==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/RNA 08-JUL-10 3NVI . COMPND 2 MOLECULE: NOP5/NOP56 RELATED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS FURIOSUS; . AUTHOR H.LI,S.XUE,R.WANG . 736 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35345.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 549 74.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 1.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 22 3.0 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 . 19 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 83 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 386 52.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 2.0 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 4 5 3 6 0 3 3 2 1 0 0 2 1 3 0 0 0 2 0 0 0 0 0 0 0 0 4 RESIDUES PER ALPHA HELIX . 0 0 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 PARALLEL BRIDGES PER LADDER . 0 0 0 4 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 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 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 1 127 A Q 0 0 191 0, 0.0 2,-1.1 0, 0.0 4,-0.3 0.000 360.0 360.0 360.0 -37.1 23.4 -23.8 14.3 2 128 A S - 0 0 87 1,-0.2 462,-0.0 2,-0.1 461,-0.0 -0.405 360.0-145.6 54.3 -99.1 23.1 -27.5 14.8 3 129 A G S S+ 0 0 48 -2,-1.1 -1,-0.2 459,-0.0 4,-0.1 0.379 78.5 77.0 120.1 -3.4 20.0 -27.6 12.6 4 130 A A >> + 0 0 21 459,-0.2 4,-1.2 2,-0.1 3,-1.1 0.437 66.8 92.5-100.5 -2.7 17.9 -30.3 14.0 5 131 A R H 3> S+ 0 0 25 -4,-0.3 4,-1.8 1,-0.3 5,-0.1 0.761 80.3 59.8 -65.5 -21.2 16.7 -28.2 17.0 6 132 A D H 3> S+ 0 0 16 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.828 102.9 51.2 -74.6 -30.6 13.6 -27.1 15.1 7 133 A K H <> S+ 0 0 70 -3,-1.1 4,-1.8 2,-0.2 -2,-0.2 0.785 108.7 52.9 -71.8 -29.4 12.5 -30.7 14.7 8 134 A M H X S+ 0 0 2 -4,-1.2 4,-2.3 2,-0.2 -2,-0.2 0.865 105.8 51.4 -73.4 -40.9 12.9 -31.2 18.4 9 135 A V H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 5,-0.2 0.867 108.3 55.4 -61.0 -35.2 10.7 -28.2 19.2 10 136 A I H X S+ 0 0 11 -4,-1.2 4,-2.4 2,-0.2 -2,-0.2 0.956 108.4 44.6 -64.7 -51.9 8.1 -29.7 16.9 11 137 A Q H X S+ 0 0 12 -4,-1.8 4,-2.9 1,-0.2 -1,-0.2 0.908 112.7 54.1 -51.9 -46.3 8.0 -33.1 18.7 12 138 A A H X S+ 0 0 0 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.901 109.7 45.2 -60.5 -39.1 7.8 -31.1 22.0 13 139 A I H X S+ 0 0 2 -4,-2.1 4,-1.0 2,-0.2 -1,-0.2 0.842 114.8 47.7 -78.9 -31.1 4.8 -29.1 20.9 14 140 A E H X S+ 0 0 57 -4,-2.4 4,-1.5 -5,-0.2 -1,-0.2 0.868 112.9 50.4 -69.1 -36.1 3.1 -32.2 19.5 15 141 A A H X S+ 0 0 2 -4,-2.9 4,-2.9 2,-0.2 -2,-0.2 0.797 104.8 57.1 -65.0 -35.0 3.9 -33.9 22.8 16 142 A L H X S+ 0 0 2 -4,-1.7 4,-1.5 1,-0.2 -1,-0.2 0.823 108.0 47.8 -70.8 -31.9 2.5 -31.0 24.7 17 143 A D H X S+ 0 0 65 -4,-1.0 4,-1.8 2,-0.2 -1,-0.2 0.824 111.3 49.9 -77.9 -34.6 -0.8 -31.5 23.0 18 144 A D H X S+ 0 0 31 -4,-1.5 4,-2.8 2,-0.2 3,-0.4 0.976 107.9 52.3 -64.6 -55.8 -0.8 -35.2 23.6 19 145 A V H X S+ 0 0 1 -4,-2.9 4,-3.0 1,-0.3 -2,-0.2 0.896 110.3 50.8 -46.7 -45.0 -0.1 -34.7 27.3 20 146 A D H X S+ 0 0 46 -4,-1.5 4,-1.9 2,-0.2 -1,-0.3 0.887 108.3 51.6 -57.2 -42.5 -3.1 -32.3 27.3 21 147 A K H X S+ 0 0 130 -4,-1.8 4,-2.3 -3,-0.4 -2,-0.2 0.970 114.8 42.4 -60.0 -52.3 -5.2 -35.0 25.6 22 148 A V H X S+ 0 0 2 -4,-2.8 4,-2.8 1,-0.2 5,-0.4 0.890 108.4 57.8 -65.1 -40.3 -4.3 -37.6 28.2 23 149 A I H X S+ 0 0 3 -4,-3.0 4,-2.5 -5,-0.3 -1,-0.2 0.932 110.7 45.2 -56.1 -42.2 -4.6 -35.2 31.2 24 150 A N H X S+ 0 0 87 -4,-1.9 4,-2.6 2,-0.2 5,-0.3 0.980 112.1 49.8 -62.6 -55.5 -8.2 -34.6 30.1 25 151 A L H X S+ 0 0 50 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.890 116.7 41.5 -49.5 -46.4 -9.0 -38.2 29.5 26 152 A L H X S+ 0 0 1 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.872 112.9 52.5 -76.8 -38.8 -7.6 -39.3 32.9 27 153 A V H X S+ 0 0 1 -4,-2.5 4,-1.9 -5,-0.4 -1,-0.2 0.840 106.9 53.5 -62.7 -31.7 -9.0 -36.4 34.9 28 154 A A H X S+ 0 0 58 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.934 112.7 45.3 -68.1 -42.0 -12.5 -37.2 33.4 29 155 A R H X S+ 0 0 19 -4,-1.7 4,-2.3 -5,-0.3 5,-0.2 0.830 108.0 56.8 -61.5 -40.7 -12.0 -40.7 34.8 30 156 A L H X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 5,-0.2 0.905 110.7 44.9 -58.8 -43.4 -10.7 -39.4 38.1 31 157 A R H X S+ 0 0 25 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.876 111.8 49.2 -71.8 -44.0 -13.9 -37.5 38.6 32 158 A E H X S+ 0 0 101 -4,-2.0 4,-0.7 2,-0.2 -2,-0.2 0.979 118.7 41.8 -58.9 -51.1 -16.3 -40.2 37.6 33 159 A W H >X S+ 0 0 0 -4,-2.3 3,-1.7 1,-0.2 4,-0.6 0.958 116.1 44.2 -61.5 -58.9 -14.5 -42.6 39.9 34 160 A Y H >X S+ 0 0 0 -4,-3.0 4,-2.0 1,-0.3 3,-0.7 0.781 103.5 69.3 -62.5 -22.2 -13.9 -40.4 42.9 35 161 A S H 3< S+ 0 0 24 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.776 86.1 66.1 -67.6 -24.6 -17.5 -39.2 42.5 36 162 A L H << S+ 0 0 46 -3,-1.7 56,-1.9 -4,-0.7 -1,-0.2 0.843 113.3 33.2 -59.5 -37.8 -18.7 -42.7 43.6 37 163 A H H << S+ 0 0 0 -3,-0.7 -2,-0.2 -4,-0.6 -1,-0.2 0.722 140.0 16.5 -84.0 -31.3 -17.2 -41.9 47.0 38 164 A F >< + 0 0 0 -4,-2.0 3,-1.1 1,-0.1 4,-0.4 -0.561 64.7 175.2-146.5 77.9 -17.9 -38.2 47.0 39 165 A P T > S+ 0 0 35 0, 0.0 3,-1.4 0, 0.0 4,-0.3 0.887 75.5 56.8 -51.2 -47.3 -20.4 -37.1 44.4 40 166 A E T 3> S+ 0 0 36 1,-0.3 4,-1.3 45,-0.2 3,-0.2 0.595 88.0 72.2 -73.2 -14.9 -20.6 -33.4 45.5 41 167 A L H <> S+ 0 0 0 -3,-1.1 4,-2.5 1,-0.2 -1,-0.3 0.768 82.8 76.8 -67.2 -24.9 -16.9 -32.4 45.1 42 168 A D H <4 S+ 0 0 70 -3,-1.4 -1,-0.2 -4,-0.4 -2,-0.1 0.937 104.8 28.4 -53.3 -57.4 -17.3 -32.6 41.3 43 169 A E H 4 S+ 0 0 127 -4,-0.3 -1,-0.2 -3,-0.2 -2,-0.2 0.861 116.3 61.9 -73.5 -37.5 -19.1 -29.3 40.8 44 170 A L H < S+ 0 0 15 -4,-1.3 -2,-0.2 1,-0.3 -1,-0.2 0.862 