==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-SEP-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 27-AUG-10 2XPP . COMPND 2 MOLECULE: IWS1; . SOURCE 2 ORGANISM_SCIENTIFIC: ENCEPHALITOZOON CUNICULI; . AUTHOR M.-L.DIEBOLD,M.KOCH,V.CURA,J.CAVARELLI,C.ROMIER . 161 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8889.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 119 73.9 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 . 1 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 . 2 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 93 57.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.2 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 1 1 0 1 1 0 2 1 0 0 0 0 1 0 0 0 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 . 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 57 A G > 0 0 79 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0-158.1 17.7 -19.0 18.4 2 58 A T H > + 0 0 98 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.895 360.0 53.0 -70.5 -41.2 14.4 -17.7 17.0 3 59 A V H > S+ 0 0 64 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.925 113.1 45.6 -66.3 -36.6 13.8 -14.5 19.0 4 60 A L H > S+ 0 0 51 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.915 111.8 51.9 -66.6 -38.1 17.3 -13.2 18.1 5 61 A E H X S+ 0 0 126 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.911 111.2 48.2 -63.9 -42.6 16.9 -14.2 14.4 6 62 A I H X S+ 0 0 79 -4,-2.8 4,-2.3 2,-0.2 -1,-0.2 0.942 113.6 46.0 -62.0 -45.0 13.6 -12.3 14.3 7 63 A S H X S+ 0 0 0 -4,-2.2 4,-2.6 -5,-0.2 -2,-0.2 0.924 112.5 49.8 -68.5 -41.7 15.0 -9.2 15.9 8 64 A R H X S+ 0 0 127 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.896 110.5 51.6 -63.2 -40.0 18.1 -9.2 13.7 9 65 A S H X S+ 0 0 82 -4,-2.4 4,-2.4 -5,-0.2 -2,-0.2 0.919 111.0 46.4 -59.0 -47.5 15.8 -9.6 10.6 10 66 A L H X S+ 0 0 8 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.925 111.2 53.2 -61.9 -42.5 13.7 -6.6 11.7 11 67 A K H X S+ 0 0 34 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.935 110.7 46.5 -57.1 -48.9 16.9 -4.6 12.4 12 68 A K H X S+ 0 0 117 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.883 110.3 53.6 -64.4 -37.4 18.2 -5.3 8.9 13 69 A R H X S+ 0 0 71 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.932 110.3 46.3 -61.8 -43.9 14.8 -4.4 7.3 14 70 A M H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.903 113.1 50.7 -66.8 -39.1 14.8 -1.0 9.1 15 71 A Q H X S+ 0 0 57 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.892 