Assignment w1 w2 T3H-N 113.38 8.099 G4H-N 113.124 8.77 N5H-N 121.226 8.988 N5HD21-ND2 113.818 7.53 N5HD22-ND2 113.818 6.746 K6H-N 119.587 8.354 V7H-N 124.203 8.774 T8H-N 125.363 8.851 I9H-N 127.015 8.628 Y11H-N 125.905 9.5 K12H-N 131.688 8.41 G14H-N 112.761 7.585 F15H-N 121.529 8.454 N16H-N 117.583 8.513 N16HD21-ND2 114.037 7.678 N16HD22-ND2 114.037 7.031 S17H-N 112.889 8.315 Y19H-N 122.06 9.072 I20H-N 118.018 9.164 H21H-N 133.346 8.843 Y22H-N 121.863 8.231 R23H-N 116.788 8.456 R23HE-NE 84.945 6.353 A25H-N 125.666 8.23 G26H-N 112.217 8.591 G27H-N 109.489 8.38 S28H-N 117.275 8.585 W29H-N 123.426 8.346 W29HE1-NE1 128.653 9.867 T30H-N 111.168 7.888 A31H-N 122.982 8.383 A32H-N 129.78 8.778 G34H-N 112.15 8.685 V35H-N 123.276 9.287 K36H-N 128.135 8.443 M37H-N 124.85 8.121 Q38H-N 121.555 8.441 Q38HE21-NE2 111.988 7.423 Q38HE22-NE2 111.988 6.767 D39H-N 121.629 8.72 A40H-N 122.646 8.423 E41H-N 120.19 10.341 I42H-N 119.473 6.466 S43H-N 121.292 8.584 G44H-N 111.896 8.623 Y45H-N 116.379 7.803 A46H-N 126.206 9.91 K47H-N 120.226 9.373 I48H-N 120.505 8.085 T49H-N 122.247 7.954 V50H-N 126.076 9.242 D51H-N 126.346 8.476 I52H-N 118.935 8.728 G53H-N 114.498 9.078 S54H-N 120.546 8.808 A55H-N 125.402 7.738 S56H-N 110.149 8.756 Q57H-N 117.023 7.139 Q57HE21-NE2 111.335 7.274 Q57HE22-NE2 111.335 6.686 L58H-N 121.156 9.149 E59H-N 126.375 8.558 A60H-N 124.321 9.614 A61H-N 120.954 9.346 F62H-N 117.021 8.351 N63H-N 116.362 9.077 N63HD21-ND2 115.974 7.891 N63HD22-ND2 115.974 3.958 D64H-N 118.002 7.482 G65H-N 110.602 8.696 N66H-N 120.867 8.371 N66HD21-ND2 112.696 7.186 N66HD22-ND2 112.696 6.675 N67H-N 113.518 8.7 N67HD21-ND2 113.583 7.521 N67HD22-ND2 113.583 6.822 N68H-N 118.464 7.975 N68HD21-ND2 117.942 8.714 N68HD22-ND2 117.942 6.819 W69H-N 120.817 8.771 W69HE1-NE1 130.994 10.031 D70H-N 122.179 9.795 S71H-N 117.314 9.238 N72H-N 122.911 8.536 N72HD21-ND2 107.407 7.025 N72HD22-ND2 107.407 6.669 N73H-N 116.146 9.086 N73HD21-ND2 113.205 7.571 N73HD22-ND2 113.205 6.973 T74H-N 110.42 7.782 K75H-N 121.968 7.652 N76H-N 108.525 8.197 N76HD21-ND2 113.333 8.034 N76HD22-ND2 113.333 6.26 Y77H-N 118.076 9.133 S78H-N 116.4 8.204 F79H-N 123.023 9.054 S80H-N 117.002 8.804 T81H-N 112.529 7.559 G82H-N 112.234 8.409 T83H-N 120.411 8.729 S84H-N 123.023 9.121 T85H-N 118.388 9.445 Y86H-N 129.195 9.858 T87H-N 124.861 7.906 G89H-N 108.823 8.294 N90H-N 117.85 8.434 N90HD21-ND2 113.598 7.53 N90HD22-ND2 113.598 6.882 S91H-N 114.973 8.819 G92H-N 108.552 8.472 N93H-N 119.035 7.985 N93HD21-ND2 113.347 7.375 N93HD22-ND2 113.347 6.996 A94H-N 123.854 8.442 G95H-N 108.88 8.353 T96H-N 110.444 7.839 I97H-N 126.77 8.733 T98H-N 121.307 9.27 S99H-N 118.544 8.667 G100H-N 113.982 8.443 A101H-N 120.741 7.908 A103H-N 122.93 7.993 G104H-N 113.507 7.587