Assignment w1 w2 A2H-N 123.842 8.183 R3H-N 120.165 8.429 A4H-N 125.165 8.37 S5H-N 114.54 8.134 V6H-N 121.415 8.119 L7H-N 115.478 7.382 S8H-N 118.29 9.166 G9H-N 109.228 8.959 G10H-N 111.102 8.782 E11H-N 120.165 7.751 L12H-N 121.415 8.34 D13H-N 116.415 7.574 K14H-N 115.478 7.117 W15H-N 121.693 8.646 W15HE1-NE1 126.482 9.326 E16H-N 127.71 7.571 K17H-N 115.79 7.456 I18H-N 124.228 7.633 R19H-N 125.79 8.031 L20H-N 120.165 7.81 R21H-N 119.54 8.974 G23H-N 112.665 9.138 G24H-N 107.978 8.134 K25H-N 117.665 8.665 K26H-N 117.925 7.817 Q27H-N 122.978 8.458 Y28H-N 119.54 7.824 K29H-N 117.978 10.61 L30H-N 128.602 9.991 K31H-N 115.165 8.399 H32H-N 119.54 8.193 I33H-N 119.54 7.898 V34H-N 122.04 7.706 W35H-N 119.986 8.452 W35HE1-NE1 131.102 10.286 A36H-N 120.478 8.311 S37H-N 111.415 8.259 R38H-N 119.852 7.559 E39H-N 121.102 8.222 L40H-N 117.04 8.016 E41H-N 117.352 7.559 R42H-N 119.54 7.647 F43H-N 117.665 7.529 A44H-N 118.915 7.928 V45H-N 119.54 7.765 N46H-N 125.79 8.399 G48H-N 108.29 8.62 L49H-N 121.728 7.765 L50H-N 112.04 7.412 E51H-N 114.54 7.5 T52H-N 122.978 7.235 S53H-N 119.228 9.313 E54H-N 121.233 8.975 G55H-N 110.79 8.517 C56H-N 118.602 8.134 R57H-N 119.54 8.488 Q58H-N 119.852 8.016 I59H-N 120.79 8.163 L60H-N 118.915 8.37 G61H-N 104.332 7.883 Q62H-N 119.852 7.795 L63H-N 117.04 8.252 Q64H-N 118.915 8.104 S66H-N 111.415 7.824 L67H-N 121.102 7.647 Q68H-N 116.415 8.06 T69H-N 106.728 7.515 G70H-N 109.54 7.692 S71H-N 114.54 8.045 E72H-N 124.228 9.092 E73H-N 120.165 8.665 L74H-N 121.415 7.765 R75H-N 119.228 7.868 S76H-N 114.228 8.576 L77H-N 125.79 8.458 Y78H-N 119.852 8.694 N79H-N 117.04 8.871 N79HD21-ND2 104.54 6.409 N79HD22-ND2 104.54 7.485 T80H-N 115.79 8.119 I81H-N 121.102 8.09 A82H-N 125.165 8.782 V83H-N 117.665 7.795 L84H-N 122.04 8.163 Y85H-N 118.915 9.062 C86H-N 116.102 7.515 V87H-N 119.978 8.429 H88H-N 118.915 8.797 Q89H-N 116.728 7.986 R90H-N 115.165 7.883 I91H-N 120.087 8.335 D92H-N 129.228 8.62 V93H-N 115.79 7.751 K94H-N 118.915 9.239 D95H-N 112.04 7.412 T96H-N 109.54 7.25 K97H-N 121.102 7.868 E98H-N 119.228 8.384 A99H-N 118.915 7.382 L100H-N 117.978 8.119 D101H-N 120.478 8.679 K102H-N 120.165 8.207 I103H-N 119.852 8.163 E104H-N 121.415 8.001 E105H-N 119.228 8.031 E106H-N 118.915 8.016 Q107H-N 118.29 8.252 N108H-N 118.29 8.252 K109H-N 120.478 8.031 S110H-N 114.54 8.031 K111H-N 122.04 7.957 K112H-N 120.79 8.016 K113H-N 121.728 8.119 A114H-N 124.228 8.178 Q115H-N 119.228 8.237 Q116H-N 120.478 8.266 A117H-N 124.852 8.266 A118H-N 122.978 8.163 A119H-N 122.665 8.163 D120H-N 119.228 8.252 T121H-N 113.602 8.075 G122H-N 110.478 8.414 N123H-N 118.602 8.266 N124H-N 119.228 8.443 S125H-N 115.79 8.266 Q126H-N 121.728 8.355 V127H-N 119.852 7.986 S128H-N 117.978 8.252 Q129H-N 121.728 8.355 N130H-N 118.29 8.252 Y131H-N 120.165 7.957