Assignment w1 w2 T4H-N 115.083 8.223 K7H-N 120.155 8.17 E8H-N 119.219 8.329 G9H-N 107.83 8.387 L10H-N 124.293 8.119 L11H-N 122.427 8.759 L12H-N 119.384 8.078 W13H-N 120.681 8.235 W13HE1-NE1 131.241 10.727 C14H-N 115.858 8.817 Q15H-N 121.776 8.832 Q15HE21-NE2 108.363 6.643 Q15HE22-NE2 108.363 7.393 R16H-N 119.616 8.605 K17H-N 115.611 8.251 T18H-N 101.781 7.329 A19H-N 127.769 7.136 Y21H-N 118.191 7.544 K22H-N 122.713 8.542 N23H-N 114.159 8.072 N23HD21-ND2 110.976 6.676 N23HD22-ND2 110.976 7.716 V24H-N 118.844 7.498 N25H-N 123.698 8.74 N25HD21-ND2 110.129 6.68 N25HD22-ND2 110.129 7.446 V26H-N 124.898 9.088 Q27H-N 125.164 8.147 Q27HE21-NE2 113.011 6.761 Q27HE22-NE2 113.011 7.599 N28H-N 112.714 7.541 N28HD21-ND2 118.735 6.134 N28HD22-ND2 118.735 8.015 F29H-N 116.571 9.337 H30H-N 112.608 8.534 S32H-N 117.33 9.417 W33H-N 119.805 8.255 W33HE1-NE1 128.971 10.131 K34H-N 120.179 7.393 D35H-N 111.105 7.868 G36H-N 103.065 7.507 L37H-N 124.814 8.903 A38H-N 121.28 8.858 F39H-N 113.73 8.307 N40H-N 114.523 7.291 N40HD21-ND2 114.621 7.419 N40HD22-ND2 114.621 7.748 A41H-N 124.487 9.251 L42H-N 115.292 8.064 I43H-N 115.961 7.343 H44H-N 122.631 8.957 R45H-N 116.258 8.459 H46H-N 113.598 7.005 R47H-N 119.617 8.712 E49H-N 118.244 9.881 L50H-N 118.297 7.912 I51H-N 115.821 7.111 E52H-N 128.94 8.997 Y53H-N 124.049 7.451 D54H-N 114.42 8.592 K55H-N 116.339 7.246 L56H-N 119.889 7.158 R57H-N 122.683 8.984 D59H-N 112.331 7.957 D60H-N 118.085 7.23 V62H-N 118.981 8.332 T63H-N 116.28 7.007 N64H-N 120.452 7.707 N64HD21-ND2 108.246 7.116 N64HD22-ND2 108.246 7.44 L65H-N 123.203 8.933 N66H-N 113.739 8.07 N66HD21-ND2 114.085 7.375 N66HD22-ND2 114.085 7.418 N67H-N 117.808 8.404 N67HD21-ND2 114.091 7.078 N67HD22-ND2 114.091 8.029 A68H-N 119.032 7.581 F69H-N 115.119 8.57 E70H-N 120.926 8.786 V71H-N 120.968 8.538 A72H-N 121.16 8.887 E73H-N 119.578 7.834 K74H-N 118.114 8.492 Y75H-N 112.057 8.632 L76H-N 115.963 7.162 D77H-N 116.242 7.59 I78H-N 120.33 7.647 K80H-N 120.43 8.349 M81H-N 121.031 6.942 L82H-N 117.738 7.182 D83H-N 121.481 8.615 A84H-N 127.873 9.665 E85H-N 115.255 8.622 D86H-N 118.293 7.784 I87H-N 118.98 7.753 V88H-N 114.392 7.895 N89H-N 116.417 7.96 N89HD21-ND2 113.547 7.034 N89HD22-ND2 113.547 7.752 T90H-N 115.094 7.407 A91H-N 129.096 8.681 R92H-N 116.864 8.088 D94H-N 119.413 8.453 E95H-N 127.875 8.354 K96H-N 120.834 8.164 A97H-N 124.377 7.736 I98H-N 117.983 8.052 M99H-N 118.508 8.701 T100H-N 116.859 8.037 Y101H-N 124.965 7.995 V102H-N 118.963 9.143 S103H-N 116.602 8.568 S104H-N 118.239 7.723 F105H-N 123.735 7.822 Y106H-N 119.966 7.791 H107H-N 116.818 8.008 A108H-N 121.375 7.59 F109H-N 113.95 7.754 S110H-N 116.293 7.781 G111H-N 110.228 8.272 A112H-N 123.864 7.921 Q113H-N 125.128 8.073 Q113HE21-NE2 112.498 6.859 Q113HE22-NE2 112.498 7.533