==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MEMBRANE PROTEIN 15-JUN-12 4AXZ . COMPND 2 MOLECULE: PUTATIVE ANTIGEN P35; . SOURCE 2 ORGANISM_SCIENTIFIC: BORRELIA BURGDORFERI; . AUTHOR K.BRANGULIS,I.PETROVSKIS,A.KAZAKS,R.RANKA,V.BAUMANIS,K.TARS . 218 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12145.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 178 81.7 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 . 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 . 5 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 144 66.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 1 1 1 1 1 0 1 0 1 0 0 0 0 1 0 0 0 0 1 0 0 0 1 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 72 A N > 0 0 153 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 21.2 -11.5 -25.8 -12.8 2 73 A E H > + 0 0 151 2,-0.2 4,-2.4 3,-0.1 5,-0.1 0.811 360.0 54.2 -54.3 -37.3 -11.8 -24.7 -9.2 3 74 A K H > S+ 0 0 172 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.948 104.4 47.5 -61.7 -57.9 -8.2 -26.1 -9.7 4 75 A E H > S+ 0 0 121 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.911 113.4 51.1 -48.9 -49.3 -7.3 -23.9 -12.7 5 76 A K H X S+ 0 0 119 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.933 112.6 43.6 -53.6 -55.9 -8.7 -20.8 -10.8 6 77 A I H X S+ 0 0 86 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.917 112.6 54.1 -61.1 -41.6 -6.6 -21.6 -7.6 7 78 A I H X S+ 0 0 94 -4,-3.1 4,-2.5 1,-0.2 -2,-0.2 0.899 106.7 50.4 -60.0 -45.8 -3.5 -22.3 -9.7 8 79 A K H X S+ 0 0 127 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.915 111.8 48.6 -57.5 -46.0 -3.6 -19.0 -11.5 9 80 A K H X S+ 0 0 108 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.837 111.0 49.9 -61.0 -39.6 -4.0 -17.1 -8.2 10 81 A I H X S+ 0 0 68 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.954 109.9 49.8 -68.6 -48.0 -1.0 -19.0 -6.7 11 82 A A H X S+ 0 0 42 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.862 112.2 49.4 -56.0 -41.8 1.2 -18.3 -9.7 12 83 A Q H X S+ 0 0 107 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.841 108.5 52.1 -65.6 -38.8 0.3 -14.6 -9.4 13 84 A E H X S+ 0 0 72 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.896 110.3 48.8 -66.5 -38.1 1.0 -14.6 -5.7 14 85 A F H X S+ 0 0 67 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.929 113.2 47.7 -60.5 -52.5 4.6 -16.1 -6.4 15 86 A D H X S+ 0 0 98 -4,-2.3 4,-1.2 1,-0.2 -2,-0.2 0.933 117.0 41.4 -53.1 -52.5 5.2 -13.4 -9.1 16 87 A E H X S+ 0 0 79 -4,-2.5 4,-1.5 1,-0.2 -2,-0.2 0.851 112.8 53.3 -70.1 -36.8 4.1 -10.5 -6.9 17 88 A N H X S+ 0 0 1 -4,-2.4 4,-2.3 -5,-0.2 -1,-0.2 0.874 106.3 55.1 -60.1 -39.6 5.8 -11.8 -3.7 18 89 