Assignment w1 w2 A1H-N 129.783 8.314 S2H-N 114.193 8.383 M3H-N 122.587 8.539 V4H-N 122.329 8.207 L5H-N 126.619 8.367 S6H-N 118.319 8.468 R8H-N 117.127 8.126 D9H-N 121.397 7.798 E10H-N 120.17 8.447 R11H-N 116.798 7.938 T12H-N 116.774 8.053 L13H-N 121.225 7.868 V14H-N 116.41 7.704 R15H-N 118.617 8.038 K16H-N 116.918 7.797 V17H-N 116.788 7.409 Q18H-N 120.756 7.988 Q18HE21-NE2 110.939 6.776 Q18HE22-NE2 110.939 7.276 I19H-N 116.961 7.7 N20H-N 116.535 7.961 N20HD21-ND2 111.874 7.021 N20HD22-ND2 111.874 7.515 R22H-N 116.071 7.984 T23H-N 117.922 7.691 T24H-N 117.758 8.781 A25H-N 122.495 9.073 K26H-N 116.57 8.33 D27H-N 120.108 7.749 L28H-N 121.709 7.922 V29H-N 119.139 8.182 K30H-N 119.688 7.557 M31H-N 119.115 7.95 L32H-N 119.019 8.007 E33H-N 122.635 8.346 E34H-N 118.905 7.896 T35H-N 107.147 7.539 G36H-N 108.269 7.76 T37H-N 119.889 7.953 K38H-N 129.08 8.592 V39H-N 120.322 8.234 S40H-N 116.025 8.18 I41H-N 121.975 8.902 S42H-N 114.947 8.277 T43H-N 120.757 7.807 V44H-N 120.024 7.468 K45H-N 117.782 8.565 R46H-N 118.405 7.79 V47H-N 119.359 7.717 L48H-N 117.922 8.062 Y49H-N 119.104 8.356 R50H-N 119.327 8.153 N52H-N 116.505 8.104 N52HD21-ND2 112.11 6.833 N52HD22-ND2 112.11 7.532 L53H-N 118.96 8.063 K54H-N 119.125 7.921 G55H-N 109.823 8.472 R56H-N 120.521 8.277 S57H-N 116.517 8.458 A58H-N 125.301 8.261 R59H-N 119.327 8.162 K60H-N 121.728 8.23 L61H-N 122.537 8.134 E62H-N 120.848 8.17