112.0 36.6 -60.0 -36.6 -17.5 -27.7 43.9 45 171 A L < + 0 0 0 -4,-2.5 -1,-0.3 1,-0.1 6,-0.2 -0.627 66.8 158.0-117.0 74.6 -14.0 -28.1 42.4 46 172 A P + 0 0 87 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.698 53.5 88.9 -69.2 -21.5 -14.6 -27.4 38.6 47 173 A K S > S- 0 0 112 -3,-0.2 4,-2.0 1,-0.1 3,-0.2 -0.711 74.6-145.2 -84.9 119.2 -10.9 -26.5 38.3 48 174 A H H > S+ 0 0 61 -2,-0.5 4,-2.7 1,-0.2 5,-0.3 0.895 93.1 50.9 -55.0 -58.0 -8.8 -29.7 37.4 49 175 A P H > S+ 0 0 54 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.897 112.8 51.1 -50.7 -41.1 -5.5 -29.0 39.3 50 176 A Q H > S+ 0 0 60 -3,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.912 110.5 46.4 -60.3 -46.3 -7.6 -28.3 42.4 51 177 A Y H >X S+ 0 0 0 -4,-2.0 4,-2.6 -6,-0.2 3,-0.6 0.985 116.6 45.4 -58.3 -57.5 -9.7 -31.5 42.1 52 178 A V H 3X S+ 0 0 2 -4,-2.7 4,-2.6 1,-0.3 5,-0.3 0.911 110.4 52.5 -51.6 -50.0 -6.5 -33.6 41.5 53 179 A A H 3X S+ 0 0 32 -4,-2.7 4,-1.7 -5,-0.3 -1,-0.3 0.847 113.2 48.2 -58.1 -31.9 -4.5 -31.9 44.3 54 180 A F H S+ 0 0 0 -4,-1.6 4,-3.3 -3,-0.6 5,-0.8 0.983 111.8 43.9 -71.1 -58.9 -7.5 -32.8 46.6 55 181 A V H <5S+ 0 0 0 -4,-2.6 -2,-0.2 1,-0.2 4,-0.2 0.898 117.3 49.8 -55.1 -37.8 -8.0 -36.4 45.7 56 182 A K H <5S+ 0 0 59 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.873 122.7 27.7 -70.7 -42.0 -4.2 -36.9 45.9 57 183 A T H <5S+ 0 0 69 -4,-1.7 -2,-0.2 -5,-0.3 -1,-0.2 0.615 132.3 31.5 -96.7 -13.5 -3.6 -35.2 49.3 58 184 A V T <5S+ 0 0 1 -4,-3.3 2,-0.5 -5,-0.1 -3,-0.2 0.831 73.0 162.6-107.5 -57.9 -7.0 -35.8 51.0 59 185 A G < + 0 0 0 -5,-0.8 -1,-0.1 -4,-0.2 -2,-0.1 -0.603 51.0 44.9 75.1-121.7 -8.5 -39.0 49.8 60 186 A H S > S- 0 0 16 -2,-0.5 3,-1.3 1,-0.1 4,-0.3 -0.072 81.2-118.4 -59.0 154.8 -11.2 -40.5 51.9 61 187 A R G > S+ 0 0 31 1,-0.2 3,-1.5 2,-0.2 -1,-0.1 0.821 110.3 70.9 -60.7 -31.3 -14.0 -38.3 53.3 62 188 A D G 3 S+ 0 0 107 1,-0.3 -1,-0.2 24,-0.0 -2,-0.1 0.656 94.6 54.3 -65.5 -13.4 -12.9 -39.2 56.8 63 189 A N G < S+ 0 0 84 -3,-1.3 2,-0.3 -5,-0.1 -1,-0.3 0.568 79.6 108.5 -93.9 -11.2 -9.7 -37.1 56.3 64 190 A I < + 0 0 4 -3,-1.5 2,-0.3 -4,-0.3 3,-0.0 -0.524 42.0 144.3 -69.7 128.6 -11.5 -33.9 55.4 65 191 A N > - 0 0 69 -2,-0.3 4,-1.4 1,-0.0 -2,-0.0 -0.970 65.4 -95.7-158.0 161.8 -11.2 -31.3 58.2 66 192 A E H > S+ 0 0 108 -2,-0.3 4,-0.9 1,-0.2 -1,-0.0 0.835 119.0 56.2 -50.6 -35.8 -10.9 -27.5 58.5 67 193 A E H >> S+ 0 0 145 1,-0.2 4,-1.6 2,-0.2 3,-0.9 0.978 106.3 41.2 -57.0 -68.7 -7.1 -28.0 58.9 68 194 A V H 34 S+ 0 0 53 1,-0.3 4,-0.3 -5,-0.2 -1,-0.2 0.665 109.8 60.0 -63.6 -22.0 -6.0 -29.9 55.7 69 195 A L H 3<>S+ 0 0 0 -4,-1.4 5,-0.9 2,-0.2 -1,-0.3 0.788 104.9 46.7 -79.3 -32.8 -8.3 -27.9 53.4 70 196 A R H X<5S+ 0 0 114 -4,-0.9 3,-2.0 -3,-0.9 -2,-0.2 0.902 108.6 54.8 -73.5 -42.1 -6.7 -24.5 54.2 71 197 A E T 3<5S+ 0 0 179 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.677 102.4 59.1 -63.8 -16.9 -3.2 -26.0 53.8 72 198 A L T 3 5S- 0 0 45 -4,-0.3 -1,-0.3 -5,-0.2 -2,-0.2 0.604 115.5-127.8 -84.1 -14.2 -4.5 -27.1 50.4 73 199 A G T < 5 + 0 0 60 -3,-2.0 2,-0.3 1,-0.2 -3,-0.2 0.933 53.4 143.1 72.6 52.9 -5.0 -23.4 49.8 74 200 A L < - 0 0 17 -5,-0.9 -1,-0.2 1,-0.2 5,-0.1 -0.872 51.1 -81.8-122.4 163.1 -8.6 -22.8 48.7 75 201 A S > - 0 0 75 -2,-0.3 4,-1.8 1,-0.1 -1,-0.2 0.264 34.5-109.1 -67.6-180.0 -11.0 -20.0 49.6 76 202 A E H > S+ 0 0 107 2,-0.2 4,-0.6 1,-0.2 5,-0.1 0.830 114.2 45.1 -80.8 -35.3 -13.2 -19.5 52.7 77 203 A E H > S+ 0 0 117 2,-0.2 4,-2.5 3,-0.2 3,-0.3 0.895 112.4 54.7 -73.4 -39.7 -16.7 -20.1 51.2 78 204 A K H 4 S+ 0 0 51 1,-0.2 5,-0.3 2,-0.2 -2,-0.2 0.961 110.2 44.8 -50.7 -60.6 -15.4 -23.2 49.4 79 205 A I H < S+ 0 0 4 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.610 108.7 56.6 -64.6 -16.5 -14.0 -24.7 52.7 80 206 A K H < S+ 0 0 137 -4,-0.6 4,-0.4 -3,-0.3 3,-0.3 0.830 111.2 52.0 -80.8 -35.4 -17.3 -23.8 54.5 81 207 A K S < S+ 0 0 83 -4,-2.5 2,-1.1 1,-0.2 -3,-0.0 -0.205 99.2 48.2 -72.6-177.6 -18.8 -25.8 51.7 82 208 A I S > S+ 0 0 0 1,-0.2 4,-0.7 -2,-0.1 -1,-0.2 0.066 104.5 69.4 67.5 -27.2 -17.3 -29.3 51.3 83 209 A L H > S+ 0 0 45 -2,-1.1 4,-0.8 -5,-0.3 -1,-0.2 0.723 106.8 34.1 -90.3 -26.5 -17.7 -29.6 55.1 84 210 A E H > S+ 0 0 61 -4,-0.4 4,-1.8 2,-0.2 5,-0.1 0.855 119.5 50.2 -81.8 -57.0 -21.5 -29.7 54.9 85 211 A A H 4 S+ 0 0 13 1,-0.2 -45,-0.2 2,-0.2 -2,-0.2 0.832 111.9 55.0 -49.5 -34.2 -21.6 -31.6 51.6 86 212 A K H >< S+ 0 0 45 -4,-0.7 3,-1.2 2,-0.2 -1,-0.2 0.968 109.4 36.0 -67.3 -58.6 -19.1 -34.1 53.2 87 213 A E H 3< S+ 0 0 126 -4,-0.8 -2,-0.2 1,-0.3 -1,-0.1 0.839 125.0 44.2 -71.1 -29.0 -20.6 -35.4 56.4 88 214 A K T 3< S+ 0 0 137 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.269 88.4 135.9 -93.6 7.6 -24.1 -35.3 54.8 89 215 A T < - 0 0 25 -3,-1.2 -3,-0.1 -5,-0.1 -4,-0.0 -0.082 52.0-147.3 -64.2 159.2 -23.1 -36.9 51.4 90 216 A M + 0 0 152 -5,-0.1 -1,-0.1 2,-0.0 -52,-0.1 0.364 59.8 121.0-100.6 3.5 -25.0 -39.6 49.6 91 217 A G - 0 0 13 -54,-0.2 -54,-0.2 1,-0.1 -55,-0.1 -0.306 69.7 -97.2 -70.3 150.3 -21.8 -41.2 48.1 92 218 A A - 0 0 31 -56,-1.9 -1,-0.1 -57,-0.1 2,-0.1 -0.205 39.6-103.5 -66.8 154.5 -20.9 -44.8 48.7 93 219 A W - 0 0 126 -33,-0.0 2,-0.4 -55,-0.0 281,-0.2 -0.415 33.5-150.3 -71.7 151.1 -18.4 -45.8 51.4 94 220 A M - 0 0 1 -57,-0.1 -33,-0.1 -2,-0.1 278,-0.0 -0.991 3.8-139.9-128.9 132.6 -14.9 -46.7 50.3 95 221 A D > - 0 0 60 -2,-0.4 4,-1.5 1,-0.1 5,-0.2 -0.076 37.1 -97.8 -70.4-179.9 -12.5 -49.1 52.0 96 222 A Q H > S+ 0 0 154 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.922 125.6 48.8 -64.1 -44.0 -8.7 -48.4 52.3 97 223 A T H > S+ 0 0 53 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.875 109.2 53.6 -66.6 -35.4 -8.0 -50.6 49.2 98 224 A D H > S+ 0 0 0 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.868 