A E H X S+ 0 0 86 -4,-2.0 4,-2.7 1,-0.2 -1,-0.2 0.866 106.5 49.3 -63.6 -38.9 9.0 -12.1 -5.7 19 90 A K H X S+ 0 0 141 -4,-1.2 4,-0.6 2,-0.2 -1,-0.2 0.832 111.6 49.8 -68.3 -37.4 8.9 -8.4 -6.7 20 91 A L H >< S+ 0 0 24 -4,-1.5 3,-0.6 2,-0.2 4,-0.3 0.916 114.1 44.3 -66.1 -42.8 8.2 -7.3 -3.2 21 92 A I H >X S+ 0 0 3 -4,-2.3 4,-2.6 1,-0.2 3,-2.4 0.914 105.2 62.0 -69.0 -44.0 11.2 -9.4 -1.9 22 93 A N H 3< S+ 0 0 89 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.662 94.3 65.8 -58.0 -20.2 13.5 -8.2 -4.7 23 94 A K T << S+ 0 0 115 -4,-0.6 -1,-0.3 -3,-0.6 -2,-0.2 0.698 119.0 18.8 -68.5 -25.7 13.0 -4.7 -3.3 24 95 A I T <> S+ 0 0 1 -3,-2.4 4,-2.5 -4,-0.3 -2,-0.2 0.598 104.1 84.6-121.9 -21.7 14.8 -5.6 -0.1 25 96 A G H X S+ 0 0 10 -4,-2.6 4,-1.8 1,-0.2 -3,-0.1 0.855 92.2 46.1 -57.5 -48.7 16.8 -8.7 -0.9 26 97 A P H > S+ 0 0 84 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.911 115.0 50.0 -59.4 -40.4 19.9 -7.0 -2.4 27 98 A N H > S+ 0 0 53 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.889 108.1 51.5 -64.3 -41.9 19.9 -4.6 0.5 28 99 A I H X S+ 0 0 6 -4,-2.5 4,-3.2 1,-0.2 -1,-0.2 0.890 108.3 51.8 -66.2 -40.2 19.7 -7.3 3.2 29 100 A E H X S+ 0 0 114 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.909 112.3 46.6 -63.0 -42.9 22.6 -9.2 1.6 30 101 A M H X S+ 0 0 102 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.913 113.5 48.2 -64.3 -46.0 24.7 -6.0 1.7 31 102 A F H X S+ 0 0 38 -4,-2.7 4,-3.1 2,-0.2 -2,-0.2 0.909 109.3 52.8 -61.2 -45.4 23.7 -5.2 5.3 32 103 A A H X S+ 0 0 44 -4,-3.2 4,-2.4 1,-0.2 -1,-0.2 0.920 112.3 45.6 -55.8 -44.9 24.5 -8.8 6.5 33 104 A Q H X S+ 0 0 130 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.910 113.7 48.8 -63.3 -43.8 28.0 -8.5 4.9 34 105 A T H X S+ 0 0 66 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.909 110.6 51.1 -62.1 -47.5 28.5 -5.0 6.5 35 106 A I H X S+ 0 0 10 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.937 110.7 48.4 -56.7 -48.6 27.3 -6.3 9.9 36 107 A N H X S+ 0 0 92 -4,-2.4 4,-1.5 1,-0.2 -2,-0.2 0.894 110.7 51.7 -59.6 -41.9 29.8 -9.2 9.7 37 108 A T H X S+ 0 0 69 -4,-2.3 4,-0.5 2,-0.2 -1,-0.2 0.892 109.8 48.7 -62.6 -41.3 32.6 -6.8 8.7 38 109 A D H >< S+ 0 0 9 -4,-2.4 3,-1.1 1,-0.2 -2,-0.2 0.906 108.4 54.1 -62.2 -44.6 31.8 -4.5 11.7 39 110 A I H 3< S+ 0 0 88 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.820 107.0 52.3 -58.7 -33.1 31.8 -7.5 14.1 40 111 A Q H 3< S+ 0 0 123 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.605 86.7 112.0 -81.3 -12.1 35.3 -8.4 12.8 41 112 A K S << S- 0 0 80 -3,-1.1 2,-0.6 -4,-0.5 -3,-0.0 -0.267 72.2-120.4 -64.9 147.9 36.8 -4.9 13.5 42 113 A I - 0 0 161 