Assignment w1 w2 V3H-N 120.72 8.251 S4H-N 119.258 8.309 L5H-N 124.874 8.312 S6H-N 115.991 8.152 Y7H-N 122.024 8.001 R8H-N 122.002 8.135 C9H-N 120.968 8.111 C11H-N 114.311 8.252 R12H-N 122.268 8.301 F13H-N 116.295 7.524 F14H-N 119.606 8.265 E15H-N 121.874 8.898 S16H-N 118.432 8.796 H17H-N 120.667 8.947 I18H-N 119.092 7.139 A19H-N 130.707 8.449 R20H-N 123.653 7.683 A21H-N 116.979 8.077 N22H-N 112.246 7.706 N22HD21-ND2 111.389 7.658 N22HD22-ND2 111.389 7.089 V23H-N 116.369 7.482 K24H-N 122.755 9.215 H25H-N 115.149 8.204 L26H-N 121.37 8.077 K27H-N 123.707 9.108 I28H-N 123.239 8.433 L29H-N 129.051 9.059 N30H-N 123.549 8.724 N30HD21-ND2 111.611 6.686 N30HD22-ND2 111.611 7.523 T31H-N 118.81 8.183 N33H-N 112.769 8.519 N33HD21-ND2 113.493 7.264 N33HD22-ND2 113.493 6.893 C34H-N 116.366 7.587 A35H-N 124.876 8.393 L36H-N 121.46 8.007 Q37H-N 123.227 8.452 Q37HE21-NE2 110.376 6.624 Q37HE22-NE2 110.376 7.285 I38H-N 124.747 9.327 V39H-N 123.395 8.789 A40H-N 125.311 9.148 R41H-N 118.028 8.442 L42H-N 124.573 8.943 K43H-N 120.613 8.366 N44H-N 114.271 8.633 N44HD21-ND2 112.381 7.604 N44HD22-ND2 112.381 6.782 N45H-N 114.876 7.403 N45HD21-ND2 109.224 7.45 N45HD22-ND2 109.224 6.488 N46H-N 116.177 8.068 N46HD21-ND2 112.268 6.887 N46HD22-ND2 112.268 7.554 R47H-N 120.126 7.969 Q48H-N 123.423 8.696 Q48HE21-NE2 111.801 7.518 Q48HE22-NE2 111.801 6.878 V49H-N 120.108 9.0 C50H-N 120.567 8.772 I51H-N 122.917 8.624 D52H-N 126.518 7.677 K54H-N 115.305 8.136 L55H-N 120.291 7.077 K56H-N 125.358 8.863 W57H-N 113.478 7.798 W57HE1-NE1 130.477 10.246 I58H-N 123.327 6.385 Q59H-N 120.718 7.801 Q59HE21-NE2 113.485 6.791 Q59HE22-NE2 113.485 7.557 E60H-N 118.041 8.079 Y61H-N 120.914 7.734 L62H-N 119.614 8.553 E63H-N 118.407 7.904 K64H-N 117.257 7.492 A65H-N 121.445 8.009 L66H-N 117.185 7.913 N67H-N 117.778 7.833 N67HD21-ND2 112.916 6.902 N67HD22-ND2 112.916 7.654 K68H-N 120.965 8.136 G69H-N 108.886 8.367 R70H-N 120.571 8.035 R71H-N 122.454 8.492 E72H-N 122.847 8.392 K74H-N 122.912 8.412 V75H-N 121.232 8.103 G76H-N 112.632 8.464 K77H-N 121.228 8.176 K78H-N 123.381 8.36 E79H-N 122.479 8.398 K80H-N 122.653 8.39 I81H-N 122.341 8.136 G82H-N 112.989 8.448 K83H-N 121.219 8.176 K85H-N 122.85 8.37 R86H-N 123.08 8.41 Q87H-N 122.644 8.482 K88H-N 123.968 8.446 K89H-N 122.75 8.328 R90H-N 123.66 8.41 K91H-N 123.539 8.408 A92H-N 126.2 8.358 A93H-N 123.871 8.302 Q94H-N 120.159 8.325 K95H-N 123.579 8.392 R96H-N 123.151 8.381 K97H-N 123.894 8.422 N98H-N 125.422 8.019 N98HD21-ND2 112.497 6.77 N98HD22-ND2 112.497 7.485