109.3 52.6 -65.2 -40.4 27.5 11.8 42.6 79 92 A E H X S+ 0 0 3 -4,-1.8 4,-2.7 1,-0.2 -2,-0.2 0.866 105.8 53.4 -62.9 -40.1 26.1 13.8 39.7 80 93 A L H X S+ 0 0 16 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.892 111.0 46.4 -61.7 -40.5 25.9 10.7 37.5 81 94 A G H X S+ 0 0 40 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.890 111.8 50.5 -69.5 -40.2 24.0 8.9 40.1 82 95 A F H X S+ 0 0 30 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.944 110.7 50.1 -62.1 -47.8 21.7 11.8 40.6 83 96 A L H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.903 109.6 49.8 -58.2 -45.3 21.0 12.1 36.9 84 97 A E H X S+ 0 0 40 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.905 110.0 50.6 -63.4 -38.8 20.2 8.4 36.6 85 98 A S H X S+ 0 0 45 -4,-2.1 4,-1.2 1,-0.2 -2,-0.2 0.906 111.4 49.9 -63.8 -39.8 17.8 8.6 39.5 86 99 A C H X S+ 0 0 2 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.887 108.9 51.3 -63.7 -41.7 16.1 11.6 37.7 87 100 A L H < S+ 0 0 0 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.831 102.6 60.6 -66.2 -35.4 15.9 9.7 34.4 88 101 A R H < S+ 0 0 156 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.889 110.3 40.9 -56.3 -42.9 14.2 6.7 36.1 89 102 A V H < S+ 0 0 87 -4,-1.2 -2,-0.2 1,-0.3 -1,-0.2 0.925 137.1 12.4 -75.6 -45.6 11.3 9.0 37.2 90 103 A N >< + 0 0 73 -4,-2.2 3,-1.1 1,-0.1 -1,-0.3 -0.782 63.5 178.1-132.7 90.2 11.0 10.9 33.9 91 104 A P T 3 S+ 0 0 40 0, 0.0 41,-0.1 0, 0.0 40,-0.1 0.397 77.5 59.2 -74.6 8.6 13.0 9.4 31.1 92 105 A K T 3 + 0 0 113 39,-0.1 2,-0.5 38,-0.1 -5,-0.1 0.260 66.8 124.6-119.4 13.7 11.8 12.1 28.6 93 106 A S <> - 0 0 2 -3,-1.1 4,-1.8 1,-0.2 5,-0.2 -0.605 48.5-154.2 -77.5 121.6 13.1 15.4 30.2 94 107 A Y H > S+ 0 0 67 -2,-0.5 4,-2.3 1,-0.2 -1,-0.2 0.882 93.8 54.5 -58.7 -39.1 15.3 17.3 27.7 95 108 A G H > S+ 0 0 18 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.863 105.7 50.6 -67.2 -39.9 17.1 19.0 30.5 96 109 A T H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.947 112.5 45.1 -65.3 -50.2 18.1 15.8 32.3 97 110 A W H X S+ 0 0 12 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.884 114.3 50.2 -62.6 -39.8 19.5 14.2 29.1 98 111 A H H X S+ 0 0 27 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.889 106.2 54.0 -66.0 -39.6 21.4 17.4 28.2 99 112 A H H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.899 108.3 51.6 -60.1 -39.2 22.9 17.8 31.7 100 113 A R H X S+ 0 0 5 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.936 110.7 46.9 -63.7 -45.8 24.2 14.3 31.3 101 114 A C H X S+ 0 0 16 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.895 112.1 51.0 -57.8 -45.4 25.8 15.1 27.9 102 115 A W H X S+ 0 0 31 -4,-2.8 4,-1.0 2,-0.2 -2,-0.2 