1,-0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.796 26.6-134.7 -86.2 121.6 39.4 -4.5 16.2 43 114 A E - 0 0 44 -2,-0.6 2,-0.1 1,-0.1 27,-0.0 -0.540 26.2-112.7 -69.8 138.1 38.0 -1.9 18.7 44 115 A P > - 0 0 46 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 -0.416 24.8-112.6 -67.8 155.5 40.7 0.6 19.6 45 116 A N T 3 S+ 0 0 165 1,-0.3 -2,-0.1 2,-0.1 0, 0.0 0.809 117.4 54.3 -57.7 -32.6 42.0 0.5 23.2 46 117 A D T > S- 0 0 77 5,-0.1 3,-1.9 1,-0.0 -1,-0.3 0.452 102.6-132.8 -80.0 -2.8 40.4 3.9 24.0 47 118 A Q G X - 0 0 42 -3,-1.9 3,-2.2 1,-0.3 -2,-0.1 0.844 62.4 -67.4 53.2 36.7 37.0 2.7 22.8 48 119 A F G 3 S- 0 0 13 1,-0.3 -1,-0.3 2,-0.0 43,-0.2 0.754 97.4 -54.2 59.1 26.2 36.6 5.9 20.8 49 120 A G G < S+ 0 0 2 -3,-1.9 2,-1.6 1,-0.1 -1,-0.3 0.362 109.8 122.5 86.3 -3.4 36.5 7.8 24.1 50 121 A I < + 0 0 2 -3,-2.2 2,-0.3 -4,-0.2 -1,-0.1 -0.636 49.9 108.9 -90.5 73.8 33.5 5.7 25.5 51 122 A N S >> S- 0 0 25 -2,-1.6 4,-1.9 -3,-0.1 3,-1.3 -0.901 85.7 -93.6-144.0 173.8 35.5 4.6 28.6 52 123 A K T 34 S+ 0 0 132 -2,-0.3 5,-0.2 1,-0.3 -2,-0.0 0.693 115.1 66.1 -71.2 -20.2 35.6 5.2 32.3 53 124 A T T 34 S+ 0 0 120 1,-0.2 -1,-0.3 3,-0.1 3,-0.1 0.776 116.8 26.9 -66.3 -25.1 38.2 8.0 32.1 54 125 A L T <4 S+ 0 0 85 -3,-1.3 2,-0.4 1,-0.3 -2,-0.2 0.617 127.0 41.9-113.8 -22.2 35.6 10.2 30.3 55 126 A F S < S- 0 0 3 -4,-1.9 -1,-0.3 8,-0.0 2,-0.1 -0.960 89.2-125.3-129.6 112.5 32.3 8.9 31.5 56 127 A T > - 0 0 73 -2,-0.4 3,-0.7 -3,-0.1 4,-0.3 -0.328 26.0-115.3 -63.7 130.7 32.2 8.1 35.3 57 128 A E T 3 S+ 0 0 101 -5,-0.2 -1,-0.1 1,-0.2 4,-0.1 -0.273 91.6 23.0 -55.3 147.2 31.1 4.6 36.2 58 129 A K T 3 S+ 0 0 184 2,-0.3 -1,-0.2 1,-0.1 3,-0.1 0.751 87.7 103.3 66.2 30.3 27.8 4.1 38.2 59 130 A K S < S+ 0 0 99 -3,-0.7 2,-0.3 1,-0.4 -2,-0.1 0.659 91.6 11.8-103.6 -29.2 26.0 7.3 37.2 60 131 A D > - 0 0 19 -4,-0.3 4,-2.2 1,-0.1 -1,-0.4 -0.982 64.2-135.4-152.1 137.7 23.7 5.7 34.7 61 132 A N H > S+ 0 0 121 -2,-0.3 4,-2.1 2,-0.2 5,-0.1 0.833 107.1 49.7 -60.4 -40.1 22.8 2.1 33.9 62 133 A N H > S+ 0 0 22 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.895 110.0 50.9 -72.7 -38.4 23.0 2.6 30.2 63 134 A I H > S+ 0 0 1 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.918 111.0 50.0 -57.3 -44.4 26.4 4.2 30.4 64 135 A D H X S+ 0 0 37 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.874 105.5 54.9 -68.2 -37.9 27.5 1.3 32.5 65 136 A F H X S+ 0 0 78 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.947 111.0 47.0 -55.0 -46.6 26.2 -1.3 30.0 66 137 A M H < S+ 0 0 0 -4,-1.9 -2,-0.2 1,-0.2 7,-0.2 0.897 112.0 49.6 -62.9 -40.5 28.4 0.5 27.4 67 138 A L H < S+ 0 0 30 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.833 118.3 40.0 -67.9 -29.3 