110.0 49.0 -61.8 -45.8 18.4 -0.4 8.0 16 72 A D H X S+ 0 0 59 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.906 111.7 48.5 -64.9 -41.4 17.7 -1.2 4.4 17 73 A I H X S+ 0 0 19 -4,-2.3 4,-2.3 1,-0.2 17,-0.2 0.916 112.6 48.6 -65.1 -43.2 14.6 1.1 4.3 18 74 A L H X S+ 0 0 29 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.944 111.9 48.4 -62.2 -49.5 16.6 3.9 5.9 19 75 A K H X S+ 0 0 141 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.881 113.3 47.9 -58.6 -41.2 19.6 3.6 3.5 20 76 A K H X S+ 0 0 131 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.877 112.7 47.5 -68.6 -38.5 17.3 3.4 0.4 21 77 A D H X S+ 0 0 4 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.927 113.7 48.3 -71.9 -40.7 15.2 6.5 1.5 22 78 A N H X S+ 0 0 46 -4,-2.8 4,-2.0 -5,-0.2 -2,-0.2 0.915 112.6 47.4 -65.5 -42.0 18.4 8.4 2.2 23 79 A A H X S+ 0 0 53 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.877 112.8 50.2 -61.2 -41.9 20.0 7.5 -1.1 24 80 A N H X>S+ 0 0 34 -4,-2.3 5,-2.0 2,-0.2 4,-1.9 0.880 106.7 54.5 -68.3 -37.9 16.8 8.4 -2.9 25 81 A N H <5S+ 0 0 32 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.940 110.9 46.0 -60.4 -39.9 16.6 11.8 -1.1 26 82 A L H <5S+ 0 0 133 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.862 116.3 45.6 -68.1 -35.0 20.2 12.5 -2.4 27 83 A E H <5S- 0 0 148 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.726 111.9-116.5 -79.3 -24.7 19.3 11.4 -5.9 28 84 A G T <5S+ 0 0 71 -4,-1.9 -3,-0.2 1,-0.3 -4,-0.1 0.727 72.3 127.0 85.7 24.4 15.9 13.2 -6.1 29 85 A R S + 0 0 56 -2,-0.4 4,-2.2 1,-0.2 5,-0.2 0.240 33.2 102.5-107.2 8.2 8.7 6.6 0.5 33 89 A G H > S+ 0 0 15 -16,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.915 84.0 46.6 -62.7 -43.1 10.1 3.5 2.2 34 90 A K H >> S+ 0 0 7 -17,-0.2 4,-1.9 1,-0.2 3,-0.7 0.946 115.1 45.3 -65.1 -48.1 9.7 4.7 5.7 35 91 A I H 34 S+ 0 0 43 -4,-0.3 4,-0.4 1,-0.2 -1,-0.2 0.871 112.3 51.1 -65.5 -34.7 6.1 5.9 5.2 36 92 A E H 3< S+ 0 0 144 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.682 123.4 30.1 -74.4 -17.6 5.1 2.7 3.3 37 93 A N H S+ 0 0 125 -4,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.960 116.0 40.9 -65.5 -46.0 2.7 1.0 10.4 40 96 A E H > S+ 0 0 103 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.934 118.7 44.4 -64.1 -51.1 3.8 -2.6 9.9 41 97 A I H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.891 111.6 53.5 -63.5 -42.1 7.2 -2.2 11.4 42 98 A S H X S+ 0 0 0 -4,-2.7 4,-1.0 -5,-0.3 -1,-0.2 0.885 104.9 55.3 -62.5 -38.0 5.9 -0.2 14.4 43 99 A D H < S+ 0 0 