114.4 38.8 -67.5 -43.6 -10.7 -48.9 47.2 99 225 A I H X S+ 0 0 4 -4,-1.5 4,-2.2 2,-0.2 -1,-0.2 0.708 106.3 66.2 -81.0 -26.8 -9.5 -45.3 47.7 100 226 A E H X S+ 0 0 80 -4,-1.9 4,-1.5 1,-0.2 -2,-0.2 0.896 102.5 47.3 -62.7 -35.8 -5.8 -46.2 47.5 101 227 A V H X S+ 0 0 9 -4,-1.2 4,-1.4 2,-0.2 -1,-0.2 0.890 111.1 49.4 -79.6 -33.1 -6.1 -47.1 43.9 102 228 A V H X S+ 0 0 0 -4,-0.9 4,-1.4 1,-0.2 -1,-0.2 0.889 109.8 52.3 -69.0 -35.9 -8.0 -44.0 42.9 103 229 A R H X S+ 0 0 64 -4,-2.2 4,-1.5 1,-0.2 -2,-0.2 0.833 103.4 58.9 -65.2 -30.8 -5.4 -41.8 44.7 104 230 A Q H X S+ 0 0 36 -4,-1.5 4,-1.8 1,-0.2 3,-0.2 0.908 103.2 52.2 -60.8 -42.2 -2.7 -43.6 42.7 105 231 A L H X S+ 0 0 2 -4,-1.4 4,-2.4 1,-0.2 -1,-0.2 0.880 109.7 49.1 -59.4 -37.5 -4.5 -42.3 39.6 106 232 A A H X S+ 0 0 0 -4,-1.4 4,-1.2 2,-0.2 -1,-0.2 0.713 107.2 53.6 -79.5 -21.0 -4.4 -38.8 41.0 107 233 A E H X S+ 0 0 50 -4,-1.5 4,-1.9 -3,-0.2 -1,-0.2 0.814 110.1 51.4 -76.3 -31.0 -0.7 -39.0 41.9 108 234 A E H X S+ 0 0 9 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.980 105.7 50.3 -67.1 -57.5 -0.2 -40.0 38.3 109 235 A I H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.901 108.4 56.7 -50.2 -41.2 -2.1 -37.2 36.7 110 236 A D H X S+ 0 0 42 -4,-1.2 4,-2.1 2,-0.2 5,-0.3 0.955 103.4 51.1 -55.9 -51.6 0.0 -34.9 39.0 111 237 A R H >X S+ 0 0 84 -4,-1.9 4,-1.6 1,-0.2 3,-0.5 0.959 109.4 54.4 -47.6 -48.8 3.3 -36.3 37.5 112 238 A L H 3X S+ 0 0 0 -4,-2.4 4,-1.8 1,-0.3 -2,-0.2 0.865 104.4 51.8 -54.6 -42.2 1.6 -35.5 34.2 113 239 A Y H 3X S+ 0 0 55 -4,-2.3 4,-1.8 -3,-0.2 -1,-0.3 0.876 110.6 49.0 -59.7 -38.2 1.0 -31.8 35.1 114 240 A Q H X S+ 0 0 3 -4,-2.3 4,-2.5 1,-0.2 3,-2.1 0.945 100.8 61.0 -71.7 -45.4 14.4 -23.7 22.9 127 253 A M H 3X S+ 0 0 0 -4,-3.6 4,-2.0 1,-0.3 8,-0.2 0.832 95.1 65.3 -46.6 -35.7 12.5 -21.1 20.9 128 254 A D H 3< S+ 0 0 84 -4,-0.8 -1,-0.3 -5,-0.3 -2,-0.2 0.794 110.9 33.6 -62.8 -30.6 15.2 -18.7 22.0 129 255 A D H << S+ 0 0 89 -3,-2.1 -2,-0.2 -4,-0.5 -1,-0.2 0.876 125.7 42.4 -83.7 -45.9 17.8 -20.5 20.1 130 256 A V H < S- 0 0 16 -4,-2.5 -3,-0.2 1,-0.2 -2,-0.2 0.954 134.9 -5.0 -70.9 -56.8 15.6 -21.6 17.2 131 257 A A X + 0 0 0 -4,-2.0 4,-2.6 -5,-0.2 5,-0.2 -0.487 59.7 169.4-143.9 73.4 13.4 -18.5 16.4 132 258 A P H > S+ 0 0 32 0, 0.0 4,-2.0 0, 0.0 -1,-0.1 0.876 84.0 46.2 -50.0 -45.8 13.9 -15.5 18.7 133 259 A N H > S+ 0 0 0 84,-0.2 4,-2.1 2,-0.2 5,-0.2 0.971 110.9 51.2 -65.7 -50.7 11.9 -13.1 16.5 134 260 A L H > S+ 0 0 0 83,-0.4 4,-1.7 1,-0.3 5,-0.4 0.908 111.2 50.7 -48.8 -47.2 9.0 -15.6 15.9 135 261 A K H X S+ 0 0 38 -4,-2.6 4,-2.5 -8,-0.2 -1,-0.3 0.902 107.5 53.0 -56.4 -46.0 8.8 -16.0 19.6 136 262 A A H < S+ 0 0 29 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.928 111.5 43.3 -61.8 -51.1 8.7 -12.2 20.3 137 263 A L H < S+ 0 0 9 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.983 135.2 10.3 -53.8 -65.8 5.8 -11.4 18.0 138 264 A V H < S- 0 0 18 -4,-1.7 4,-0.4 -5,-0.2 -2,-0.2 0.482 107.3-102.0-100.8 -5.7 3.5 -14.3 18.9 139 265 A G X - 0 0 31 -4,-2.5 4,-2.6 -5,-0.4 5,-0.2 0.070 38.3 -83.9 88.3 150.9 4.9 -16.1 22.0 140 266 A A H > S+ 0 0 10 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.862 122.1 52.1 -61.9 -41.1 6.9 -19.3 22.1 141 267 A K H > S+ 0 0 87 2,-0.2 4,-1.6 1,-0.2 3,-0.3 0.981 114.2 40.6 -63.0 -59.0 4.0 -21.7 22.1 142 268 A L H > S+ 0 0 14 -4,-0.4 4,-2.2 1,-0.2 3,-0.4 0.915 112.1 56.8 -54.3 -48.7 2.2 -20.3 19.1 143 269 A A H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.881 106.4 51.9 -52.6 -37.1 5.5 -19.9 17.2 144 270 A A H X S+ 0 0 0 -4,-2.1 4,-2.6 -3,-0.3 -1,-0.2 0.857 105.5 53.5 -69.9 -31.7 6.1 -23.6 17.8 145 271 A R H X S+ 0 0 42 -4,-1.6 4,-3.2 -3,-0.4 5,-0.2 0.936 108.8 50.7 -65.2 -43.7 2.7 -24.5 16.3 146 272 A L H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 6,-0.3 0.931 112.0 45.0 -54.7 -54.8 3.6 -22.5 13.2 147 273 A I H X>S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 5,-1.0 0.941 114.8 51.2 -54.9 -45.4 6.9 -24.2 12.7 148 274 A S H <5S+ 0 0 25 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.922 111.8 44.5 -60.2 -46.6 5.1 -27.5 13.4 149 275 A L H <5S+ 0 0 66 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.865 114.0 50.3 -66.6 -37.2 2.4 -26.9 10.8 150 276 A A H <5S- 0 0 17 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.892 114.5-117.4 -67.5 -37.2 4.9 -25.7 8.2 151 277 A G T <5S- 0 0 32 -4,-2.4 2,-0.2 -5,-0.2 -3,-0.2 0.288 76.6 -15.7 110.5 -6.8 7.0 -28.7 8.8 152 278 A G S > S+ 0 0 9 -2,-0.2 4,-2.0 2,-0.2 5,-0.2 0.935 125.7 49.3 -60.9 -49.0 11.7 -23.4 10.3 154 280 A R H >> S+ 0 0 77 1,-0.2 4,-1.0 2,-0.2 3,-0.5 0.956 110.9 49.4 -55.5 -51.8 13.1 -23.6 6.7 155 281 A E H >4 S+ 0 0 83 1,-0.3 3,-0.6 2,-0.2 -1,-0.2 0.887 113.7 47.0 -55.2 -39.5 9.7 -24.6 5.3 156 282 A L H >< S+ 0 0 2 -4,-2.0 3,-0.7 1,-0.2 -1,-0.3 0.762 108.7 54.7 -73.2 -29.3 8.1 -21.8 7.1 157 283 A A H << S+ 0 0 0 -4,-2.0 -1,-0.2 -3,-0.5 -2,-0.2 0.527 103.7 56.6 -83.4 -8.4 10.8 -19.3 6.0 158 284 A M T << S+ 0 0 21 -4,-1.0 -1,-0.2 -3,-0.6 -2,-0.2 0.371 91.5 106.1 -96.0 -1.3 10.1 -20.3 2.3 159 285 A M < - 0 0 24 -3,-0.7 2,-0.1 -5,-0.2 128,-0.1 -0.533 69.1-123.9 -90.1 150.5 6.4 -19.4 2.6 160 286 A P >> - 0 0 3 0, 0.0 4,-1.5 0, 0.0 3,-0.6 -0.452 33.4-113.3 -72.7 156.5 4.4 -16.5 1.3 161 287 A S H 3> S+ 0 0 24 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.886 115.1 64.1 -61.2 -39.4 2.5 -14.5 4.0 162 288 A S H 3> S+ 0 0 46 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.840 102.7 48.3 -54.2 -34.9 -0.8 -15.8 2.5 163 289 A T H X> S+ 0 0 48 -3,-0.6 3,-0.8 2,-0.2 4,-0.6 0.942 109.9 52.7 -69.2 -44.5 0.1 -19.3 3.4 164 290 A I H >< S+ 0 0 0 -4,-1.5 3,-0.7 1,-0.3 25,-0.3 0.838 101.1 58.8 -61.0 -37.3 1.1 -18.3 7.0 165 