31.4 0.6 29.7 68 139 A K H < S+ 0 0 151 -4,-1.9 2,-0.6 1,-0.2 -2,-0.2 0.745 109.0 56.2 -93.1 -27.5 31.1 -3.1 30.5 69 140 A D X - 0 0 28 -4,-2.1 4,-1.9 -5,-0.2 3,-0.5 -0.895 49.8-168.4-125.5 112.1 30.1 -4.8 27.2 70 141 A N H > S+ 0 0 91 -2,-0.6 4,-2.5 1,-0.2 -1,-0.1 0.754 91.6 59.5 -66.3 -23.7 32.1 -4.6 23.9 71 142 A R H > S+ 0 0 170 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.867 106.3 46.8 -74.1 -34.2 29.2 -6.1 22.0 72 143 A L H > S+ 0 0 27 -3,-0.5 4,-2.3 -7,-0.2 -2,-0.2 0.880 112.3 50.6 -74.3 -36.6 26.8 -3.3 23.0 73 144 A R H X S+ 0 0 13 -4,-1.9 4,-2.7 -7,-0.2 -2,-0.2 0.930 108.7 52.2 -62.7 -41.9 29.6 -0.8 22.1 74 145 A R H X S+ 0 0 40 -4,-2.5 4,-2.8 1,-0.2 5,-0.2 0.938 109.5 49.8 -59.7 -47.1 29.9 -2.6 18.7 75 146 A L H X S+ 0 0 17 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.918 110.8 49.2 -53.6 -47.0 26.1 -2.2 18.2 76 147 A F H < S+ 0 0 1 -4,-2.3 4,-0.5 2,-0.2 -2,-0.2 0.922 111.3 48.8 -62.2 -41.1 26.3 1.4 19.0 77 148 A Y H ><>S+ 0 0 2 -4,-2.7 5,-2.6 1,-0.2 3,-1.4 0.933 112.5 48.7 -61.9 -45.3 29.2 2.0 16.6 78 149 A S H ><5S+ 0 0 0 -4,-2.8 3,-2.0 1,-0.3 -1,-0.2 0.814 98.9 67.4 -65.5 -30.7 27.3 0.1 13.8 79 150 A S T 3<5S+ 0 0 0 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.683 105.7 43.8 -60.0 -17.9 24.2 2.3 14.6 80 151 A L T X 5S- 0 0 1 -3,-1.4 3,-1.4 -4,-0.5 -1,-0.3 -0.078 127.2-100.4-115.4 25.6 26.3 5.2 13.2 81 152 A N T < 5 - 0 0 96 -3,-2.0 -3,-0.2 1,-0.3 3,-0.2 0.739 63.9 -78.6 60.9 28.7 27.6 3.1 10.2 82 153 A Y T 3 - 0 0 64 -3,-1.4 4,-2.6 -6,-0.5 -1,-0.2 -0.761 18.2-164.2 -83.4 98.5 31.9 6.1 11.2 84 155 A E H > S+ 0 0 96 -2,-1.1 4,-2.7 1,-0.2 5,-0.2 0.867 83.3 49.8 -56.1 -45.7 34.9 6.4 13.5 85 156 A N H > S+ 0 0 140 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.894 113.8 46.7 -62.8 -40.0 35.4 10.1 13.3 86 157 A K H > S+ 0 0 40 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.905 112.5 49.5 -69.1 -41.2 31.7 10.7 14.0 87 158 A I H X S+ 0 0 1 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.950 114.4 44.7 -61.4 -52.1 31.7 8.2 16.9 88 159 A K H X S+ 0 0 89 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.928 114.0 50.1 -59.3 -46.6 34.8 9.8 18.5 89 160 A K H X S+ 0 0 83 -4,-2.6 4,-2.6 -5,-0.2 -2,-0.2 0.917 112.3 46.5 -59.5 -49.1 33.4 13.3 17.9 90 161 A L H X S+ 0 0 1 -4,-2.9 4,-3.1 1,-0.2 5,-0.2 0.931 112.3 51.3 -55.3 -47.3 30.0 12.4 19.6 91 162 A A H X S+ 0 0 2 -4,-2.7 4,-2.2 -5,-0.2 -2,-0.2 0.866 111.1 47.4 -61.3 -41.5 31.8 10.7 22.5 92 163 A T H < S+ 0 0 59 -4,-2.3 4,-0.5 2,-0.2 -1,-0.2 0.932 112.7 49.6 -62.1 -48.3 33.9 13.8 23.0 93 164 A I H >< S+ 0 0 2 -4,-2.6 3,-1.2 1,-0.2 4,-0.3 0.946 113.1 46.5 -57.0 -49.0 30.8 16.1 22.8 94 