104 -4,-1.9 3,-0.5 -5,-0.2 -1,-0.2 0.920 111.2 44.8 -58.2 -44.2 3.4 -2.9 15.2 44 100 A I H >< S+ 0 0 52 -4,-1.7 3,-2.1 1,-0.2 -2,-0.2 0.905 107.1 57.8 -66.0 -42.3 6.2 -5.4 15.4 45 101 A L H 3< S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.695 100.5 61.0 -61.2 -19.4 8.4 -3.1 17.4 46 102 A M T 3< S+ 0 0 40 -4,-1.0 -1,-0.3 -3,-0.5 2,-0.2 0.484 73.9 122.1 -82.8 -9.3 5.6 -3.0 20.0 47 103 A S <> - 0 0 40 -3,-2.1 4,-0.9 1,-0.2 -3,-0.0 -0.403 51.4-156.9 -61.0 121.4 5.8 -6.8 20.6 48 104 A K T 4 S+ 0 0 137 -2,-0.2 4,-0.5 1,-0.2 3,-0.3 0.861 94.0 54.9 -66.9 -30.8 6.4 -7.4 24.3 49 105 A A T 4 S+ 0 0 90 1,-0.2 4,-0.3 2,-0.1 -1,-0.2 0.834 114.2 40.2 -73.0 -31.0 7.9 -10.8 23.6 50 106 A L T > S+ 0 0 20 -6,-0.2 4,-2.8 1,-0.1 -1,-0.2 0.592 92.4 93.9 -86.2 -13.0 10.4 -9.3 21.1 51 107 A Q H X S+ 0 0 7 -4,-0.9 4,-2.5 -3,-0.3 5,-0.2 0.864 83.8 42.7 -58.8 -50.4 11.2 -6.2 23.2 52 108 A E H > S+ 0 0 94 -4,-0.5 4,-2.6 2,-0.2 -1,-0.2 0.886 115.8 49.6 -64.6 -40.1 14.2 -7.3 25.1 53 109 A S H > S+ 0 0 16 -4,-0.3 4,-2.0 2,-0.2 -2,-0.2 0.909 110.9 50.8 -62.9 -43.0 15.9 -9.0 22.1 54 110 A L H <>S+ 0 0 1 -4,-2.8 5,-2.5 2,-0.2 6,-0.2 0.929 113.1 44.6 -59.7 -44.4 15.2 -5.9 20.0 55 111 A L H ><5S+ 0 0 9 -4,-2.5 3,-1.7 1,-0.2 5,-0.3 0.929 113.2 51.5 -67.7 -42.4 16.8 -3.6 22.7 56 112 A D H 3<5S+ 0 0 111 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.803 107.4 53.7 -62.0 -33.6 19.7 -6.1 23.1 57 113 A E T 3<5S- 0 0 52 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.309 121.3-107.4 -87.6 8.3 20.3 -6.1 19.3 58 114 A G T X>5 + 0 0 20 -3,-1.7 3,-2.2 -5,-0.1 4,-0.6 0.760 61.3 156.7 78.8 30.2 20.5 -2.2 19.2 59 115 A I H 3>< + 0 0 2 -5,-2.5 4,-2.5 1,-0.3 3,-0.3 0.737 65.5 73.3 -63.4 -21.7 17.2 -1.5 17.6 60 116 A L H 3> S+ 0 0 5 -5,-0.3 4,-2.7 1,-0.2 -1,-0.3 0.812 89.1 61.1 -60.7 -27.9 17.3 2.0 19.2 61 117 A D H <> S+ 0 0 70 -3,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.902 108.2 41.8 -61.0 -43.9 20.0 2.8 16.5 62 118 A E H X S+ 0 0 15 -4,-0.6 4,-2.5 -3,-0.3 -2,-0.2 0.885 113.6 51.8 -74.1 -38.7 17.5 2.1 13.7 63 119 A I H X S+ 0 0 0 -4,-2.5 4,-1.4 2,-0.2 -2,-0.2 0.955 111.2 48.6 -60.7 -47.9 14.7 3.9 15.5 64 120 A K H >X S+ 0 0 42 -4,-2.7 4,-1.2 1,-0.2 3,-0.5 0.922 110.4 52.0 -52.2 -51.7 17.0 6.9 15.9 65 121 A G H 3< S+ 0 0 8 -4,-2.2 3,-0.3 1,-0.2 -1,-0.2 0.884 107.4 51.2 -53.9 -46.9 18.0 6.8 12.2 66 122 A W H 3< S+ 0 0 2 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.780 112.9 46.5 -62.7 -28.4 14.4 6.8 11.1 67 123 A L H << S+ 0 0 1 -4,-1.4 -1,-0.2 -3,-0.5 -2,-0.2 0.627 95.4 98.4 -86.5 -17.3 13.7 9.9 13.3 68 124 A E S < S- 0 0 60 -4,-1.2 -3,-0.0 -3,-0.3 90,-0.0 -0.254 86.0 -87.1 -70.9 157.9 16.8 11.8 12.1 69 125 A P - 0 0 12 0, 0.0 6,-0.2 0, 0.0 -1,-0.1 -0.301 43.8-110.8 -60.5 149.7 16.8 14.4 9.4 70 126 A L > - 0 0 14 4,-2.8 3,-2.5 -3,-0.1 -48,-0.1 -0.303 40.1 -93.2 -64.4 161.6 17.2 13.4 5.8 71 127 A P T 3 S+ 0 0 58 0, 0.0 -1,-0.1 0, 0.0 -49,-0.0 0.770 127.9 55.4 -50.8 -28.9 20.4 14.3 3.9 72 128 A D T 3 S- 0 0 85 2,-0.1 3,-0.1 1,-0.0 -2,-0.0 0.286 122.3-105.6 -91.1 13.6 18.8 17.5 2.6 73 129 A K S < S+ 0 0 122 -3,-2.5 -1,-0.0 1,-0.3 2,-0.0 0.280 79.3 132.1 80.2 -6.8 18.0 18.6 6.2 74 130 A S - 0 0 50 -5,-0.1 -4,-2.8 1,-0.1 -1,-0.3 -0.297 54.9-121.1 -71.1 159.7 14.3 17.9 5.8 75 131 A M - 0 0 40 -6,-0.2 3,-0.1 -3,-0.1 -7,-0.1 -0.760 29.9 -96.8 -99.8 154.0 12.4 15.9 8.5 76 132 A P - 0 0 4 0, 0.0 5,-0.2 0, 0.0 -1,-0.1 -0.226 59.9 -72.1 -62.1 155.1 10.6 12.6 8.0 77 133 A N >> - 0 0 88 1,-0.1 4,-1.6 3,-0.1 3,-1.2 -0.125 45.3-117.9 -47.3 137.9 6.9 12.6 7.5 78 134 A I H 3> S+ 0 0 60 1,-0.3 4,-3.0 2,-0.2 5,-0.3 0.753 112.9 65.8 -58.2 -24.7 5.0 13.5 10.7 79 135 A K H 3> S+ 0 0 70 2,-0.2 4,-2.3 1,-0.2 -1,-0.3 0.921 104.9 44.9 -64.9 -37.6 3.3 10.1 10.6 80 136 A I H <> S+ 0 0 4 -3,-1.2 4,-2.6 2,-0.2 5,-0.3 0.927 112.1 51.6 -64.7 -45.6 6.7 8.5 11.1 81 137 A R H X S+ 0 0 31 -4,-1.6 4,-1.7 1,-0.2 -2,-0.2 0.930 114.5 43.1 -57.5 -49.9 7.7 11.0 13.9 82 138 A K H X S+ 0 0 74 -4,-3.0 4,-2.2 2,-0.2 -1,-0.2 0.942 115.0 47.1 -64.7 -48.2 4.4 10.3 15.8 83 139 A R H X S+ 0 0 62 -4,-2.3 4,-2.1 -5,-0.3 -2,-0.2 0.902 112.5 47.8 -68.5 -40.2 4.4 6.6 15.5 84 140 A L H X S+ 0 0 1 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.835 110.3 51.9 -68.3 -34.9 8.1 6.0 16.4 85 141 A L H X S+ 0 0 6 -4,-1.7 4,-1.8 -5,-0.3 -1,-0.2 0.899 109.5 51.5 -67.2 -37.9 7.8 8.3 19.5 86 142 A D H X S+ 0 0 63 -4,-2.2 4,-0.8 2,-0.2 -2,-0.2 0.909 110.0 49.5 -59.8 -47.2 4.7 6.1 20.4 87 143 A V H >< S+ 0 0 0 -4,-2.1 3,-1.3 1,-0.2 4,-0.5 0.947 109.5 50.8 -52.0 -54.6 6.8 3.0 20.0 88 144 A L H >< S+ 0 0 0 -4,-2.4 3,-1.3 1,-0.3 5,-0.2 0.844 103.0 60.4 -55.8 -36.3 9.7 4.4 22.2 89 145 A K H 3< S+ 0 0 136 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.789 103.7 51.6 -63.9 -28.2 7.2 5.3 25.0 90 146 A T T << S+ 0 0 43 -3,-1.3 2,-0.3 -4,-0.8 -1,-0.3 0.541 92.0 95.5 -86.6 -10.7 6.2 1.6 25.3 91 147 A M S < S- 0 0 1 -3,-1.3 2,-1.9 -4,-0.5 -45,-0.0 -0.628 77.8-125.1 -92.3 142.4 9.8 0.3 25.7 92 148 A K + 0 0 146 -2,-0.3 2,-0.4 2,-0.0 -3,-0.1 -0.555 45.2 178.3 -83.4 79.8 11.6 -0.5 28.9 93 149 A I - 0 0 8 -2,-1.9 2,-0.2 -5,-0.2 41,-0.1 -0.689 3.9-176.6 -93.6 126.5 14.6 1.7 28.1 94 150 A H > - 0 0 83 -2,-0.4 4,-1.8 40,-0.0 3,-0.4 -0.639 42.8 -84.3-121.1 174.4 17.4 2.1 30.6 95 151 A K H > S+ 0 0 78 1,-0.2 4,-2.6 -2,-0.2 5,-0.2 0.845 123.2 50.6 -45.6 -49.2 20.6 4.0 30.9 96 152 A E H > S+ 0 0 114 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.894 108.7 51.7 -64.4 -39.4 22.8 1.6 28.9 97 153 A H H > S+ 0 0 29 -3,-0.4 4,-1.5 1,-0.2 6,-0.3 0.881 113.5 45.5 -60.0 -41.3 20.4 1.5 26.0 98 154 A L H X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 6,-0.3 0.907 111.6 50.1 -71.7 -42.4 20.4 5.3 25.8 99 155 A V H < S+ 0 0 51 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.956 115.2 42.8 -65.0 -45.6 24.1 5.8 26.2 100 156 A T H < S+ 0 0 112 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.830 122.3 36.9 -71.2 -33.3 25.0 3.3 23.4 101 157 A S H < S- 0 0 7 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.800 83.3-147.0 -87.5 -34.2 22.3 4.4 20.9 102 158 A G >X + 0 0 6 -4,-2.6 3,-1.8 -5,-0.2 4,-0.8 0.605 52.0 138.4 67.9 14.0 22.1 8.2 21.4 103 159 A V H 3> + 0 0 0 -6,-0.3 4,-2.2 1,-0.3 3,-0.3 0.820 61.3 68.3 -62.3 -28.4 18.4 8.1 20.6 104 160 A G H 3> S+ 0 0 0 -6,-0.3 4,-2.9 47,-0.2 -1,-0.3 0.810 92.1 61.0 -53.7 -31.7 17.9 10.6 23.4 105 161 A K H <> S+ 0 0 58 -3,-1.8 4,-1.8 46,-0.4 -1,-0.2 0.899 107.6 40.8 -69.6 -42.0 19.7 13.2 21.3 106 162 A I H X S+ 0 0 0 -4,-0.8 4,-2.2 -3,-0.3 -1,-0.2 0.905 116.3 49.8 -73.3 -37.4 17.2 13.1 18.4 107 163 A V H X S+ 0 0 0 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.915 109.0 53.3 -65.0 -39.2 14.2 12.9 20.9 108 164 A Y H X S+ 0 0 69 -4,-2.9 4,-0.8 1,-0.2 -1,-0.2 0.920 107.6 51.5 -58.2 -44.0 15.7 15.9 22.7 109 165 A F H >X S+ 0 0 7 -4,-1.8 4,-1.6 1,-0.2 3,-1.3 0.920 106.3 53.5 -61.0 -40.4 15.8 17.7 19.4 110 166 A Y H 3< S+ 0 0 0 -4,-2.2 -1,-0.2 1,-0.3 3,-0.2 0.877 104.5 56.9 -59.7 -37.2 12.2 16.9 18.8 111 167 A S H 3< S+ 0 0 4 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.664 119.1 29.9 -69.3 -17.5 11.3 18.4 22.2 112 168 A I H << S+ 0 0 65 -3,-1.3 -1,-0.2 -4,-0.8 -2,-0.2 0.465 84.3 121.1-120.5 -4.7 12.9 21.8 21.3 113 169 A N >< - 0 0 4 -4,-1.6 3,-1.6 -3,-0.2 8,-0.1 -0.468 48.9-156.0 -69.3 115.9 12.4 22.0 17.5 114 170 A P T 3 S+ 0 0 92 0, 0.0 -1,-0.2 0, 0.0 7,-0.0 0.805 92.9 56.8 -66.3 -25.9 10.4 25.2 16.7 115 171 A K T 3 S+ 0 0 178 2,-0.0 -2,-0.1 -3,-0.0 2,-0.0 0.588 88.1 103.8 -73.1 -13.5 9.2 23.8 13.4 116 172 A E S < S- 