291 A Q H 3< S+ 0 0 30 -4,-2.2 22,-1.5 1,-0.2 -1,-0.3 0.831 115.2 38.0 -60.2 -33.1 -2.2 -16.5 7.7 166 292 A V H X< S+ 0 0 14 -3,-0.8 3,-2.4 -4,-0.7 -1,-0.2 0.366 77.3 130.4-102.2 1.6 -4.0 -19.9 7.0 167 293 A L T << S+ 0 0 7 -3,-0.7 21,-2.1 -4,-0.6 22,-0.4 -0.425 80.0 27.1 -55.4 125.9 -1.6 -22.5 8.5 168 294 A G T 3 S+ 0 0 36 19,-0.3 -1,-0.3 -2,-0.1 3,-0.2 0.146 103.0 83.1 104.1 -20.6 -3.8 -24.7 10.7 169 295 A A <> + 0 0 16 -3,-2.4 4,-2.0 1,-0.2 3,-0.3 -0.122 53.2 139.8 -94.1 20.9 -7.0 -24.0 8.6 170 296 A E H > + 0 0 57 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.833 67.1 44.8 -42.8 -46.0 -5.8 -26.7 6.2 171 297 A K H > S+ 0 0 168 -3,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.916 113.5 48.2 -68.6 -43.1 -9.3 -28.2 5.6 172 298 A A H > S+ 0 0 24 -3,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.805 113.0 50.2 -67.0 -29.8 -11.2 -24.9 5.1 173 299 A L H X S+ 0 0 39 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.914 112.6 44.6 -74.3 -46.2 -8.5 -23.8 2.7 174 300 A F H X S+ 0 0 97 -4,-2.1 4,-2.7 -5,-0.3 5,-0.2 0.921 112.3 52.4 -64.2 -42.1 -8.6 -26.9 0.6 175 301 A R H X>S+ 0 0 124 -4,-2.8 4,-2.1 1,-0.2 5,-0.8 0.928 111.7 46.2 -63.7 -43.4 -12.3 -26.9 0.6 176 302 A H H <5S+ 0 0 51 -4,-2.0 4,-0.4 4,-0.2 -1,-0.2 0.840 113.8 50.1 -56.3 -38.7 -12.2 -23.2 -0.6 177 303 A L H <5S+ 0 0 113 -4,-2.1 -2,-0.2 2,-0.1 -1,-0.2 0.829 117.8 38.1 -73.2 -32.6 -9.6 -24.2 -3.2 178 304 A R H <5S+ 0 0 188 -4,-2.7 -2,-0.2 -5,-0.1 -3,-0.2 0.960 132.4 19.7 -80.8 -62.4 -11.6 -27.2 -4.5 179 305 A T T <5S- 0 0 107 -4,-2.1 -3,-0.2 -5,-0.2 -2,-0.1 0.841 100.6-115.1 -80.3 -36.0 -15.3 -26.0 -4.5 180 306 A G < + 0 0 59 -5,-0.8 -4,-0.2 -4,-0.4 -3,-0.1 0.435 58.9 153.5 108.4 3.5 -14.8 -22.2 -4.4 181 307 A A - 0 0 33 -6,-0.6 -1,-0.2 1,-0.2 -2,-0.0 -0.167 58.6 -68.7 -63.0 157.1 -16.3 -21.6 -0.9 182 308 A K - 0 0 182 1,-0.1 -1,-0.2 -7,-0.0 -6,-0.1 -0.216 58.9-119.3 -55.4 132.7 -15.2 -18.6 1.2 183 309 A P - 0 0 71 0, 0.0 2,-0.2 0, 0.0 -10,-0.1 -0.164 25.5 -98.9 -70.2 158.7 -11.6 -18.9 2.4 184 310 A P - 0 0 25 0, 0.0 3,-0.1 0, 0.0 -15,-0.1 -0.594 20.3-154.1 -75.9 146.0 -10.5 -19.0 6.0 185 311 A K S S+ 0 0 103 1,-0.2 2,-0.3 -2,-0.2 23,-0.0 0.490 76.0 14.9 -91.6 -12.6 -9.2 -15.7 7.3 186 312 A H - 0 0 38 -20,-0.1 -20,-0.2 21,-0.1 -1,-0.2 -0.981 50.4-171.1-159.8 151.0 -7.0 -17.4 9.9 187 313 A G S > S- 0 0 11 -22,-1.5 3,-2.3 -2,-0.3 -19,-0.3 -0.002 80.6 -26.9-105.4-139.7 -5.4 -20.7 11.1 188 314 A V G > S+ 0 0 26 -21,-2.1 3,-2.2 1,-0.3 4,-0.2 0.747 123.3 79.0 -45.5 -32.6 -3.6 -21.1 14.4 189 315 A I G > + 0 0 0 -22,-0.4 3,-2.4 -25,-0.3 -1,-0.3 0.715 69.4 90.1 -59.1 -11.4 -2.8 -17.4 14.5 190 316 A Y G < S+ 0 0 84 -3,-2.3 6,-1.0 1,-0.3 -1,-0.3 0.791 77.1 62.6 -52.5 -29.7 -6.4 -17.1 15.6 191 317 A Q G < S+ 0 0 102 -3,-2.2 -1,-0.3 4,-0.1 -2,-0.2 0.703 70.6 113.8 -69.3 -21.9 -5.0 -17.4 19.2 192 318 A Y S X> S- 0 0 24 -3,-2.4 3,-2.0 -4,-0.2 4,-1.3 -0.355 76.5-128.6 -51.3 126.3 -3.0 -14.3 18.9 193 319 A P H 3> S+ 0 0 75 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.899 104.3 58.1 -48.9 -49.5 -4.8 -12.1 21.5 194 320 A A H 34 S+ 0 0 24 1,-0.2 -2,-0.1 2,-0.2 12,-0.1 0.688 112.2 43.8 -59.9 -18.8 -5.3 -9.1 19.2 195 321 A I H X4 S+ 0 0 0 -3,-2.0 3,-2.4 -6,-0.2 -1,-0.2 0.928 114.4 39.9 -83.9 -70.1 -7.2 -11.4 16.8 196 322 A N H 3< S+ 0 0 62 -4,-1.3 -2,-0.2 -6,-1.0 -5,-0.1 0.633 119.9 45.9 -61.5 -22.5 -9.6 -13.6 18.8 197 323 A R T 3< S+ 0 0 192 -4,-2.0 -1,-0.3 -5,-0.3 -3,-0.1 0.257 95.3 97.2 -97.9 11.3 -10.6 -10.8 21.2 198 324 A S S < S- 0 0 9 -3,-2.4 5,-0.1 -5,-0.2 -3,-0.0 -0.644 91.3 -73.8-106.2 157.3 -11.2 -8.1 18.6 199 325 A P > - 0 0 59 0, 0.0 3,-1.8 0, 0.0 4,-0.3 -0.154 47.3-123.3 -45.1 137.1 -14.4 -6.9 16.9 200 326 A W G > S+ 0 0 183 1,-0.3 3,-1.2 2,-0.2 4,-0.4 0.832 106.7 63.8 -61.2 -30.3 -15.3 -9.6 14.4 201 327 A W G 3 S+ 0 0 142 1,-0.2 -1,-0.3 2,-0.1 4,-0.1 0.622 104.8 45.0 -73.0 -13.6 -15.3 -7.2 11.5 202 328 A Q G <> S+ 0 0 4 -3,-1.8 4,-1.4 -7,-0.1 -1,-0.2 0.371 83.8 96.2-103.9 4.0 -11.6 -6.4 11.9 203 329 A R H <> S+ 0 0 54 -3,-1.2 4,-2.6 -4,-0.3 5,-0.2 0.891 81.3 51.4 -66.9 -41.3 -10.2 -10.0 12.3 204 330 A G H > S+ 0 0 13 -4,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.836 110.7 50.4 -62.0 -32.5 -9.3 -10.7 8.7 205 331 A K H > S+ 0 0 52 -3,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.804 111.9 45.4 -79.7 -31.0 -7.3 -7.5 8.5 206 332 A I H X S+ 0 0 0 -4,-1.4 4,-2.5 2,-0.2 5,-0.2 0.866 112.2 53.1 -77.8 -38.1 -5.4 -8.1 11.7 207 333 A A H X S+ 0 0 0 -4,-2.6 4,-3.1 1,-0.2 5,-0.3 0.953 110.3 46.5 -55.0 -50.8 -4.7 -11.7 10.6 208 334 A R H X S+ 0 0 145 -4,-2.0 4,-1.1 1,-0.2 -1,-0.2 0.754 112.6 51.6 -71.2 -19.5 -3.3 -10.4 7.2 209 335 A A H X S+ 0 0 6 -4,-0.7 4,-1.4 2,-0.2 -1,-0.2 0.894 113.1 43.6 -78.2 -42.8 -1.2 -7.9 9.1 210 336 A L H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.911 110.3 54.2 -71.5 -45.3 0.2 -10.4 11.5 211 337 A A H X S+ 0 0 1 -4,-3.1 4,-2.0 1,-0.2 5,-0.2 0.929 105.7 56.6 -53.5 -45.4 0.9 -13.0 8.7 212 338 A G H X S+ 0 0 14 -4,-1.1 4,-1.3 -5,-0.3 -1,-0.2 0.935 111.4 40.9 -49.9 -51.6 2.8 -10.3 7.0 213 339 A K H X S+ 0 0 14 -4,-1.4 4,-2.2 1,-0.2 -1,-0.2 0.805 110.5 56.4 -72.7 -31.8 5.1 -9.8 9.9 214 340 A L H X S+ 0 0 2 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.844 103.0 55.8 -68.8 -33.3 5.5 -13.4 10.8 215 341 A A H X S+ 0 0 1 -4,-2.0 4,-1.7 -5,-0.2 -1,-0.2 0.936 112.0 42.5 -66.6 -42.3 6.8 -14.2 7.3 216 342 A I H X S+ 0 0 25 -4,-1.3 4,-1.8 -5,-0.2 -2,-0.2 0.877 113.5 52.8 -68.4 -37.6 9.5 -11.6 7.7 217 343 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -83,-0.4 0.872 109.1 49.4 -66.1 -37.6 10.2 -12.7 11.3 218 344 A A H X S+ 0 0 0 -4,-2.4 4,-1.8 2,-0.2 5,-0.2 0.873 108.3 53.1 -72.2 -36.1 10.7 -16.3 10.2 219 345 A R H X S+ 0 0 3 -4,-1.7 4,-2.4 -5,-0.2 5,-0.3 0.886 110.6 47.8 -64.6 -38.0 13.1 -15.3 7.3 220 346 A V H X>S+ 0 0 0 -4,-1.8 5,-2.1 2,-0.2 4,-1.8 0.941 110.5 50.0 -68.8 -45.5 15.2 -13.4 9.7 221 347 A D H <5S+ 0 0 13 -4,-2.1 -1,-0.2 3,-0.2 -2,-0.2 0.873 120.0 37.5 -57.6 -38.9 15.4 -16.2 12.4 222 348 A Y H <5S+ 0 0 63 -4,-1.8 -2,-0.2 -5,-0.1 -1,-0.2 0.910 122.0 38.2 -82.5 -44.9 16.4 -18.8 9.7 223 349 A F H <5S- 0 0 63 -4,-2.4 -3,-0.2 -5,-0.2 -2,-0.2 0.650 135.6 -1.4 -86.2 -16.4 18.7 -16.8 7.4 224 350 A S T <5 - 0 0 54 -4,-1.8 -3,-0.2 -5,-0.3 -4,-0.1 0.609 65.7-133.7-135.4 -60.5 20.6 -14.7 9.9 225 351 A G < + 0 0 53 -5,-2.1 -4,-0.2 1,-0.4 -5,-0.1 0.436 58.3 145.7 93.2 4.3 19.8 -14.9 13.6 226 352 A E - 0 0 81 -6,-0.4 2,-0.6 1,-0.1 -1,-0.4 -0.313 50.6-124.1 -58.5 151.4 19.9 -11.1 13.5 227 353 A Y + 0 0 128 1,-0.1 3,-0.2 -3,-0.1 -1,-0.1 -0.852 49.0 146.1-118.2 103.8 17.3 -9.7 15.9 228 354 A I > + 0 0 16 -2,-0.6 4,-1.9 1,-0.1 3,-0.4 0.198 33.4 114.7-106.8 5.8 14.7 -7.3 14.6 229 355 A A H > + 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.1 0.685 67.9 63.5 -67.6 -18.9 11.6 -8.1 16.7 230 356 A E H > S+ 0 0 94 2,-0.2 4,-1.7 3,-0.2 -1,-0.2 0.964 110.7 36.8 -63.8 -52.4 11.3 -4.7 18.5 231 357 A E H > S+ 0 0 98 -3,-0.4 4,-3.4 2,-0.2 5,-0.3 0.920 117.8 52.9 -64.7 -41.8 10.7 -2.7 15.2 232 358 A L H X S+ 0 0 3 -4,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.898 108.4 50.0 -63.4 -38.3 8.6 -5.6 13.9 233 359 A K H X S+ 0 0 54 -4,-2.2 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311 66 B H T 3> S+ 0 0 0 -4,-0.3 4,-2.0 -3,-0.2 -1,-0.3 0.572 89.2 77.0 -93.5 -10.2 14.8 -17.1 0.3 312 67 B L H <> S+ 0 0 0 -3,-1.6 4,-1.5 2,-0.2 -2,-0.2 0.863 89.5 51.8 -69.1 -42.4 14.4 -16.1 -3.4 313 68 B P H > S+ 0 0 3 0, 0.0 4,-1.6 0, 0.0 3,-0.4 0.983 114.9 40.9 -59.3 -52.3 17.9 -17.2 -4.5 314 69 B P H >> S+ 0 0 29 0, 0.0 4,-1.2 0, 0.0 3,-0.6 0.949 115.8 50.4 -60.7 -47.7 17.7 -20.8 -3.1 315 70 B L H 3X S+ 0 0 7 -4,-2.0 4,-1.2 1,-0.2 6,-0.2 0.793 110.0 52.2 -59.9 -27.5 14.1 -21.2 -4.1 316 71 B C H 3< S+ 0 0 0 -4,-1.5 4,-0.3 -3,-0.4 -1,-0.2 0.778 104.5 54.4 -79.6 -29.0 15.1 -20.0 -7.7 317 72 B E H << S+ 0 0 94 -4,-1.6 -2,-0.2 -3,-0.6 -1,-0.2 0.711 107.5 51.5 -78.3 -22.3 17.9 -22.6 -8.0 318 73 B E H < S+ 0 0 119 -4,-1.2 -2,-0.2 -5,-0.2 -1,-0.2 0.834 117.1 37.0 -79.9 -37.3 15.5 -25.4 -7.2 319 74 B K S < S- 0 0 74 -4,-1.2 -2,-0.2 -5,-0.2 -1,-0.2 0.400 107.4-128.4 -90.6 2.1 13.0 -24.4 -9.8 320 75 B E + 0 0 144 -4,-0.3 -3,-0.2 1,-0.2 -4,-0.1 0.328 54.5 151.8 72.0 -9.2 15.8 -23.4 -12.2 321 76 B I - 0 0 11 -5,-0.2 -1,-0.2 -6,-0.2 2,-0.2 -0.290 47.2-118.1 -57.4 133.0 14.2 -19.9 -12.8 322 77 B P - 0 0 26 0, 0.0 -25,-1.6 0, 0.0 2,-0.3 -0.503 34.0-171.3 -74.4 140.7 16.8 -17.2 -13.6 323 78 B Y E -c 297 0A 1 -27,-0.2 2,-0.3 -2,-0.2 -25,-0.2 -0.950 7.8-175.8-135.1 157.8 17.2 -14.3 -11.2 324 79 B I E -c 298 0A 0 -27,-1.9 -25,-2.2 -2,-0.3 2,-0.4 -0.969 20.9-119.3-149.6 156.5 19.0 -11.0 -11.2 325 80 B Y E -c 299 0A 1 -2,-0.3 -25,-0.2 -27,-0.2 -60,-0.1 -0.845 15.4-168.2-106.2 136.4 19.7 -8.0 -8.9 326 81 B V E -c 300 0A 0 -27,-1.3 -25,-1.6 -2,-0.4 -24,-0.3 -0.904 27.7-126.9-114.9 152.0 18.8 -4.3 -9.5 327 82 B P S S+ 0 0 62 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.755 84.7 50.1 -73.5 -25.1 20.3 -1.7 -7.2 328 83 B S > - 0 0 26 -27,-0.1 4,-2.4 1,-0.1 5,-0.1 -0.958 50.3-163.7-128.2 127.8 17.1 0.1 -6.0 329 84 B K H > S+ 0 0 73 -2,-0.4 13,-2.0 2,-0.2 4,-1.7 0.810 99.0 52.7 -72.4 -30.6 13.7 -1.1 -4.6 330 85 B K H > S+ 0 0 102 11,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.899 111.5 47.2 -68.6 -39.4 12.1 2.3 -5.4 331 86 B E H > S+ 0 0 105 2,-0.2 4,-3.3 1,-0.2 5,-0.2 0.969 111.8 48.8 -64.1 -54.9 13.3 2.1 -9.0 332 87 B L H X S+ 0 0 0 -4,-2.4 4,-0.9 1,-0.2 -1,-0.2 0.852 110.3 54.9 -50.4 -38.9 12.1 -1.5 -9.3 333 88 B G H ><>S+ 0 0 0 -4,-1.7 5,-1.5 2,-0.2 3,-0.6 0.944 111.2 41.3 -63.6 -51.7 8.8 -0.4 -7.8 334 89 B A H ><5S+ 0 0 50 -4,-2.4 3,-2.5 1,-0.2 -2,-0.2 0.920 108.6 60.0 -61.1 -44.8 8.2 2.4 -10.4 335 90 B A H 3<5S+ 0 0 5 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.769 106.7 50.2 -55.6 -22.9 9.5 0.1 -13.2 336 91 B A T <<5S- 0 0 2 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.476 123.6-106.5 -95.7 -3.9 6.6 -2.1 -12.2 337 92 B G T < 5S+ 0 0 40 -3,-2.5 2,-0.3 1,-0.3 -3,-0.2 0.832 76.3 120.5 85.7 34.3 4.0 0.7 -12.2 338 93 B I < - 0 0 39 -5,-1.5 -1,-0.3 2,-0.2 -2,-0.2 -0.956 62.8-132.2-129.3 151.8 3.4 1.4 -8.6 339 94 B E S S+ 0 0 173 -2,-0.3 -5,-0.1 2,-0.1 -1,-0.1 0.828 91.1 52.7 -71.8 -31.6 3.8 4.5 -6.5 340 95 B V S S- 0 0 104 1,-0.2 -2,-0.2 -7,-0.1 2,-0.1 -0.201 96.4 -82.3 -92.8-173.0 5.6 2.6 -3.6 341 96 B A - 0 0 46 -8,-0.1 2,-0.3 -2,-0.1 -11,-0.2 -0.352 28.1-149.8 -90.6 171.2 8.6 0.4 -3.7 342 97 B A - 0 0 5 -13,-2.0 -42,-0.2 1,-0.1 -9,-0.1 -0.965 9.3-159.6-142.4 121.9 9.0 -3.4 -4.5 343 98 B A S S+ 0 0 21 -2,-0.3 -43,-2.2 1,-0.2 2,-0.3 0.805 82.7 0.3 -73.0 -27.0 11.6 -5.7 -3.0 344 99 B S E - B 0 299A 0 -45,-0.2 -63,-1.7 -15,-0.1 2,-0.3 -0.984 60.3-167.0-155.3 161.7 11.2 -8.2 -5.9 345 100 B V E -AB 280 298A 0 -47,-2.2 -47,-2.9 -2,-0.3 2,-0.4 -0.990 7.0-156.2-148.1 143.7 9.2 -8.7 -9.1 346 101 B A E -AB 279 297A 0 -67,-2.2 -67,-2.7 -2,-0.3 2,-0.6 -0.989 13.8-138.3-126.1 134.7 8.7 -11.6 -11.3 347 102 B I E -AB 278 296A 0 -51,-2.6 -52,-3.0 -2,-0.4 -51,-1.1 -0.841 18.4-177.8 -89.4 120.5 7.7 -11.6 -15.0 348 103 B I E S+ 0 0 30 -71,-2.2 -1,-0.2 -2,-0.6 -70,-0.2 0.971 79.0 10.6 -78.7 -68.7 5.1 -14.2 -15.7 349 104 B E E S-A 277 0A 109 -72,-1.3 -72,-2.1 -77,-0.2 -1,-0.3 -0.974 71.3-149.8-113.9 119.7 4.8 -13.7 -19.5 350 105 B P > - 0 0 18 0, 0.0 3,-1.3 0, 0.0 2,-0.3 0.707 24.9-172.4 -57.1 -27.4 7.4 -11.4 -21.0 351 106 B G G > S- 0 0 6 1,-0.2 3,-0.9 2,-0.2 -75,-0.2 -0.501 72.0 -7.0 64.7-124.0 5.1 -10.1 -23.8 352 107 B K G 3 S+ 0 0 162 -2,-0.3 -1,-0.2 -81,-0.3 3,-0.1 0.330 132.8 68.8 -88.3 8.4 7.0 -7.9 -26.2 353 108 B A G X> + 0 0 1 -3,-1.3 4,-1.7 1,-0.1 3,-0.6 0.375 58.7 108.7-100.9 -2.7 10.1 -8.2 -23.9 354 109 B R H <> S+ 0 0 153 -3,-0.9 4,-2.5 1,-0.3 5,-0.2 0.811 73.9 63.3 -52.6 -34.7 11.0 -11.9 -24.3 355 110 B D H 3> S+ 0 0 108 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.966 105.7 43.4 -48.8 -61.9 14.1 -10.9 -26.3 356 111 B L H <> S+ 0 0 24 -3,-0.6 4,-1.8 1,-0.2 -1,-0.2 0.883 111.0 57.0 -52.3 -42.7 15.6 -9.1 -23.3 357 112 B V H >X S+ 0 0 17 -4,-1.7 4,-2.3 1,-0.2 3,-0.6 0.966 105.2 49.5 -56.3 -57.4 14.5 -12.0 -20.9 358 113 B E H 3X S+ 0 0 133 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.864 113.3 45.5 -49.1 -46.1 16.5 -14.6 -22.9 359 114 B E H 3X S+ 0 0 82 -4,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.739 109.1 55.6 -76.0 -24.8 19.7 -12.6 -23.0 360 115 B I H > + 0 0 18 -281,-0.2 4,-1.6 -3,-0.1 3,-1.0 0.354 65.5 94.0-101.2 -1.1 -21.1 -49.8 45.5 375 131 C R H 3> S+ 0 0 26 -4,-0.3 4,-1.6 1,-0.3 125,-0.1 0.773 79.7 57.4 -62.5 -25.8 -17.9 -51.9 45.1 376 132 C D H 3> S+ 0 0 18 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.793 102.9 54.5 -72.8 -30.0 -19.0 -53.1 41.7 377 133 C K H <> S+ 0 0 77 -3,-1.0 4,-2.2 2,-0.2 -2,-0.2 0.933 107.9 48.2 -69.0 -44.6 -19.3 -49.6 40.5 378 134 C M H X S+ 0 0 1 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.875 108.9 54.6 -61.9 -38.7 -15.7 -48.9 41.5 379 135 C V H X S+ 0 0 0 -4,-1.6 4,-2.2 2,-0.2 3,-0.2 0.959 107.4 50.0 -59.0 -50.6 -14.6 -52.1 39.8 380 136 C I H X S+ 0 0 11 -4,-2.2 4,-2.5 1,-0.2 5,-0.3 0.924 109.4 51.8 -47.9 -51.1 -16.2 -50.8 36.6 381 137 C Q H X S+ 0 0 9 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.853 109.8 50.6 -56.9 -36.5 -14.4 -47.5 37.0 382 138 C A H X S+ 0 0 0 -4,-1.9 4,-2.1 -3,-0.2 -1,-0.2 0.869 109.4 47.6 -74.9 -38.2 -11.1 -49.3 37.3 383 139 C I H X S+ 0 0 2 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.900 114.7 46.8 -69.6 -43.4 -11.5 -51.5 34.2 384 140 C E H X S+ 0 0 54 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.890 111.4 53.8 -59.6 -40.6 -12.5 -48.4 32.2 385 141 C A H X S+ 0 0 0 -4,-2.1 4,-3.3 -5,-0.3 -2,-0.2 0.899 104.4 54.4 -58.3 -43.6 -9.5 -46.8 33.9 386 142 C L H X S+ 0 0 2 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.911 110.8 45.0 -58.8 -43.6 -7.3 -49.6 32.7 387 143 C D H X S+ 0 0 57 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.881 112.6 50.3 -69.9 -40.9 -8.4 -49.1 29.1 388 144 C D H X S+ 0 0 17 -4,-2.5 4,-1.7 2,-0.2 3,-0.2 0.963 111.3 49.3 -58.6 -52.8 -8.0 -45.4 29.3 389 145 C V H X S+ 0 0 0 -4,-3.3 4,-2.3 1,-0.2 -2,-0.2 0.913 107.2 55.7 -53.8 -45.6 -4.5 -45.8 30.7 390 146 C D H X S+ 0 0 46 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.919 105.3 53.8 -49.7 -47.6 -3.7 -48.3 27.8 391 147 C K H X S+ 0 0 104 -4,-1.9 4,-1.4 -3,-0.2 -1,-0.2 0.887 109.4 45.5 -56.2 -45.5 -4.7 -45.5 25.3 392 148 C V H X S+ 0 0 1 -4,-1.7 4,-3.2 1,-0.2 5,-0.3 0.862 109.6 54.8 -74.4 -32.9 -2.3 -42.9 26.7 393 149 C I H X S+ 0 0 1 -4,-2.3 4,-2.8 -5,-0.2 5,-0.3 0.934 109.0 48.1 -61.0 -42.9 0.5 -45.3 27.0 394 150 C N H X S+ 0 0 94 -4,-2.2 4,-1.3 -5,-0.2 -1,-0.2 0.829 115.9 46.2 -66.6 -29.1 0.1 -46.2 23.3 395 151 C L H X S+ 0 0 50 -4,-1.4 4,-1.7 2,-0.2 -2,-0.2 0.865 114.9 42.8 -79.5 -47.1 -0.0 -42.5 22.5 396 152 C L H X S+ 0 0 2 -4,-3.2 4,-2.9 2,-0.2 5,-0.2 0.920 112.6 54.6 -68.7 -41.9 3.0 -41.3 24.7 397 153 C V H X S+ 0 0 2 -4,-2.8 4,-2.3 -5,-0.3 5,-0.2 0.931 106.6 51.3 -56.0 -48.0 5.1 -44.3 23.5 398 154 C A H X S+ 0 0 52 -4,-1.3 4,-2.6 -5,-0.3 -1,-0.2 0.920 112.3 46.0 -55.0 -47.7 4.5 -43.3 19.9 399 155 C R H X S+ 0 0 19 -4,-1.7 4,-2.4 1,-0.2 5,-0.2 0.919 110.2 54.6 -59.0 -46.2 5.6 -39.8 20.6 400 156 C L H X S+ 0 0 0 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.849 111.3 45.4 -54.7 -39.9 8.6 -41.1 22.5 401 157 C R H X S+ 0 0 22 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.910 113.5 47.0 -73.8 -44.6 9.6 -43.2 19.5 402 158 C E H < S+ 0 0 96 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.871 117.8 44.6 -63.2 -34.7 9.1 -40.4 16.9 403 159 C W H >< S+ 0 0 0 -4,-2.4 3,-1.2 -5,-0.2 4,-0.5 0.892 113.1 44.7 -81.4 -43.3 11.0 -38.0 19.1 404 160 C Y H >X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.3 3,-0.8 0.766 100.7 73.4 -78.7 -19.1 14.0 -40.0 20.2 405 161 C S T 3< S+ 0 0 23 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.641 83.8 66.7 -61.4 -18.0 14.3 -41.2 16.6 406 162 C L T <4 S+ 0 0 42 -3,-1.2 56,-2.3 2,-0.2 -1,-0.2 0.883 111.2 34.9 -71.2 -35.5 15.6 -37.7 15.7 407 163 C H T <4 S+ 0 0 0 -3,-0.8 -2,-0.2 -4,-0.5 54,-0.2 0.805 139.9 13.2 -81.7 -37.2 18.7 -38.5 17.8 408 164 C F >< - 0 0 0 -4,-2.0 3,-0.5 1,-0.1 4,-0.4 -0.649 64.8-179.9-146.4 80.9 18.9 -42.3 17.0 409 165 C P T > S+ 0 0 48 0, 0.0 3,-0.7 0, 0.0 4,-0.3 0.763 77.2 53.7 -51.7 -37.1 16.7 -43.5 14.1 410 166 C E T >> S+ 0 0 48 1,-0.2 4,-1.4 2,-0.2 3,-0.9 0.829 85.8 76.0 -80.1 -31.7 17.6 -47.2 14.1 411 167 C L H <> S+ 0 0 0 -3,-0.5 4,-2.0 1,-0.2 -1,-0.2 0.758 85.5 72.6 -50.7 -25.1 16.8 -48.0 17.7 412 168 C D H <4 S+ 0 0 62 -3,-0.7 -1,-0.2 -4,-0.4 -2,-0.2 0.940 102.0 35.2 -56.5 -55.7 13.2 -48.0 16.7 413 169 C E H <4 S+ 0 0 115 -3,-0.9 -1,-0.2 -4,-0.3 -2,-0.2 0.877 114.4 59.6 -70.5 -38.1 13.1 -51.2 14.6 414 170 C L H < S+ 0 0 9 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.881 111.0 40.0 -53.0 -44.2 15.6 -52.9 17.0 415 171 C L < + 0 0 1 -4,-2.0 -1,-0.2 1,-0.2 6,-0.2 -0.638 61.9 158.6-115.6 76.8 13.3 -52.5 20.0 416 172 C P + 0 0 84 0, 0.0 2,-0.7 0, 0.0 -1,-0.2 0.666 55.4 90.1 -70.6 -16.4 