165 A L H >< S+ 0 0 2 -4,-3.1 3,-1.8 1,-0.3 -1,-0.2 0.889 104.3 60.9 -63.0 -44.9 28.9 13.9 25.3 95 166 A A T 3< S+ 0 0 33 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.495 103.9 51.6 -61.6 -10.0 31.8 13.7 27.9 96 167 A Q T < S+ 0 0 67 -3,-1.2 -1,-0.3 -4,-0.5 -2,-0.2 0.454 82.6 109.8-106.2 1.0 31.8 17.4 28.3 97 168 A T < + 0 0 11 -3,-1.8 2,-0.3 -4,-0.3 89,-0.2 -0.370 45.5 178.1 -68.3 157.2 28.1 17.8 29.0 98 169 A S + 0 0 49 87,-1.9 91,-0.3 86,-0.1 2,-0.3 -0.916 9.7 178.8-151.9 162.8 27.3 18.8 32.6 99 170 A S - 0 0 27 -2,-0.3 3,-0.1 1,-0.1 87,-0.1 -0.962 35.5-120.7-163.3 170.2 24.2 19.6 34.8 100 171 A S S S+ 0 0 102 -2,-0.3 -1,-0.1 1,-0.2 86,-0.0 0.869 114.0 37.3 -80.4 -41.3 23.1 20.5 38.4 101 172 A N S S- 0 0 122 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 0.179 110.4-115.4 -96.9 9.9 20.8 17.5 38.9 102 173 A D S >> S+ 0 0 69 1,-0.1 3,-1.5 -3,-0.1 4,-0.7 0.529 75.1 133.6 65.7 9.9 23.1 15.0 37.0 103 174 A Y H >> + 0 0 75 1,-0.3 4,-2.4 2,-0.2 3,-0.5 0.760 55.6 75.3 -61.9 -24.6 20.4 14.5 34.5 104 175 A H H 3> S+ 0 0 14 1,-0.3 4,-2.7 2,-0.2 -1,-0.3 0.860 91.9 56.4 -56.8 -34.7 23.0 14.8 31.7 105 176 A Y H <> S+ 0 0 35 -3,-1.5 4,-2.6 2,-0.2 -1,-0.3 0.880 106.2 48.7 -63.2 -37.5 24.1 11.3 32.6 106 177 A T H - 0 0 65 -2,-1.4 4,-2.6 -3,-0.3 5,-0.2 -0.179 58.5-101.4 -66.1 165.2 17.7 -14.9 5.2 131 202 A K H > S+ 0 0 121 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.915 125.8 51.0 -52.6 -47.0 17.6 -16.0 1.6 132 203 A D H > S+ 0 0 121 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.894 111.4 47.5 -57.5 -44.1 15.8 -19.2 2.7 133 204 A E H > S+ 0 0 32 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.859 110.3 52.5 -65.7 -36.2 13.3 -17.2 4.7 134 205 A Q H X S+ 0 0 22 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.934 111.1 46.4 -65.6 -44.8 12.8 -14.9 1.7 135 206 A K H X S+ 0 0 109 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.900 109.7 54.5 -61.7 -43.2 12.1 -17.9 -0.5 136 207 A R H X S+ 0 0 79 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.905 110.3 48.1 -53.8 -43.1 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228 A M H X S+ 0 0 45 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.914 110.3 47.7 -55.9 -43.2 15.7 1.1 7.5 158 229 A Q H X S+ 0 0 95 -4,-1.9 4,-3.0 2,-0.2 -2,-0.2 0.883 106.0 55.5 -70.3 -42.9 14.2 4.6 7.9 159 230 A E H X S+ 0 0 35 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.875 109.1 50.0 -49.6 -41.5 14.1 4.6 11.7 160 231 A R H X S+ 0 0 19 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.932 111.2 47.4 -69.0 -45.8 17.8 3.8 11.6 161 232 A N H X S+ 0 0 62 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.867 