Assignment w1 w2 N17H-N 112.666 7.53 N17HD21-ND2 113.032 6.873 N17HD22-ND2 113.032 7.726 T18H-N 112.254 7.961 V19H-N 122.266 7.051 A20H-N 122.426 7.571 M21H-N 117.336 8.052 L22H-N 120.553 8.3 N23H-N 116.388 7.953 N23HD21-ND2 114.517 6.86 N23HD22-ND2 114.517 7.742 E24H-N 115.648 7.299 L25H-N 118.197 7.264 R26H-N 120.223 8.13 R26HE-NE 84.56 8.305 H27H-N 120.786 8.384 G28H-N 110.04 8.443 L29H-N 119.337 8.004 I30H-N 121.552 8.219 Y31H-N 127.812 8.66 K32H-N 125.857 9.271 L33H-N 125.551 8.721 E34H-N 130.089 9.05 S35H-N 107.868 7.612 T37H-N 116.989 8.478 G38H-N 107.727 8.222 H41H-N 121.893 8.35 A42H-N 124.247 7.248 L44H-N 119.038 8.351 F45H-N 126.372 9.079 T46H-N 117.069 8.607 I47H-N 130.16 9.322 S48H-N 119.865 9.673 V49H-N 118.215 8.877 E50H-N 128.74 7.845 V51H-N 125.354 8.995 D52H-N 129.856 9.451 G53H-N 103.064 8.645 Q54H-N 119.911 7.647 Q54HE21-NE2 112.821 7.385 Q54HE22-NE2 112.821 6.694 K55H-N 122.685 8.211 Y56H-N 125.3 8.806 L57H-N 121.59 8.521 G58H-N 107.496 9.071 Q59H-N 118.792 8.423 Q59HE21-NE2 112.317 6.713 Q59HE22-NE2 112.317 7.346 G60H-N 103.848 8.378 R61H-N 118.986 9.003 S62H-N 110.1 7.488 K63H-N 123.195 8.591 K64H-N 117.995 8.041 V65H-N 117.8 7.336 A66H-N 121.915 7.863 R67H-N 117.11 7.996 I68H-N 119.448 7.359 E69H-N 120.002 8.441 A70H-N 126.793 8.488 A71H-N 118.014 8.215 A72H-N 119.217 8.289 T73H-N 116.263 8.19 A74H-N 125.118 7.865 L75H-N 118.442 8.483 R76H-N 116.297 7.509 S77H-N 113.838 7.446 F78H-N 120.535 7.629 I79H-N 120.901 7.917 D83H-N 121.605 8.335 G84H-N 108.666 8.197 A85H-N 123.461 7.984 V86H-N 118.946 7.983 L87H-N 125.915 8.217 S88H-N 117.832 8.173 L90H-N 121.777 8.12 A93H-N 129.879 7.896