0.923 112.7 47.1 -58.4 -45.7 27.3 18.4 29.3 103 116 A L H >X S+ 0 0 0 -4,-2.5 3,-0.8 -5,-0.2 4,-0.6 0.953 114.3 43.6 -61.6 -54.1 28.8 16.4 32.2 104 117 A L H >< S+ 0 0 1 -4,-2.6 3,-0.9 1,-0.2 -1,-0.2 0.832 108.2 59.3 -65.5 -35.2 30.3 13.6 30.2 105 118 A S H 3< S+ 0 0 65 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.771 103.2 54.1 -63.2 -28.7 31.7 15.9 27.5 106 119 A R H << S+ 0 0 74 -4,-1.0 -1,-0.2 -3,-0.8 -2,-0.2 0.662 89.1 94.6 -75.8 -20.6 33.7 17.7 30.2 107 120 A L << - 0 0 31 -3,-0.9 -3,-0.0 -4,-0.6 -4,-0.0 -0.572 66.5-146.1 -89.7 141.6 35.4 14.5 31.5 108 121 A P S S+ 0 0 131 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.187 93.9 14.6-124.6 21.8 38.8 13.6 30.1 109 122 A E S S+ 0 0 174 -5,-0.1 2,-0.2 0, 0.0 -3,-0.0 -0.433 81.2 175.0-121.6 138.4 38.3 10.3 30.2 110 123 A P - 0 0 30 0, 0.0 2,-1.1 0, 0.0 -6,-0.0 -0.690 40.2-108.8 -95.2 161.5 34.7 9.2 30.7 111 124 A N > + 0 0 84 -2,-0.2 4,-1.1 1,-0.2 3,-0.2 -0.729 39.8 173.7 -90.9 89.4 33.5 5.5 30.6 112 125 A W H > S+ 0 0 34 -2,-1.1 4,-2.0 1,-0.2 5,-0.2 0.831 72.6 61.9 -68.9 -34.4 31.6 5.4 27.3 113 126 A A H > S+ 0 0 71 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.914 103.9 51.3 -57.8 -42.7 30.9 1.6 27.4 114 127 A R H > S+ 0 0 92 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.848 108.1 52.1 -59.7 -39.3 28.9 2.1 30.6 115 128 A E H X S+ 0 0 0 -4,-1.1 4,-1.9 2,-0.2 -1,-0.2 0.844 106.0 53.2 -68.2 -35.1 26.9 4.9 28.9 116 129 A L H X S+ 0 0 30 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.830 109.1 50.9 -68.3 -30.4 26.1 2.6 26.0 117 130 A E H X S+ 0 0 106 -4,-1.4 4,-2.5 2,-0.2 -2,-0.2 0.879 105.0 54.4 -72.7 -42.7 24.8 0.1 28.5 118 131 A L H X S+ 0 0 2 -4,-2.0 4,-2.1 2,-0.2 5,-0.2 0.912 110.0 49.6 -52.3 -44.8 22.6 2.7 30.2 119 132 A C H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.941 107.9 51.5 -60.7 -49.4 21.2 3.3 26.7 120 133 A A H X S+ 0 0 27 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.909 111.4 49.9 -52.5 -44.5 20.5 -0.4 26.2 121 134 A R H X S+ 0 0 92 -4,-2.5 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-1,-0.2 0.919 107.3 45.8 -58.5 -41.7 15.9 11.1 23.9 132 145 A C H > S+ 0 0 0 -3,-0.3 4,-2.8 2,-0.2 -2,-0.2 0.898 111.3 50.0 -73.4 -40.7 17.6 7.9 24.6 133 146 A W H X S+ 0 0 5 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.917 111.5 50.4 -59.8 -42.4 18.3 7.1 20.9 134 147 A D H X S+ 0 0 10 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.908 111.8 47.8 -61.6 -41.8 19.7 10.7 20.6 135 148 A Y H X S+ 0 0 3 -4,-2.2 4,-2.8 2,-0.2 5,-0.2 0.909 108.4 54.7 -66.2 -40.2 21.9 10.1 23.6 136 149 A R H X S+ 0 0 14 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.906 108.1 48.5 -59.5 -42.8 23.1 6.7 22.2 137 150 A R H X S+ 0 0 35 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.861 110.7 52.5 -65.3 -36.8 24.2 8.4 19.0 138 151 A F H X S+ 0 0 40 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.965 112.6 43.5 -57.8 -55.1 26.0 11.0 21.1 139 152 A V H X S+ 0 0 0 -4,-2.8 4,-2.9 1,-0.2 5,-0.2 0.909 111.9 54.5 -57.9 -45.3 27.9 8.3 23.1 140 153 A A H <>S+ 0 0 8 -4,-2.7 5,-3.0 -5,-0.2 4,-0.4 0.903 111.1 44.6 -57.8 -44.2 28.6 6.3 19.9 141 154 A A H <5S+ 0 0 78 -4,-2.0 3,-0.4 3,-0.2 -1,-0.2 0.889 113.9 49.6 -67.6 -40.9 30.2 9.4 18.3 142 155 A Q H <5S+ 0 0 93 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.911 117.5 40.2 -64.3 -42.8 32.2 10.3 21.4 143 156 A A T <5S- 0 0 40 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.455 110.0-125.0 -84.2 -3.5 33.5 6.7 21.8 144 157 A A T 5 - 0 0 83 -3,-0.4 2,-0.3 -4,-0.4 -3,-0.2 0.900 38.7-176.0 56.2 44.9 34.0 6.4 18.0 145 158 A V < - 0 0 42 -5,-3.0 -1,-0.2 -6,-0.2 -2,-0.0 -0.574 26.4-118.2 -68.8 131.2 31.8 3.3 17.8 146 159 A A >> - 0 0 51 -2,-0.3 4,-1.5 1,-0.1 3,-0.9 -0.445 16.0-117.4 -75.3 145.9 31.9 2.1 14.2 147 160 A P H 3> S+ 0 0 35 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.809 112.6 61.6 -47.7 -38.7 28.7 1.9 12.1 148 161 A A H 3> S+ 0 0 47 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.904 103.0 49.8 -60.6 -41.9 29.0 -1.9 11.8 149 162 A E H <> S+ 0 0 127 -3,-0.9 4,-1.9 2,-0.2 -1,-0.2 0.921 112.4 46.3 -62.5 -45.0 28.7 -2.3 15.6 150 163 A E H X S+ 0 0 7 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.868 108.9 56.5 -66.4 -34.0 25.6 -0.1 15.8 151 164 A L H X S+ 0 0 27 -4,-2.6 4,-2.0 -5,-0.2 -2,-0.2 0.935 105.6 50.8 -62.1 -42.8 24.2 -2.0 12.8 152 165 A A H X S+ 0 0 50 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.889 106.8 55.0 -60.6 -39.5 24.6 -5.2 14.8 153 166 A F H X S+ 0 0 35 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.936 107.9 48.9 -56.5 -48.3 22.8 -3.6 17.8 154 167 A T H X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 5,-0.2 0.867 106.4 56.9 -61.3 -39.3 19.8 -2.8 15.5 155 168 A D H X S+ 0 0 59 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.955 107.8 47.1 -54.3 -54.9 19.7 -6.4 14.2 156 169 A S H X S+ 0 0 26 -4,-1.9 4,-2.7 1,-0.2 -2,-0.2 0.925 113.4 49.3 -54.1 -49.7 19.3 -7.8 17.7 157 170 A L H X S+ 0 0 32 -4,-2.0 4,-1.4 1,-0.2 -2,-0.2 0.955 108.6 49.5 -54.7 -58.5 16.6 -5.2 18.5 158 171 A I H < S+ 0 0 25 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.795 115.2 49.1 -56.6 -29.3 14.4 -5.8 15.4 159 172 A T H < S+ 0 0 114 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.960 100.2 61.0 -70.5 -56.5 14.7 -9.5 16.2 160 173 A R H < S- 0 0 180 -4,-2.7 2,-0.3 -5,-0.1 -2,-0.2 0.839 122.6 -45.2 -40.2 -49.1 13.7 -9.5 20.0 161 174 A N < - 0 0 88 -4,-1.4 -1,-0.1 1,-0.0 3,-0.1 -0.933 65.3 -75.9-168.3 178.1 10.3 -8.0 19.3 162 175 A F S S+ 0 0 36 -2,-0.3 -1,-0.0 1,-0.1 -3,-0.0 -0.139 75.6 97.3 -77.8-174.7 8.3 -5.4 17.3 163 176 A S + 0 0 58 -2,-0.0 -1,-0.1 -35,-0.0 -36,-0.1 0.892 53.7 143.4 85.9 50.4 8.2 -1.7 18.2 164 177 A N > + 0 0 10 2,-0.1 4,-2.4 -36,-0.1 5,-0.3 -0.229 16.3 105.9 159.9 -46.0 10.6 -1.0 15.9 165 178 A Y H > S+ 0 0 2 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.891 89.6 53.7 -58.1 -41.9 10.3 2.3 13.9 166 179 A S H > S+ 0 0 2 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.895 110.2 47.2 -62.9 -35.9 13.2 3.8 15.9 167 180 A S H > S+ 0 0 5 -3,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.903 112.3 47.7 -75.7 -39.3 15.4 0.8 15.1 168 181 A W H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.892 110.1 54.6 -63.1 -38.7 14.6 0.8 11.4 169 182 A H H X S+ 0 0 0 -4,-2.5 4,-1.1 -5,-0.3 -2,-0.2 0.949 107.1 49.8 -60.3 -45.3 15.2 4.6 11.3 170 183 A Y H >X S+ 0 0 9 -4,-1.9 4,-2.1 1,-0.2 3,-1.0 0.931 108.7 52.4 -59.0 -46.0 18.6 4.1 12.8 171 184 A R H 3X S+ 0 0 9 -4,-2.1 4,-2.7 1,-0.3 -1,-0.2 0.878 102.6 60.1 -53.6 -39.9 19.4 1.4 10.2 172 185 A S H 3< S+ 0 0 7 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.793 111.3 39.4 -62.7 -29.0 18.4 3.9 7.5 173 186 A C H << S+ 0 0 34 -4,-1.1 4,-0.5 -3,-1.0 -1,-0.2 0.770 116.0 50.4 -88.4 -32.6 21.2 6.2 8.7 174 187 A L H >X S+ 0 0 3 -4,-2.1 4,-1.6 -5,-0.2 3,-0.9 0.895 101.1 61.2 -72.0 -43.2 23.8 3.6 9.4 175 188 A L H 3X S+ 0 0 4 -4,-2.7 4,-1.3 1,-0.3 3,-0.2 0.888 102.0 49.7 -58.8 -47.8 23.6 1.8 6.0 176 189 A P H 34 S+ 0 0 49 0, 0.0 -1,-0.3 0, 0.0 -2,-0.2 0.750 108.3 57.0 -60.9 -23.7 24.7 4.7 3.9 177 190 A Q H <4 S+ 0 0 108 -3,-0.9 -2,-0.2 -4,-0.5 -3,-0.1 0.866 106.8 47.0 -71.7 -39.2 27.7 5.2 6.3 178 191 A L H < S+ 0 0 60 -4,-1.6 -1,-0.2 1,-0.3 -3,-0.1 0.736 124.4 34.1 -71.6 -23.8 28.9 1.7 5.6 179 192 A H S < S- 0 0 63 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.1 -0.613 94.5-171.6-130.5 68.3 28.5 2.2 1.9 180 193 A P + 0 0 103 0, 0.0 -3,-0.1 0, 0.0 -2,-0.0 -0.093 11.1 170.3 -80.7 168.8 29.3 5.9 1.5 181 194 A Q 0 0 132 -5,-0.1 -2,-0.0 3,-0.0 0, 0.0 -0.976 360.0 360.0-170.7 146.1 29.0 8.2 -1.5 182 195 A P 0 0 178 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.082 360.0 360.0 -34.9 360.0 29.2 11.9 -2.6 183 ! 