Assignment w1 w2 S11H-N 116.385 8.268 L12H-N 123.711 8.217 I13H-N 120.207 7.937 D14H-N 124.117 8.257 E15H-N 121.829 8.345 D16H-N 120.32 8.322 A17H-N 124.159 7.941 V18H-N 114.027 7.821 C19H-N 123.878 7.6 S20H-N 123.55 9.028 I21H-N 123.965 9.017 C22H-N 117.876 8.121 M23H-N 117.636 8.029 D24H-N 121.198 8.435 G25H-N 109.505 8.59 E26H-N 122.983 8.779 S27H-N 120.284 9.053 Q28H-N 120.83 8.056 N29H-N 119.892 8.794 N29HD21-ND2 112.794 7.662 N29HD22-ND2 112.794 6.918 S30H-N 111.564 7.864 N31H-N 121.759 7.848 N31HD21-ND2 111.236 7.109 N31HD22-ND2 111.236 6.747 V32H-N 119.987 8.552 I33H-N 120.95 8.125 L34H-N 130.717 8.516 F35H-N 115.995 8.096 C36H-N 126.951 9.36 D37H-N 131.038 9.363 M38H-N 118.588 8.844 C39H-N 119.405 8.294 N40H-N 119.215 8.101 N40HD21-ND2 111.647 7.474 N40HD22-ND2 111.647 6.786 L41H-N 123.939 8.567 A42H-N 130.193 8.158 V43H-N 116.744 8.556 H44H-N 120.978 9.337 Q45H-N 121.596 8.715 Q45HE21-NE2 107.095 6.872 Q45HE22-NE2 107.095 6.415 E46H-N 116.796 9.044 C47H-N 116.192 6.644 Y48H-N 117.582 7.869 G49H-N 107.131 7.774 V50H-N 121.86 8.165 Y52H-N 115.429 7.123 I53H-N 124.308 8.617 E55H-N 121.494 8.645 G56H-N 110.652 8.334 Q57H-N 122.218 8.384 Q57HE21-NE2 112.526 7.881 Q57HE22-NE2 112.526 6.842 W58H-N 127.533 9.342 W58HE1-NE1 129.339 9.884 L59H-N 125.706 6.584 C60H-N 122.13 8.718 R61H-N 115.222 8.394 H62H-N 119.016 7.928 C63H-N 126.879 8.728 L64H-N 119.989 8.341 Q65H-N 116.619 7.426 Q65HE21-NE2 111.871 7.43 Q65HE22-NE2 111.871 6.834 S66H-N 114.368 7.725 R67H-N 121.133 7.69 A68H-N 123.9 7.875 R69H-N 121.46 8.112 A71H-N 130.583 8.053