9.7 -53.2 18.8 417 173 C K S >> S- 0 0 145 1,-0.2 4,-2.0 -3,-0.2 3,-1.1 -0.750 70.1-152.7 -89.6 114.6 8.7 -54.0 22.4 418 174 C H H 3> S+ 0 0 64 -2,-0.7 4,-3.1 1,-0.3 5,-0.4 0.914 91.2 55.3 -53.6 -55.5 7.6 -50.7 24.0 419 175 C P H 3> S+ 0 0 78 0, 0.0 4,-0.9 0, 0.0 -1,-0.3 0.787 113.7 45.1 -49.0 -30.9 8.4 -51.6 27.7 420 176 C Q H <> S+ 0 0 47 -3,-1.1 4,-1.5 2,-0.2 -2,-0.2 0.846 112.2 49.3 -81.0 -40.2 12.0 -52.2 26.5 421 177 C Y H X S+ 0 0 0 -4,-2.0 4,-2.2 -3,-0.3 5,-0.2 0.932 114.3 45.2 -64.0 -48.5 12.2 -49.1 24.3 422 178 C V H X S+ 0 0 4 -4,-3.1 4,-2.1 1,-0.2 -1,-0.2 0.837 111.3 53.8 -62.5 -36.4 11.0 -46.9 27.1 423 179 C A H X S+ 0 0 30 -4,-0.9 4,-1.8 -5,-0.4 5,-0.3 0.825 110.1 49.1 -70.4 -29.9 13.3 -48.6 29.6 424 180 C F H X>S+ 0 0 0 -4,-1.5 4,-3.6 2,-0.2 5,-0.6 0.995 111.2 44.9 -70.8 -67.7 16.2 -47.9 27.2 425 181 C V H <5S+ 0 0 0 -4,-2.2 4,-0.4 1,-0.2 -2,-0.2 0.856 114.7 51.9 -44.0 -48.1 15.6 -44.2 26.6 426 182 C K H <5S+ 0 0 57 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.953 122.5 25.1 -56.8 -58.0 14.9 -43.7 30.4 427 183 C T H <5S+ 0 0 81 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.784 133.4 34.2 -83.0 -30.6 18.1 -45.3 31.8 428 184 C V T <5S+ 0 0 2 -4,-3.6 2,-0.4 -5,-0.3 -3,-0.2 0.938 76.3 159.9 -88.6 -57.9 20.5 -44.9 28.8 429 185 C G < + 0 0 0 -5,-0.6 -1,-0.1 -4,-0.4 -2,-0.1 -0.606 50.9 43.4 76.3-124.4 19.5 -41.6 27.2 430 186 C H S > S- 0 0 18 -2,-0.4 3,-1.3 1,-0.1 4,-0.4 -0.233 83.7-117.9 -53.8 147.8 22.1 -40.0 24.9 431 187 C R G > S+ 0 0 35 1,-0.2 3,-1.4 2,-0.2 -1,-0.1 0.816 108.5 70.0 -53.2 -37.4 24.0 -42.3 22.5 432 188 C D G 3 S+ 0 0 123 1,-0.3 -1,-0.2 24,-0.0 -3,-0.1 0.766 91.9 59.3 -56.6 -27.0 27.3 -41.4 24.2 433 189 C N G < S+ 0 0 83 -3,-1.3 -1,-0.3 -5,-0.1 5,-0.3 0.672 83.9 98.5 -81.8 -19.2 26.3 -43.4 27.3 434 190 C I < + 0 0 11 -3,-1.4 2,-0.3 -4,-0.4 3,-0.1 -0.315 39.2 135.9 -63.8 151.3 25.8 -46.8 25.6 435 191 C N S > S- 0 0 66 1,-0.1 4,-1.2 0, 0.0 18,-0.0 -0.901 70.6 -76.9-168.6-177.4 28.4 -49.5 25.7 436 192 C E H > S+ 0 0 150 -2,-0.3 4,-0.9 1,-0.2 3,-0.5 0.930 122.6 60.5 -50.1 -47.5 28.5 -53.2 26.2 437 193 C E H >> S+ 0 0 128 1,-0.2 3,-1.6 2,-0.2 4,-1.1 0.927 104.8 40.3 -45.6 -71.4 28.2 -52.7 30.0 438 194 C V H 3> S+ 0 0 49 1,-0.3 4,-0.7 -5,-0.3 -1,-0.2 0.705 105.7 66.8 -61.5 -22.8 24.8 -50.8 30.4 439 195 C L H 3<>S+ 0 0 1 -4,-1.2 5,-1.2 -3,-0.5 -1,-0.3 0.742 101.0 46.5 -74.5 -24.9 23.0 -53.0 27.7 440 196 C R H X<5S+ 0 0 179 -3,-1.6 3,-1.6 -4,-0.9 -1,-0.2 0.872 106.3 56.2 -81.0 -41.3 23.2 -56.2 29.7 441 197 C E H 3<5S+ 0 0 146 -4,-1.1 -2,-0.2 1,-0.3 -1,-0.2 0.712 103.5 58.5 -60.8 -18.1 22.0 -54.6 33.0 442 198 C L T 3<5S- 0 0 39 -4,-0.7 -1,-0.3 2,-0.1 -2,-0.2 0.701 114.6-130.1 -77.9 -23.3 19.1 -53.6 30.8 443 199 C G T < 5 + 0 0 49 -3,-1.6 2,-0.3 1,-0.2 -3,-0.2 0.905 51.9 146.8 75.7 47.1 18.6 -57.3 30.2 444 200 C L < - 0 0 10 -5,-1.2 -1,-0.2 1,-0.1 -2,-0.1 -0.812 51.5 -92.5-112.1 156.0 18.4 -57.6 26.4 445 201 C S > - 0 0 61 -2,-0.3 4,-2.0 1,-0.1 -1,-0.1 -0.009 34.1-108.3 -69.5 175.9 19.7 -60.6 24.4 446 202 C E H > S+ 0 0 143 2,-0.2 4,-1.8 1,-0.2 5,-0.2 0.847 115.4 46.4 -80.2 -38.8 23.2 -60.8 22.9 447 203 C E H > S+ 0 0 67 2,-0.2 4,-2.0 1,-0.2 5,-0.3 0.973 111.6 53.4 -61.4 -54.8 22.3 -60.4 19.3 448 204 C K H > S+ 0 0 53 1,-0.2 4,-2.1 2,-0.2 5,-0.3 0.902 109.9 50.1 -49.1 -44.1 20.1 -57.5 20.1 449 205 C I H X S+ 0 0 29 -4,-2.0 4,-3.3 1,-0.2 5,-0.3 0.939 109.4 44.1 -64.9 -54.4 22.9 -55.7 22.0 450 206 C K H X S+ 0 0 117 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.875 114.6 52.2 -61.3 -34.2 25.8 -55.9 19.5 451 207 C K H X S+ 0 0 86 -4,-2.0 4,-2.8 2,-0.2 -1,-0.2 0.917 114.7 39.2 -70.7 -46.0 23.5 -54.9 16.7 452 208 C I H X S+ 0 0 0 -4,-2.1 4,-1.5 -5,-0.3 -2,-0.2 0.908 115.7 54.5 -62.7 -45.3 22.1 -51.8 18.4 453 209 C L H X S+ 0 0 44 -4,-3.3 4,-1.0 -5,-0.3 -2,-0.2 0.859 111.8 45.9 -57.4 -33.4 25.6 -51.2 19.7 454 210 C E H X S+ 0 0 98 -4,-1.9 4,-1.5 -5,-0.3 3,-0.4 0.977 106.7 54.4 -71.6 -53.4 26.7 -51.3 16.1 455 211 C A H < S+ 0 0 4 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.709 106.8 58.1 -54.7 -23.3 24.0 -49.1 14.6 456 212 C K H >< S+ 0 0 27 -4,-1.5 3,-2.2 2,-0.2 -1,-0.2 0.968 101.2 46.3 -69.3 -58.5 25.0 -46.4 17.1 457 213 C E H 3< S+ 0 0 125 -4,-1.0 -1,-0.2 -3,-0.4 -2,-0.2 0.772 125.5 39.5 -63.0 -24.5 28.6 -45.8 16.4 458 214 C K T 3< S+ 0 0 115 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.193 88.8 132.5-102.2 6.9 27.4 -45.7 12.8 459 215 C T < - 0 0 25 -3,-2.2 -3,-0.1 -5,-0.1 -51,-0.0 -0.236 51.2-145.7 -74.3 157.2 24.0 -43.8 12.9 460 216 C M + 0 0 181 2,-0.0 -1,-0.1 -2,-0.0 -52,-0.1 0.232 57.3 131.6 -96.6 8.4 22.7 -41.0 10.7 461 217 C G - 0 0 17 -54,-0.2 -54,-0.2 -5,-0.1 -55,-0.1 -0.256 62.7-102.2 -64.6 149.1 20.8 -39.3 13.6 462 218 C A - 0 0 32 -56,-2.3 2,-0.2 -57,-0.2 -1,-0.1 -0.290 41.5-106.1 -63.1 151.4 20.8 -35.7 14.6 463 219 C W - 0 0 135 -55,-0.0 2,-0.3 1,-0.0 -459,-0.2 -0.586 32.0-150.1 -81.5 144.6 22.9 -34.7 17.6 464 220 C M - 0 0 0 -2,-0.2 2,-0.1 -57,-0.1 -462,-0.0 -0.857 5.8-135.1-114.5 150.8 21.2 -33.8 20.9 465 221 C D > - 0 0 50 -2,-0.3 4,-1.7 1,-0.1 5,-0.2 -0.381 34.1-104.7 -85.8 176.2 22.3 -31.4 23.6 466 222 C Q H > S+ 0 0 138 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.835 124.5 49.2 -71.1 -32.4 22.1 -32.3 27.3 467 223 C T H > S+ 0 0 49 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.815 111.3 50.9 -70.7 -32.0 19.0 -30.1 27.6 468 224 C D H > S+ 0 0 3 2,-0.2 4,-0.7 1,-0.2 -2,-0.2 0.833 113.0 41.7 -78.6 -38.3 17.4 -31.7 24.6 469 225 C I H X S+ 0 0 6 -4,-1.7 4,-1.4 1,-0.2 -1,-0.2 0.807 106.7 64.7 -80.8 -29.4 17.8 -35.3 25.6 470 226 C E H X S+ 0 0 88 -4,-1.4 4,-1.1 1,-0.2 -2,-0.2 0.832 99.0 51.8 -63.1 -33.1 16.8 -34.5 29.2 471 