109.6 52.9 -63.5 -36.9 18.4 6.7 9.2 162 233 A S H X S+ 0 0 42 -4,-3.0 4,-1.9 2,-0.2 -1,-0.2 0.868 107.7 53.0 -67.0 -33.9 16.4 9.1 11.3 163 234 A W H X S+ 0 0 2 -4,-1.8 4,-2.0 -5,-0.2 -2,-0.2 0.932 107.5 50.4 -64.6 -44.4 18.5 8.1 14.3 164 235 A I H X S+ 0 0 17 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.912 108.5 53.0 -60.0 -39.3 21.7 8.9 12.4 165 236 A K H X S+ 0 0 112 -4,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.875 104.9 55.0 -65.9 -38.5 20.2 12.3 11.5 166 237 A I H X S+ 0 0 17 -4,-1.9 4,-2.7 2,-0.2 -1,-0.2 0.950 109.8 46.2 -55.8 -52.3 19.5 13.0 15.2 167 238 A V H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.912 111.4 52.3 -57.7 -42.3 23.2 12.4 16.0 168 239 A D H X S+ 0 0 65 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.900 110.9 47.7 -62.0 -39.7 24.2 14.6 13.1 169 240 A N H X S+ 0 0 84 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.882 109.8 52.1 -66.6 -41.3 22.0 17.4 14.4 170 241 A I H X S+ 0 0 1 -4,-2.7 4,-1.3 2,-0.2 -2,-0.2 0.921 112.3 45.4 -58.6 -47.6 23.4 17.0 17.9 171 242 A I H X S+ 0 0 12 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.905 109.4 58.2 -60.9 -41.8 26.9 17.3 16.6 172 243 A G H X S+ 0 0 21 -4,-2.2 4,-3.0 1,-0.2 5,-0.2 0.864 100.8 54.6 -56.3 -41.2 25.7 20.2 14.4 173 244 A E H X>S+ 0 0 26 -4,-2.1 5,-2.3 2,-0.2 4,-0.7 0.916 111.0 45.9 -58.1 -45.0 24.6 22.2 17.6 174 245 A Y H ><5S+ 0 0 46 -4,-1.3 3,-0.6 3,-0.2 -2,-0.2 0.933 113.7 48.2 -64.1 -47.2 28.0 21.8 19.0 175 246 A D H 3<5S+ 0 0 76 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.873 113.8 46.5 -62.3 -42.5 29.6 22.8 15.6 176 247 A K H 3<5S- 0 0 154 -4,-3.0 -1,-0.3 -5,-0.1 -2,-0.2 0.620 108.5-129.4 -67.8 -15.6 27.3 25.9 15.3 177 248 A N T X<5 - 0 0 63 -4,-0.7 3,-3.1 -3,-0.6 -3,-0.2 0.828 28.3-155.5 62.8 33.7 28.1 26.7 19.0 178 249 A T G > S+ 0 0 25 -3,-3.1 3,-1.5 -4,-0.1 4,-0.6 0.810 84.8 156.1 69.4 32.3 27.8 29.1 23.4 181 252 A C T <4 + 0 0 0 -3,-1.6 7,-0.4 1,-0.3 3,-0.3 0.726 61.5 71.4 -62.0 -24.4 27.6 25.4 24.3 182 253 A K T 34 S+ 0 0 102 1,-0.2 -1,-0.3 -8,-0.2 3,-0.1 0.801 106.5 36.6 -58.6 -30.3 31.3 25.0 23.3 183 254 A A T <4 S+ 0 0 99 -3,-1.5 2,-0.4 1,-0.2 -1,-0.2 0.520 118.6 51.4-100.5 -10.2 32.3 26.9 26.4 184 255 A D X - 0 0 68 -4,-0.6 4,-1.9 -3,-0.3 -1,-0.2 -0.942 55.7-165.8-141.5 113.1 29.7 25.6 28.8 185 256 A G H > S+ 0 0 17 -2,-0.4 4,-2.2 1,-0.2 -87,-1.9 0.739 94.7 55.2 -69.8 -25.9 28.9 22.0 29.4 186 257 A K H > S+ 0 0 93 -89,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.912 108.0 47.3 -71.6 -44.2 25.6 22.9 31.2 187 258 A I H > S+ 0 0 59 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.897 112.2 52.5 -59.8 -39.6 24.4 24.9 