Assignment w1 w2 T2H-N 115.777 8.613 S3H-N 119.576 8.512 T4H-N 117.587 8.305 K5H-N 124.706 8.289 K6H-N 123.73 8.317 L7H-N 123.824 8.167 H8H-N 119.016 8.573 K9H-N 123.661 8.412 E10H-N 124.067 9.009 A12H-N 121.175 8.153 T13H-N 110.418 8.191 L14H-N 126.345 9.2 I15H-N 126.278 8.461 K16H-N 115.724 8.051 A17H-N 131.232 9.588 I18H-N 125.994 8.067 D19H-N 118.98 8.255 G20H-N 104.383 8.576 D21H-N 113.205 8.011 T22H-N 116.747 7.616 V23H-N 122.912 9.131 K24H-N 128.363 9.357 L25H-N 127.508 9.451 M26H-N 122.915 9.618 Y27H-N 131.409 9.09 K28H-N 128.177 9.275 G29H-N 103.011 8.383 Q30H-N 120.818 7.991 M32H-N 127.121 9.44 T33H-N 120.199 8.951 F34H-N 126.208 9.092 R35H-N 123.505 9.201 R35HE-NE 125.488 7.271 L36H-N 125.544 8.912 L37H-N 126.713 7.562 L38H-N 128.062 8.674 V39H-N 120.705 7.807 D40H-N 123.842 8.427 T41H-N 115.584 8.143 E43H-N 118.945 8.438 T44H-N 115.213 7.916 K45H-N 123.621 8.184 H46H-N 119.481 8.341 K48H-N 122.689 8.54 K49H-N 122.889 8.366 G50H-N 111.326 8.485 V51H-N 119.53 7.988 E52H-N 125.134 8.626 K53H-N 122.313 8.189 Y54H-N 120.809 8.184 G55H-N 110.419 8.497 E57H-N 120.421 8.951 A58H-N 124.421 8.374 S59H-N 113.371 8.102 A60H-N 123.586 7.965 F61H-N 121.243 8.009 T62H-N 119.458 8.679 K63H-N 120.632 7.71 K64H-N 117.921 7.674 M65H-N 117.236 7.768 V66H-N 109.992 8.047 E67H-N 121.109 8.615 N68H-N 114.262 7.457 N68HD21-ND2 114.31 7.817 N68HD22-ND2 114.31 7.045 A69H-N 122.569 6.792 K70H-N 126.269 10.125 K71H-N 122.412 8.953 I72H-N 129.61 9.015 E73H-N 124.242 8.847 V74H-N 119.245 9.742 E75H-N 127.012 8.946 F76H-N 123.448 8.739 D77H-N 121.259 9.067 K78H-N 128.853 8.699 G79H-N 108.242 8.751 Q80H-N 119.011 7.393 R81H-N 120.989 8.358 R81HE-NE 125.715 7.252 T82H-N 114.943 7.799 D83H-N 119.567 7.834 K84H-N 117.513 8.258 Y85H-N 119.173 7.869 G86H-N 110.117 8.173 R87H-N 119.466 8.266 R87HE-NE 125.262 8.768 W88H-N 124.319 8.235 W88HE1-NE1 130.6 9.872 L89H-N 128.116 9.386 A90H-N 124.313 8.887 Y91H-N 121.158 8.898 I92H-N 122.567 8.331 Y93H-N 126.65 9.525 A94H-N 126.753 9.331 D95H-N 127.957 9.784 G96H-N 104.079 9.411 K97H-N 122.067 7.896 M98H-N 126.785 9.283 V99H-N 136.012 9.933 E101H-N 114.947 6.602 A102H-N 123.326 7.632 L103H-N 118.38 8.094 V104H-N 117.529 7.154 R105H-N 121.917 8.317 R105HE-NE 125.566 7.555 Q106H-N 117.628 7.77 G107H-N 108.228 7.937 L108H-N 119.462 7.624 A109H-N 123.673 7.808 K110H-N 125.978 7.801