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 0.0 184 202 A R 0 0 67 0, 0.0 37,-0.2 0, 0.0 36,-0.1 0.000 360.0 360.0 360.0 142.8 21.2 5.0 -3.0 185 203 A L - 0 0 4 35,-2.0 37,-0.4 32,-0.1 -10,-0.0 -0.946 360.0 -97.5-119.4 149.9 22.4 1.7 -1.6 186 204 A P > - 0 0 50 0, 0.0 4,-2.7 0, 0.0 3,-0.3 -0.348 39.0-115.9 -60.1 148.2 24.6 -0.8 -3.5 187 205 A E H > S+ 0 0 47 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.869 113.4 54.9 -61.8 -39.4 22.4 -3.6 -4.9 188 206 A N H > S+ 0 0 107 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.908 113.4 43.5 -58.5 -41.5 23.9 -6.4 -2.8 189 207 A V H > S+ 0 0 8 -3,-0.3 4,-2.2 2,-0.2 -2,-0.2 0.929 113.4 51.0 -65.8 -50.5 23.1 -4.3 0.3 190 208 A L H X S+ 0 0 1 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.910 108.7 51.4 -55.5 -46.1 19.7 -3.4 -0.9 191 209 A L H X S+ 0 0 23 -4,-3.2 4,-1.8 1,-0.2 -1,-0.2 0.912 109.3 50.2 -59.7 -44.2 18.8 -7.0 -1.7 192 210 A K H X S+ 0 0 149 -4,-1.7 4,-1.9 -5,-0.2 -1,-0.2 0.879 111.7 49.2 -59.8 -40.0 19.8 -8.1 1.8 193 211 A E H X S+ 0 0 7 -4,-2.2 4,-2.8 2,-0.2 5,-0.3 0.881 107.3 53.7 -67.5 -41.2 17.7 -5.3 3.3 194 212 A L H X S+ 0 0 2 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.865 108.8 50.1 -60.9 -37.3 14.6 -6.3 1.2 195 213 A E H X S+ 0 0 114 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.925 112.0 47.6 -65.5 -45.4 15.0 -9.8 2.6 196 214 A L H X S+ 0 0 50 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.927 116.3 42.1 -61.9 -47.8 15.1 -8.6 6.2 197 215 A V H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 5,-0.3 0.901 111.2 55.4 -69.2 -38.7 12.2 -6.2 5.9 198 216 A Q H X S+ 0 0 40 -4,-2.3 4,-1.6 -5,-0.3 5,-0.2 0.919 107.0 52.0 -60.3 -44.4 10.1 -8.8 3.9 199 217 A N H X S+ 0 0 78 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.937 110.1 50.4 -48.3 -53.8 10.6 -11.2 6.8 200 218 A A H X S+ 0 0 15 -4,-1.8 4,-2.7 1,-0.2 -2,-0.2 0.941 111.7 42.5 -56.6 -56.5 9.4 -8.6 9.2 201 219 A F H < S+ 0 0 0 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.691 116.8 48.1 -77.0 -13.5 6.1 -7.6 7.5 202 220 A F H < S+ 0 0 57 -4,-1.6 -1,-0.2 -5,-0.3 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30.3 395 87 B A S S- 0 0 2 5,-0.5 -40,-1.3 -43,-0.2 2,-0.3 0.775 95.1 -7.5 -69.3 -27.5 10.2 32.1 31.0 396 88 B S S > S- 0 0 11 -42,-0.2 3,-2.0 -10,-0.1 -1,-0.2 -0.964 95.4 -62.5-162.6 167.2 9.7 34.0 34.2 397 89 B I T 3 S+ 0 0 97 -2,-0.3 -11,-0.1 1,-0.3 3,-0.1 -0.396 121.9 15.4 -63.9 129.4 11.4 36.5 36.6 398 90 B G T 3 S+ 0 0 38 1,-0.4 -1,-0.3 -2,-0.1 2,-0.1 0.285 102.9 111.7 88.8 -11.1 14.6 35.0 38.0 399 91 B H S < S- 0 0 2 -3,-2.0 -1,-0.4 1,-0.1 -5,-0.2 -0.450 74.5 -94.4 -88.8 169.6 14.7 32.2 35.5 400 92 B D - 0 0 26 -2,-0.1 -5,-0.5 1,-0.1 -4,-0.1 -0.559 38.8-101.3 -92.0 149.0 17.4 32.0 32.8 401 93 B P B +B 394 0B 23 0, 0.0 2,-0.3 0, 0.0 -7,-0.3 -0.278 45.6 169.8 -64.6 149.0 17.1 33.3 29.2 402 94 B H > - 0 0 17 -9,-2.1 4,-1.9 42,-0.1 -9,-0.4 -0.977 46.1-116.1-159.0 149.8 