28.2 188 259 A L H X S+ 0 0 1 -4,-1.9 4,-2.4 -7,-0.4 -2,-0.2 0.932 107.2 50.1 -65.0 -48.1 25.4 21.9 26.0 189 260 A G H X S+ 0 0 6 -4,-2.2 4,-3.0 -91,-0.3 -1,-0.2 0.898 114.4 45.8 -53.1 -41.4 23.5 19.4 28.1 190 261 A E H X S+ 0 0 90 -4,-2.0 4,-2.6 2,-0.2 5,-0.4 0.869 109.0 54.4 -75.1 -37.1 20.4 21.6 27.9 191 262 A V H X S+ 0 0 23 -4,-2.7 4,-1.9 -5,-0.2 -1,-0.2 0.929 115.0 41.1 -58.0 -44.8 20.8 22.2 24.2 192 263 A I H X>S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 5,-0.5 0.939 115.8 49.2 -73.8 -47.0 20.9 18.5 23.7 193 264 A R H X5S+ 0 0 90 -4,-3.0 4,-2.0 3,-0.2 5,-0.5 0.944 118.2 38.0 -52.6 -55.9 18.0 17.7 26.2 194 265 A V H <5S+ 0 0 84 -4,-2.6 4,-0.2 1,-0.2 -2,-0.2 0.916 122.5 42.2 -70.9 -45.3 15.6 20.3 24.8 195 266 A G H <5S+ 0 0 31 -4,-1.9 -1,-0.2 -5,-0.4 -2,-0.2 0.864 133.4 9.3 -63.1 -36.4 16.4 19.8 21.1 196 267 A Y H >X5S+ 0 0 28 -4,-2.4 3,-0.9 -5,-0.2 4,-0.7 0.584 91.6 91.2-134.5 -15.2 16.6 16.0 21.1 197 268 A E G >< S+ 0 0 4 -2,-0.2 4,-2.1 2,-0.1 5,-0.2 0.606 72.9 78.2 -89.5 -11.3 14.1 2.9 19.9 203 274 A N H > S+ 0 0 112 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.920 88.9 54.6 -55.8 -49.6 10.5 1.7 20.9 204 275 A K H > S+ 0 0 100 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.902 108.3 50.9 -51.8 -46.2 9.3 2.3 17.4 205 276 A S H > S+ 0 0 0 -4,-0.4 4,-2.3 1,-0.2 -2,-0.2 0.934 110.0 48.1 -59.8 -50.0 12.1 0.1 16.0 206 277 A M H X S+ 0 0 55 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.857 109.8 50.8 -69.4 -29.5 11.4 -2.6 18.2 207 278 A Q H X S+ 0 0 93 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.962 108.2 52.8 -68.0 -45.6 7.8 -2.6 17.5 208 279 A I H X S+ 0 0 8 -4,-2.6 4,-0.8 1,-0.2 -2,-0.2 0.886 109.8 51.1 -55.8 -38.1 8.4 -2.7 13.8 209 280 A L H >X S+ 0 0 21 -4,-2.3 4,-2.7 2,-0.2 3,-1.1 0.932 106.9 51.8 -62.7 -50.2 10.7 -5.7 14.5 210 281 A N H 3X S+ 0 0 69 -4,-1.9 4,-2.6 1,-0.3 -2,-0.2 0.859 107.4 53.8 -55.7 -38.0 7.9 -7.5 16.4 211 282 A N H 3< S+ 0 0 67 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.675 110.9 46.1 -72.8 -19.8 5.5 -6.9 13.5 212 283 A I H X S+ 0 0 78 -4,-2.7 4,-1.0 1,-0.2 3,-0.8 0.919 101.7 61.5 -66.4 -44.8 8.6 -11.4 13.6 214 285 A T H 3< S+ 0 0 54 -4,-2.6 4,-0.3 1,-0.3 3,-0.3 0.822 103.6 46.1 -64.6 -38.7 5.0 -12.3 14.3 215 286 A P H >4 S+ 0 0 28 0, 0.0 3,-0.8 0, 0.0 -1,-0.3 0.799 108.5 60.8 -66.0 -25.0 3.8 -13.3 10.8 216 287 A L H << S+ 0 0 15 -3,-0.8 -2,-0.2 -4,-0.7 -3,-0.1 0.759 85.6 70.3 -77.4 -24.9 7.0 -15.4 10.4 217 288 A K T 3< 0 0 170 -4,-1.0 -1,-0.2 -3,-0.3 -3,-0.1 0.712 360.0 360.0 -68.1 -19.5 6.4 -17.8 13.3 218 289 A T < 0 0 131 -3,-0.8 -1,-0.3 -4,-0.3 -2,-0.2 0.715 360.0 360.0 -47.7 360.0 3.6 -19.2 11.1