0 0 8 -3,-1.6 2,-0.1 1,-0.1 -6,-0.0 -0.325 82.9-100.0 -74.0 150.8 7.7 20.7 15.2 117 173 A S > - 0 0 39 1,-0.1 4,-2.8 -2,-0.0 5,-0.2 -0.431 30.9-119.4 -62.7 146.2 4.0 20.3 15.8 118 174 A K H > S+ 0 0 167 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.898 114.0 53.3 -52.9 -41.9 3.0 21.2 19.4 119 175 A E H > S+ 0 0 114 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.914 110.3 43.8 -61.4 -50.4 1.7 17.6 19.8 120 176 A V H > S+ 0 0 1 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.922 113.6 52.4 -63.3 -45.2 5.0 15.9 18.7 121 177 A R H X S+ 0 0 52 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.932 110.5 47.6 -54.4 -47.8 7.0 18.4 20.8 122 178 A A H X S+ 0 0 59 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.890 111.8 50.8 -61.5 -41.4 4.9 17.6 23.9 123 179 A S H X S+ 0 0 55 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.935 112.6 46.1 -59.9 -45.3 5.3 13.8 23.2 124 180 A A H X S+ 0 0 0 -4,-2.9 4,-2.7 1,-0.2 -2,-0.2 0.877 110.0 54.0 -64.7 -42.5 9.1 14.2 22.9 125 181 A K H X S+ 0 0 104 -4,-2.5 4,-2.7 -5,-0.2 -1,-0.2 0.918 109.0 48.8 -57.9 -44.7 9.2 16.3 26.1 126 182 A A H X S+ 0 0 62 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.897 111.0 49.6 -65.0 -37.4 7.4 13.6 28.0 127 183 A L H X S+ 0 0 7 -4,-1.8 4,-2.8 2,-0.2 5,-0.2 0.920 110.7 50.2 -67.6 -41.7 9.7 10.9 26.7 128 184 A V H X S+ 0 0 4 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.932 111.0 49.7 -60.2 -44.8 12.8 13.1 27.7 129 185 A Q H X S+ 0 0 124 -4,-2.7 4,-0.7 -5,-0.2 -1,-0.2 0.879 111.0 49.4 -64.8 -35.3 11.3 13.5 31.2 130 186 A K H >< S+ 0 0 88 -4,-2.2 3,-1.0 1,-0.2 4,-0.3 0.945 113.3 45.1 -64.0 -51.3 10.7 9.8 31.5 131 187 A W H >X S+ 0 0 2 -4,-2.8 3,-1.6 1,-0.2 4,-0.5 0.765 99.1 71.3 -66.8 -27.0 14.3 8.9 30.4 132 188 A T H >X S+ 0 0 21 -4,-2.2 3,-1.3 1,-0.3 4,-0.7 0.835 86.5 67.7 -57.6 -30.9 15.7 11.6 32.7 133 189 A N H X< S+ 0 0 101 -3,-1.0 3,-0.7 -4,-0.7 -1,-0.3 0.794 87.6 66.0 -54.6 -32.2 14.7 9.3 35.5 134 190 A E H X4 S+ 0 0 47 -3,-1.6 3,-0.5 -4,-0.3 -1,-0.3 0.742 94.5 59.7 -66.1 -23.0 17.4 6.9 34.3 135 191 A V H << S+ 0 0 6 -3,-1.3 -1,-0.3 -4,-0.5 -2,-0.2 0.871 111.1 39.0 -65.3 -34.4 19.9 9.5 35.3 136 192 A F T << 0 0 87 -4,-0.7 -2,-0.2 -3,-0.7 -1,-0.2 0.250 360.0 360.0-105.4 14.7 18.7 9.4 38.9 137 193 A K < 0 0 219 -3,-0.5 -1,-0.2 -4,-0.2 -42,-0.1 -0.633 360.0 360.0 79.2 360.0 18.2 5.6 39.2 138 !