227 C V H X S+ 0 0 12 -4,-0.9 4,-0.8 1,-0.2 -1,-0.2 0.841 111.1 46.8 -74.9 -33.2 13.3 -33.5 28.2 472 228 C V H X S+ 0 0 0 -4,-0.7 4,-1.7 2,-0.2 -1,-0.2 0.669 108.8 55.8 -78.4 -19.9 12.7 -36.7 26.2 473 229 C R H X S+ 0 0 68 -4,-1.4 4,-2.1 2,-0.2 -2,-0.2 0.796 104.2 54.2 -78.4 -27.6 14.1 -38.7 29.1 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G X S+ 0 0 0 -3,-0.9 3,-1.1 -4,-0.2 -1,-0.3 0.183 93.2 103.2-100.0 9.0 -35.1 -67.7 39.0 680 65 D A T < S+ 0 0 15 -3,-1.4 -2,-0.1 1,-0.2 -1,-0.1 0.567 74.4 57.3 -73.4 -10.2 -34.2 -65.2 41.7 681 66 D H T 3> S+ 0 0 0 -4,-0.3 4,-1.5 -3,-0.2 -1,-0.2 0.535 90.0 76.1 -94.0 -9.9 -34.3 -62.2 39.3 682 67 D L H <> S+ 0 0 0 -3,-1.1 4,-2.2 2,-0.2 5,-0.2 0.949 86.7 55.2 -70.1 -48.7 -37.9 -62.8 38.3 683 68 D P H > S+ 0 0 3 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.918 114.5 37.7 -55.5 -48.4 -39.8 -61.5 41.3 684 69 D P H > S+ 0 0 39 0, 0.0 4,-2.0 0, 0.0 3,-0.3 0.960 116.1 52.6 -68.6 -43.7 -38.3 -58.0 41.4 685 70 D L H X S+ 0 0 7 -4,-1.5 4,-0.9 1,-0.3 -3,-0.1 0.764 111.4 49.4 -56.8 -28.8 -38.2 -57.7 37.6 686 71 D C H <>S+ 0 0 1 -4,-2.2 5,-2.2 2,-0.2 4,-0.3 0.794 106.7 53.3 -80.1 -34.4 -41.9 -58.6 37.7 687 72 D E H <5S+ 0 0 97 -4,-1.7 -2,-0.2 -3,-0.3 3,-0.2 0.814 108.0 53.3 -68.0 -28.8 -42.7 -56.0 40.4 688 73 D E H <5S+ 0 0 122 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.813 116.4 34.9 -77.8 -33.2 -41.1 -53.4 38.2 689 74 D K 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-78.9 40.3 699 84 D K H > S+ 0 0 74 -2,-0.4 13,-3.2 1,-0.2 4,-1.1 0.717 100.4 51.6 -73.5 -20.6 -40.2 -77.9 37.4 700 85 D K H > S+ 0 0 98 11,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.838 109.6 48.7 -79.6 -37.0 -40.9 -81.1 35.6 701 86 D E H > S+ 0 0 102 2,-0.2 4,-2.5 1,-0.2 3,-0.3 0.959 108.8 53.4 -65.3 -51.2 -44.6 -80.7 35.8 702 87 D L H X S+ 0 0 0 -4,-2.2 4,-1.1 1,-0.2 -1,-0.2 0.888 108.1 52.6 -47.0 -45.6 -44.3 -77.1 34.6 703 88 D G H <>S+ 0 0 0 -4,-1.1 5,-2.1 1,-0.2 3,-0.2 0.880 109.3 45.6 -63.5 -43.5 -42.4 -78.4 31.6 704 89 D A H ><5S+ 0 0 51 -4,-1.9 3,-1.4 -3,-0.3 -1,-0.2 0.859 107.8 59.7 -68.2 -34.7 -44.9 -81.0 30.5 705 90 D A H 3<5S+ 0 0 6 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.804 106.3 48.4 -57.8 -31.5 -47.7 -78.4 31.0 706 91 D A T 3<5S- 0 0 3 -4,-1.1 -1,-0.3 -3,-0.2 -2,-0.2 0.380 124.9-103.4 -93.4 2.4 -45.9 -76.3 28.4 707 92 D G T < 5S+ 0 0 40 -3,-1.4 2,-0.4 1,-0.2 -3,-0.2 0.823 76.3 127.1 83.1 32.4 -45.5 -79.2 25.9 708 93 D I < - 0 0 34 -5,-2.1 -1,-0.2 2,-0.2 -2,-0.1 -0.967 61.4-134.5-126.2 145.3 -41.9 -80.2 26.4 709 94 D E S S+ 0 0 165 -2,-0.4 -5,-0.1 -5,-0.0 -1,-0.1 0.833 91.6 51.2 -53.5 -39.0 -40.1 -83.5 27.1 710 95 D V S S- 0 0 90 1,-0.2 -2,-0.2 -7,-0.1 2,-0.1 -0.160 95.2 -85.6 -94.0-172.8 -37.9 -81.8 29.7 711 96 D A - 0 0 36 -8,-0.1 2,-0.3 -9,-0.1 -11,-0.3 -0.344 29.7-147.0 -89.6 172.8 -38.5 -79.5 32.7 712 97 D A - 0 0 5 -13,-3.2 -42,-0.2 -2,-0.1 -10,-0.1 -0.901 10.6-159.6-146.5 119.9 -38.9 -75.7 32.9 713 98 D A S S+ 0 0 19 -2,-0.3 -43,-1.6 1,-0.2 2,-0.3 0.683 82.2 1.4 -75.9 -19.4 -37.8 -73.4 35.7 714 99 D S E - E 0 669B 0 -45,-0.2 -63,-2.6 -15,-0.1 2,-0.3 -0.971 59.8-167.4-159.8 157.0 -40.2 -70.7 34.5 715 100 D V E -DE 650 668B 0 -47,-2.2 -47,-1.9 -2,-0.3 2,-0.4 -0.960 7.4-154.9-138.1 155.4 -42.8 -70.0 31.9 716 101 D A E -DE 649 667B 0 -67,-2.1 -67,-2.6 -2,-0.3 2,-0.5 -0.999 13.6-137.5-130.7 139.5 -44.6 -66.8 30.7 717 102 D I E -DE 648 666B 0 -51,-2.7 -52,-2.9 -2,-0.4 -51,-0.8 -0.844 19.0-179.3 -89.9 128.1 -48.0 -66.5 29.0 718 103 D I E S+ 0 0 28 -71,-2.3 -1,-0.2 -2,-0.5 -70,-0.2 0.919 77.2 8.8 -86.5 -72.9 -47.9 -64.1 26.2 719 104 D E E S-D 647 0B 118 -72,-0.7 -72,-2.5 -77,-0.1 -1,-0.3 -0.960 70.4-146.2-115.6 117.5 -51.5 -64.2 25.0 720 105 D P > - 0 0 3 0, 0.0 3,-2.3 0, 0.0 -75,-0.1 0.537 27.9-174.3 -58.4 -15.4 -53.9 -66.2 27.2 721 106 D G G > S- 0 0 25 1,-0.3 3,-1.3 2,-0.2 -75,-0.2 -0.224 71.5 -4.4 50.8-132.5 -55.9 -67.5 24.3 722 107 D K G 3 S+ 0 0 167 -81,-0.4 -1,-0.3 -77,-0.3 3,-0.2 0.403 131.0 69.9 -69.1 0.7 -59.0 -69.4 25.6 723 108 D A G <> + 0 0 2 -3,-2.3 4,-2.0 1,-0.1 3,-0.5 0.371 53.8 114.6 -98.1 2.2 -57.6 -69.0 29.1 724 109 D R H <> S+ 0 0 144 -3,-1.3 4,-2.3 1,-0.3 -1,-0.1 0.796 77.0 57.6 -51.8 -33.2 -58.1 -65.3 29.8 725 110 D D H > S+ 0 0 127 -3,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.973 108.8 44.0 -53.9 -62.0 -60.7 -66.1 32.5 726 111 D L H > S+ 0 0 25 -3,-0.5 4,-2.2 1,-0.2 5,-0.2 0.889 111.6 54.0 -50.1 -48.7 -58.2 -68.2 34.5 727 112 D V H X S+ 0 0 13 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.932 107.3 51.8 -54.8 -47.4 -55.4 -65.7 34.1 728 113 D E H X S+ 0 0 140 -4,-2.3 4,-1.4 -5,-0.2 -1,-0.2 0.916 112.6 43.5 -57.5 -46.0 -57.6 -63.0 35.5 729 114 D E H X S+ 0 0 72 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.763 108.0 57.2 -78.2 -27.0 -58.6 -64.9 38.6 730 115 D I H X S+ 0 0 0 -4,-2.2 4,-1.2 -5,-0.2 -1,-0.2 0.956 110.0 47.6 -61.8 -45.4 -55.1 -66.2 39.3 731 116 D A H X S+ 0 0 26 -4,-2.1 4,-1.8 -5,-0.2 -2,-0.2 0.777 111.0 49.4 -68.8 -29.9 -54.0 -62.6 39.4 732 117 D M H X S+ 0 0 123 -4,-1.4 4,-0.8 2,-0.2 -1,-0.2 0.945 113.8 44.6 -72.2 -48.5 -56.9 -61.5 41.7 733 118 D K H X S+ 0 0 65 -4,-2.1 4,-0.9 1,-0.2 -2,-0.2 0.677 116.0 50.7 -67.2 -19.6 -56.2 -64.3 44.2 734 119 D V H X S+ 0 0 4 -4,-1.2 4,-1.7 -5,-0.2 -1,-0.2 0.845 94.1 70.4 -80.1 -38.5 -52.6 -63.4 43.8 735 120 D K H X S+ 0 0 152 -4,-1.8 4,-1.2 1,-0.2 -2,-0.2 0.786 103.5 45.3 -54.0 -28.3 -53.1 -59.7 44.4 736 121 D E H < S+ 0 0 119 -4,-0.8 -1,-0.2 2,-0.2 -2,-0.2 0.945 102.2 58.3 -76.8 -59.7 -53.9 -60.5 48.1 737 122 D L H < S+ 0 0 53 -4,-0.9 -2,-0.2 1,-0.2 -1,-0.1 0.859 109.9 48.9 -45.1 -41.8 -51.1 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