Assignment w1 w2 G10H-N 109.88 8.391 K11H-N 121.008 8.217 Q12H-N 121.554 8.463 Q12HE21-NE2 112.5 6.864 Q12HE22-NE2 112.5 7.562 A13H-N 125.509 8.379 S14H-N 114.915 8.249 A15H-N 125.867 8.294 S16H-N 114.703 8.173 Y17H-N 121.898 8.116 D18H-N 122.224 8.293 S19H-N 116.274 8.179 E20H-N 122.611 8.503 E21H-N 121.17 8.315 E22H-N 122.605 8.497 E23H-N 122.384 8.402 E24H-N 121.991 8.371 G25H-N 109.271 8.423 L26H-N 123.526 8.242 M28H-N 122.301 8.657 S29H-N 119.916 9.216 Y30H-N 122.466 9.161 D31H-N 116.888 8.481 E32H-N 120.384 7.803 K33H-N 121.408 8.112 R34H-N 118.91 8.433 Q35H-N 119.114 8.016 Q35HE21-NE2 116.6 7.89 Q35HE22-NE2 116.6 6.786 L36H-N 120.283 7.665 S37H-N 111.779 7.517 L38H-N 120.96 7.883 D39H-N 121.66 8.759 I40H-N 120.603 8.455 N41H-N 115.839 7.608 N41HD21-ND2 111.65 6.568 N41HD22-ND2 111.65 7.697 R42H-N 116.136 7.63 L43H-N 121.798 7.397 G45H-N 111.177 8.977 E46H-N 119.365 9.537 K47H-N 116.511 8.07 L48H-N 120.258 7.871 G49H-N 107.853 8.206 R50H-N 120.719 7.716 V51H-N 118.885 6.94 V52H-N 117.389 6.93 H53H-N 117.663 7.614 I54H-N 121.56 8.489 I55H-N 117.152 7.578 Q56H-N 116.108 8.68 Q56HE21-NE2 111.1 7.226 Q56HE22-NE2 111.1 6.884 S57H-N 111.66 8.022 R58H-N 118.485 7.388 E59H-N 118.277 7.877 S61H-N 113.217 8.408 L62H-N 122.643 8.008 R63H-N 121.184 7.827 D64H-N 119.917 8.26 S65H-N 114.876 7.832 N66H-N 122.198 8.568 N66HD21-ND2 113.2 7.746 N66HD22-ND2 113.2 7.146 D68H-N 115.418 8.208 E69H-N 118.63 7.489 I70H-N 122.555 9.087 E71H-N 127.225 8.633 I72H-N 125.142 8.975 D73H-N 125.899 8.526 F74H-N 122.44 9.311 E75H-N 114.76 8.705 T76H-N 106.382 7.556 L77H-N 121.847 6.71 K78H-N 123.361 10.01 T80H-N 106.152 7.885 T81H-N 121.088 7.281 L82H-N 120.411 8.005 R83H-N 115.463 8.186 E84H-N 122.862 7.986 L85H-N 120.064 8.484 E86H-N 120.318 8.629 R87H-N 118.655 8.052 Y88H-N 120.621 8.093 V89H-N 121.659 9.145 K90H-N 118.795 8.203 S91H-N 113.958 7.599 C92H-N 118.65 7.496 L93H-N 118.97 7.611 Q94H-N 119.218 7.783 Q94HE21-NE2 112.7 6.866 Q94HE22-NE2 112.7 7.512 K95H-N 122.872 8.191 K96H-N 128.364 8.015 T4H-N 115.8 8.188 W5H-N 124.2 8.167 W5HE1-NE1 128.8 10.13 R6H-N 118.8 9.256 V7H-N 122.1 8.851 Q8H-N 127.4 9.324 Q8HE21-NE2 112.9 6.973 Q8HE22-NE2 112.9 7.542 R9H-N 125.1 8.915 S10H-N 118.5 8.636 N12H-N 119.6 8.316 N12HD21-ND2 113.8 7.5 N12HD22-ND2 113.8 7.799 L14H-N 115.3 8.158 K15H-N 119.8 7.722 I16H-N 118.6 8.616 R17H-N 122.0 8.757 L18H-N 125.8 9.14 T19H-N 114.9 9.128 R20H-N 125.9 8.349 E21H-N 124.5 8.294 A22H-N 130.8 8.127