* 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 0.0 139 44 B I 0 0 129 0, 0.0 2,-1.0 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 139.0 23.5 13.5 45.3 140 45 B D > - 0 0 90 1,-0.2 4,-1.9 2,-0.0 3,-0.4 -0.831 360.0-171.2 -93.9 101.1 26.4 14.9 43.2 141 46 B Y H > S+ 0 0 138 -2,-1.0 4,-2.7 1,-0.2 5,-0.2 0.821 79.9 63.0 -66.9 -27.3 24.5 16.9 40.6 142 47 B G H > S+ 0 0 40 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.940 107.7 43.2 -59.9 -43.4 27.7 17.5 38.6 143 48 B D H > S+ 0 0 104 -3,-0.4 4,-1.8 2,-0.2 -2,-0.2 0.889 111.7 52.5 -71.7 -37.5 28.0 13.8 38.0 144 49 B R H X S+ 0 0 70 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.903 109.5 51.2 -59.4 -41.9 24.3 13.4 37.3 145 50 B D H X S+ 0 0 78 -4,-2.7 4,-3.0 2,-0.2 -2,-0.2 0.890 105.8 54.6 -62.4 -38.9 24.6 16.2 34.7 146 51 B S H X S+ 0 0 70 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.895 110.7 45.4 -64.9 -35.6 27.6 14.5 33.1 147 52 B L H X S+ 0 0 29 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.902 109.8 55.4 -72.3 -39.2 25.4 11.3 32.7 148 53 B F H X S+ 0 0 54 -4,-2.5 4,-3.1 1,-0.2 5,-0.4 0.918 108.8 48.4 -55.1 -46.0 22.5 13.5 31.4 149 54 B F H X S+ 0 0 100 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.865 105.5 57.1 -65.2 -32.9 25.0 14.8 28.7 150 55 B E H < S+ 0 0 111 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.900 117.9 35.3 -63.2 -37.5 26.0 11.3 27.8 151 56 B I H < S+ 0 0 0 -4,-1.9 -46,-0.4 2,-0.1 -47,-0.2 0.908 134.7 18.3 -76.4 -52.2 22.4 10.6 27.1 152 57 B F H >< S- 0 0 0 -4,-3.1 3,-0.7 1,-0.3 -3,-0.2 0.554 88.5-150.2-106.2 -12.4 20.9 13.8 25.6 153 58 B G T 3< - 0 0 10 -4,-1.8 -1,-0.3 -5,-0.4 -2,-0.1 -0.246 46.1 -62.9 62.8-152.3 24.1 15.6 24.6 154 59 B T T 3 - 0 0 81 -4,-0.1 -1,-0.2 -5,-0.0 -5,-0.1 0.137 67.4 -97.3-115.2 18.9 23.8 19.4 24.7 155 60 B G S < S+ 0 0 7 -3,-0.7 -2,-0.1 -50,-0.0 4,-0.1 0.562 103.0 99.6 78.0 9.5 21.1 20.2 22.1 156 61 B E > + 0 0 102 1,-0.1 3,-1.4 2,-0.1 4,-0.4 0.742 51.4 89.8 -95.6 -25.4 23.7 20.9 19.4 157 62 B E T 3 S+ 0 0 64 1,-0.3 3,-0.2 2,-0.1 -1,-0.1 0.779 104.6 18.0 -47.0 -46.8 23.5 17.7 17.6 158 63 B Y T > S+ 0 0 17 -53,-0.2 3,-2.4 1,-0.1 4,-0.4 0.241 86.8 111.7-114.0 14.6 20.8 18.7 15.1 159 64 B R G X + 0 0 120 -3,-1.4 3,-2.0 1,-0.3 -1,-0.1 0.817 65.8 76.0 -57.9 -27.4 20.8 22.5 15.3 160 65 B Y G 3 S+ 0 0 128 -4,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.736 82.7 68.9 -58.0 -22.4 22.2 22.5 11.8 161 66 B V G < 0 0 24 -3,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.802 360.0 360.0 -65.3 -34.2 18.6 21.7 10.7 162 67 B L < 0 0 108 -3,-2.0 -1,-0.3 -4,-0.4 -2,-0.2 0.466 360.0 360.0 -93.6 360.0 17.4 25.2 11.7