Assignment w1 w2 E2H-N 122.259 8.994 D3H-N 119.83 8.048 A4H-N 123.957 8.09 W5H-N 118.408 7.941 W5HE1-NE1 130.169 10.32 M6H-N 121.538 7.679 G7H-N 104.055 7.247 T8H-N 107.669 7.436 H9H-N 127.281 8.048 K11H-N 121.398 10.994 Y12H-N 121.579 7.146 L13H-N 117.518 7.778 E14H-N 119.135 7.867 M15H-N 117.884 7.773 M16H-N 119.555 8.145 E17H-N 118.216 7.761 L18H-N 117.448 7.201 D19H-N 115.844 7.789 I20H-N 117.287 8.142 G21H-N 110.656 8.207 D22H-N 119.305 7.727 A23H-N 122.468 8.644 T24H-N 114.824 8.238 Q25H-N 122.518 8.037 Q25HE21-NE2 109.9 7.606 Q25HE22-NE2 109.9 7.101 V26H-N 119.112 7.994 Y27H-N 119.17 8.003 V28H-N 113.112 8.087 A29H-N 121.35 7.853 F30H-N 120.478 8.724 L31H-N 118.427 8.146 V32H-N 119.497 7.627 Y33H-N 121.842 8.366 L34H-N 116.692 8.0 D35H-N 120.507 7.688 L36H-N 117.671 8.482 M37H-N 112.952 7.822 E38H-N 116.463 8.667 S39H-N 113.87 7.657 K40H-N 116.671 8.165 S41H-N 109.989 7.017 W42H-N 121.116 8.876 W42HE1-NE1 129.356 10.062 H43H-N 119.397 8.132 E44H-N 116.181 8.14 V45H-N 123.272 8.428 N46H-N 123.901 9.05 N46HD21-ND2 115.36 7.738 N46HD22-ND2 115.36 7.336 C47H-N 119.663 9.039 V48H-N 124.672 9.083 G49H-N 113.131 9.019 L50H-N 124.471 8.747 E52H-N 118.552 9.721 L53H-N 116.763 7.089 Q54H-N 115.489 7.964 Q54HE21-NE2 113.633 6.984 Q54HE22-NE2 113.633 7.708 L55H-N 116.422 7.139 I56H-N 122.792 8.223 C57H-N 121.575 8.995 L58H-N 121.895 9.076 V59H-N 121.702 8.966 G60H-N 114.126 9.258 T61H-N 114.856 8.834 E62H-N 129.915 8.502 I63H-N 117.075 6.928 E64H-N 126.422 8.585 G65H-N 114.614 8.754 E66H-N 119.292 7.76 G67H-N 106.161 8.262 L68H-N 120.269 8.142 Q69H-N 119.336 9.253 Q69HE21-NE2 114.767 7.478 Q69HE22-NE2 114.767 6.825 T70H-N 118.372 8.803 V71H-N 129.063 9.882 V72H-N 128.521 9.491 T74H-N 118.075 9.103 I76H-N 122.273 8.221 T77H-N 105.803 6.984 A78H-N 126.635 7.647 S79H-N 115.272 7.884 L80H-N 121.507 7.7 S81H-N 118.323 7.885 H82H-N 124.042 8.935 N83H-N 118.543 8.435 N83HD21-ND2 114.922 7.75 N83HD22-ND2 114.922 7.063 R84H-N 121.312 7.716 I85H-N 119.321 8.354 R86H-N 118.362 7.69 E87H-N 118.124 7.884 I88H-N 122.929 8.715 L89H-N 122.696 8.486 K90H-N 118.64 7.79 A91H-N 122.939 8.113 S92H-N 114.526 8.858 R93H-N 121.505 7.704 K94H-N 119.072 7.456 L95H-N 119.717 8.148 Q96H-N 114.581 7.807 Q96HE21-NE2 109.994 7.249 Q96HE22-NE2 109.994 6.848 G97H-N 106.959 7.802 D98H-N 118.447 8.156 D100H-N 119.34 8.527 L101H-N 122.107 7.379 M103H-N 123.334 9.011 S104H-N 114.434 8.239 F105H-N 116.224 9.003 T106H-N 117.469 9.074 L107H-N 133.4 9.804 A108H-N 131.422 8.435 I109H-N 124.415 8.909 V110H-N 127.457 8.706 E111H-N 129.768 9.024 S112H-N 115.956 9.143 D113H-N 118.343 8.133 S114H-N 109.836 8.034 T115H-N 117.407 7.711 I116H-N 125.48 8.219 V117H-N 127.887 8.695 Y118H-N 124.822 8.27 Y119H-N 125.153 9.207 K120H-N 129.442 7.7 L121H-N 123.403 8.112 T122H-N 109.081 8.338 D123H-N 124.199 8.004