16.3 30.9 26.4 403 95 B L H > S+ 0 0 0 40,-2.6 4,-2.3 -2,-0.3 5,-0.2 0.822 111.5 61.6 -56.4 -36.0 15.4 30.9 22.7 404 96 B L H > S+ 0 0 43 1,-0.2 4,-1.9 39,-0.2 -1,-0.2 0.919 111.3 36.8 -56.0 -46.9 12.0 29.3 23.5 405 97 B Y H > S+ 0 0 30 -3,-0.4 4,-2.3 -12,-0.3 -1,-0.2 0.716 110.7 61.2 -86.7 -22.0 10.9 32.1 25.7 406 98 B T H X S+ 0 0 0 -4,-1.9 4,-2.0 -13,-0.3 -2,-0.2 0.926 108.7 44.2 -63.7 -47.6 12.5 34.7 23.5 407 99 B L H X S+ 0 0 10 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.955 113.2 50.4 -58.2 -52.3 10.2 33.6 20.7 408 100 B S H X S+ 0 0 6 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.904 111.0 49.6 -55.7 -43.6 7.2 33.4 22.9 409 101 B A H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.909 111.6 47.9 -60.6 -44.2 7.8 37.0 24.2 410 102 B V H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.874 110.4 52.1 -68.9 -36.7 8.2 38.3 20.6 411 103 B Q H X S+ 0 0 6 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.929 110.5 48.8 -60.8 -45.6 5.0 36.6 19.5 412 104 B I H X S+ 0 0 0 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.940 111.4 48.3 -59.4 -50.1 3.2 38.2 22.4 413 105 B L H <>S+ 0 0 0 -4,-2.6 5,-3.0 1,-0.2 4,-0.4 0.827 110.1 53.2 -62.8 -32.0 4.5 41.7 21.7 414 106 B T H ><5S+ 0 0 3 -4,-2.0 3,-0.8 3,-0.2 -1,-0.2 0.907 107.1 50.7 -67.4 -43.2 3.6 41.2 18.0 415 107 B L H 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121 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.896 109.1 47.8 -56.1 -41.7 18.7 45.0 18.9 426 118 B K H > S+ 0 0 87 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.856 108.2 53.5 -73.3 -37.5 19.8 42.9 21.9 427 119 B V H X S+ 0 0 0 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.920 110.3 48.7 -57.2 -46.6 17.3 40.2 21.1 428 120 B V H X S+ 0 0 16 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.922 111.2 49.4 -60.2 -44.4 18.8 40.0 17.6 429 121 B A H X S+ 0 0 50 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.903 110.3 51.6 -62.1 -42.1 22.3 39.9 19.1 430 122 B Y H X S+ 0 0 9 -4,-2.5 4,-0.7 2,-0.2 -2,-0.2 0.950 112.2 44.6 -59.3 -51.4 21.3 37.1 21.4 431 123 B V H >< S+ 0 0 0 -4,-2.4 3,-1.7 1,-0.2 4,-0.5 0.959 112.1 52.6 -58.4 -51.5 19.8 34.9 18.7 432 124 B Q H >< S+ 0 0 103 -4,-2.7 3,-1.1 1,-0.3 -1,-0.2 0.861 105.4 56.8 -49.4 -40.4 22.8 35.6 16.4 433 125 B S H 3< S+ 0 0 79 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.634 98.4 60.5 -71.2 -18.4 25.2 34.4 19.2 434 126 B L T << S+ 0 0 4 -3,-1.7 8,-2.3 -4,-0.7 -1,-0.2 0.530 78.5 106.2 -90.2 -6.8 23.5 31.0 19.6 435 127 B Q B < -C 441 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-2,-0.3 -1,-0.1 -79,-0.1 -80,-0.0 -0.425 360.0 360.0 -62.7 360.0 0.7 25.6 -3.7