Assignment w1 w2 G3H-N 109.906 8.637 S4H-N 115.369 8.058 Y5H-N 121.995 8.208 A6H-N 127.237 8.045 L8H-N 123.046 8.595 D9H-N 117.407 8.389 T10H-N 116.01 7.88 E11H-N 119.387 8.598 L12H-N 120.406 7.563 S13H-N 114.509 8.465 E14H-N 121.291 7.66 I15H-N 119.944 7.726 E16H-N 119.942 8.716 G17H-N 103.36 7.426 L18H-N 121.142 7.394 Q19H-N 121.433 9.181 Q19HE21-NE2 113.73 7.539 Q19HE22-NE2 113.73 6.899 D20H-N 122.285 8.861 D21H-N 117.147 8.857 D22H-N 119.462 7.385 L23H-N 121.195 8.148 A24H-N 122.032 8.243 A25H-N 119.329 7.306 L26H-N 117.944 7.448 L27H-N 115.234 8.084 G28H-N 107.668 7.716 K29H-N 124.948 8.808 E30H-N 117.198 8.079 F31H-N 119.069 7.482 I32H-N 128.993 8.677 R33H-N 126.677 8.305 R33HE-NE 84.653 7.322 E34H-N 123.82 8.621 G35H-N 111.154 8.62 G37H-N 108.819 8.357 S38H-N 115.689 8.401 G39H-N 110.982 8.562 G40H-N 108.621 8.299 S46H-N 115.657 8.308 M47H-N 121.766 8.449 N48H-N 119.711 8.378 N48HD21-ND2 113.021 7.591 N48HD22-ND2 113.021 6.925 K49H-N 122.854 8.241 T51H-N 114.254 8.391 S52H-N 117.776 8.416 S53H-N 117.867 8.53 D54H-N 121.713 8.32 G55H-N 109.535 8.411 W56H-N 119.982 8.042 W56HE1-NE1 130.161 10.36 K57H-N 122.806 7.256 D58H-N 118.461 7.752 D59H-N 120.36 8.083 Y60H-N 122.423 8.182 L61H-N 117.087 8.862 S62H-N 114.102 7.938 R63H-N 120.783 7.57 R63HE-NE 85.03 7.344 L64H-N 120.9 8.676 S65H-N 110.678 8.025 R66H-N 119.628 7.121 R66HE-NE 84.849 7.213 L67H-N 120.173 7.498 S68H-N 116.23 9.213 K69H-N 121.056 9.05 N70H-N 116.482 8.578 N70HD21-ND2 111.971 7.405 N70HD22-ND2 111.971 6.761 Q71H-N 118.295 7.936 Q71HE21-NE2 115.053 7.593 Q71HE22-NE2 115.053 7.318 L72H-N 119.869 8.689 M73H-N 118.903 8.653 A74H-N 119.392 7.92 L75H-N 119.692 8.606 A76H-N 120.747 8.292 L77H-N 116.297 8.07 K78H-N 119.294 8.177 L79H-N 118.605 8.706 K80H-N 121.631 8.722 Q81H-N 118.782 8.848 Q81HE21-NE2 111.161 7.62 Q81HE22-NE2 111.161 6.857 Q82H-N 117.095 7.935 Q82HE21-NE2 110.523 7.213 Q82HE22-NE2 110.523 7.329 Q83H-N 118.825 7.624 Q83HE21-NE2 111.633 7.679 Q83HE22-NE2 111.633 7.005 L84H-N 118.382 7.733 E85H-N 118.644 7.845 Q86H-N 119.465 7.875 Q86HE21-NE2 112.437 7.567 Q86HE22-NE2 112.437 6.855 G87H-N 115.487 7.924 G3H-N 109.906 8.637 S4H-N 115.369 8.058 Y5H-N 121.995 8.208 A6H-N 127.237 8.045 L8H-N 123.046 8.595 D9H-N 117.407 8.389 T10H-N 116.01 7.88 E11H-N 119.387 8.598 L12H-N 120.406 7.563 S13H-N 114.509 8.465 E14H-N 121.291 7.66 I15H-N 119.944 7.726 E16H-N 119.942 8.716 G17H-N 103.36 7.426 L18H-N 121.142 7.394 Q19H-N 121.433 9.181 Q19HE21-NE2 113.73 7.539 Q19HE22-NE2 113.73 6.899 D20H-N 122.285 8.861 D21H-N 117.147 8.857 D22H-N 119.462 7.385 L23H-N 121.195 8.148 A24H-N 122.032 8.243 A25H-N 119.329 7.306 L26H-N 117.944 7.448 L27H-N 115.234 8.084 G28H-N 107.668 7.716 K29H-N 124.948 8.808 E30H-N 117.198 8.079 F31H-N 119.069 7.482 I32H-N 128.993 8.677 R33H-N 126.677 8.305 R33HE-NE 84.653 7.322 E34H-N 123.82 8.621 G35H-N 111.154 8.62 G37H-N 108.819 8.357 S38H-N 115.689 8.401 G39H-N 110.982 8.562 G40H-N 108.621 8.299 S46H-N 115.657 8.308 M47H-N 121.766 8.449 N48H-N 119.711 8.378 N48HD21-ND2 113.021 7.591 N48HD22-ND2 113.021 6.925 K49H-N 122.854 8.241 T51H-N 114.254 8.391 S52H-N 117.776 8.416 S53H-N 117.867 8.53 D54H-N 121.713 8.32 G55H-N 109.535 8.411 W56H-N 119.982 8.042 W56HE1-NE1 130.161 10.36 K57H-N 122.806 7.256 D58H-N 118.461 7.752 D59H-N 120.36 8.083 Y60H-N 122.423 8.182 L61H-N 117.087 8.862 S62H-N 114.102 7.938 R63H-N 120.783 7.57 R63HE-NE 85.03 7.344 L64H-N 120.9 8.676 S65H-N 110.678 8.025 R66H-N 119.628 7.121 R66HE-NE 84.849 7.213 L67H-N 120.173 7.498 S68H-N 116.23 9.213 K69H-N 121.056 9.05 N70H-N 116.482 8.578 N70HD21-ND2 111.971 7.405 N70HD22-ND2 111.971 6.761 Q71H-N 118.295 7.936 Q71HE21-NE2 115.053 7.593 Q71HE22-NE2 115.053 7.318 L72H-N 119.869 8.689 M73H-N 118.903 8.653 A74H-N 119.392 7.92 L75H-N 119.692 8.606 A76H-N 120.747 8.292 L77H-N 116.297 8.07 K78H-N 119.294 8.177 L79H-N 118.605 8.706 K80H-N 121.631 8.722 Q81H-N 118.782 8.848 Q81HE21-NE2 111.161 7.62 Q81HE22-NE2 111.161 6.857 Q82H-N 117.095 7.935 Q82HE21-NE2 110.523 7.213 Q82HE22-NE2 110.523 7.329 Q83H-N 118.825 7.624 Q83HE21-NE2 111.633 7.679 Q83HE22-NE2 111.633 7.005 L84H-N 118.382 7.733 E85H-N 118.644 7.845 Q86H-N 119.465 7.875 Q86HE21-NE2 112.437 7.567 Q86HE22-NE2 112.437 6.855 G87H-N 115.487 7.924