Assignment w1 w2 A8H-N 125.151 8.176 S9H-N 115.127 8.256 V10H-N 121.682 8.094 T11H-N 117.314 8.065 A12H-N 126.529 8.138 R13H-N 120.309 8.197 T14H-N 117.809 8.116 Q16H-N 120.287 8.35 N17H-N 119.354 8.247 F18H-N 120.702 8.082 S19H-N 117.503 8.123 V20H-N 122.8 8.013 S22H-N 117.393 8.334 G24H-N 109.104 8.127 L26H-N 121.595 8.304 N27H-N 119.187 8.285 T28H-N 116.784 7.946 V30H-N 120.524 8.153 N31H-N 123.414 8.46 S33H-N 114.952 8.263 S34H-N 117.532 8.127 V35H-N 121.068 7.893 M36H-N 123.75 8.273 S37H-N 118.687 8.265 A39H-N 124.186 8.33 G40H-N 108.361 8.322 S41H-N 115.575 8.123 S42H-N 117.504 8.146 Q43H-N 122.763 8.487 A44H-N 123.4 8.22 E45H-N 119.263 8.175 E46H-N 120.712 8.115 Q47H-N 118.383 8.061 Q48H-N 117.958 8.061 Q48HE21-NE2 110.624 7.37 Q48HE22-NE2 110.624 6.782 Y49H-N 121.869 8.197 L50H-N 118.638 8.235 D51H-N 119.925 8.503 K52H-N 121.907 7.814 L53H-N 120.315 8.393 K54H-N 118.793 7.889 Q55H-N 120.484 7.785 L56H-N 116.313 8.007 S57H-N 116.306 7.782 K58H-N 120.256 7.324 Y59H-N 117.469 8.041 I60H-N 120.553 7.623 E61H-N 117.198 8.729 L63H-N 119.395 7.998 R64H-N 119.121 8.529 R65H-N 117.853 8.12 M66H-N 120.414 8.158 I67H-N 120.049 8.408 N68H-N 115.632 7.657 K69H-N 118.503 7.601 I70H-N 115.422 7.661 D71H-N 122.958 7.973 K72H-N 117.383 7.948 N73H-N 118.333 7.79 E74H-N 124.747 8.825 D75H-N 118.112 8.283 R76H-N 117.934 7.758 K77H-N 120.135 7.628 D79H-N 120.702 7.868 L80H-N 122.15 8.288 S81H-N 113.751 8.163 K82H-N 122.299 7.644 M83H-N 118.529 8.147 K84H-N 118.875 8.578 S85H-N 115.034 7.828 L86H-N 121.616 7.549 L87H-N 119.58 8.105 D88H-N 120.587 8.105 I89H-N 118.995 7.379 L90H-N 114.662 7.711 T91H-N 103.007 7.542 D92H-N 122.072 7.59 S94H-N 114.853 8.375 K95H-N 123.046 7.511 R96H-N 119.747 7.845 C97H-N 119.781 7.652 L99H-N 126.643 9.034 K100H-N 116.502 8.816 T101H-N 116.497 7.375 L102H-N 124.083 7.828 Q103H-N 117.625 8.251 Q103HE21-NE2 110.47 7.36 Q103HE22-NE2 110.47 6.785 K104H-N 119.163 7.546 C105H-N 119.386 8.108 E106H-N 120.199 8.023 I107H-N 117.925 7.306 A108H-N 121.93 7.436 L109H-N 119.248 8.223 E110H-N 119.261 7.89 K111H-N 117.691 7.414 L112H-N 119.438 7.62 K113H-N 118.947 7.812 N114H-N 117.205 8.072 N114HD21-ND2 112.876 7.582 N114HD22-ND2 112.876 6.941 D115H-N 120.057 8.143 M116H-N 117.578 7.832 A117H-N 123.893 7.814 V118H-N 122.028 7.471