Assignment w1 w2 D1H-N 121.5 8.582 C2H-N 113.0 7.918 C3H-N 116.88 9.354 I4H-N 122.0 8.438 I5H-N 120.29 8.963 R6H-N 120.07 8.991 V7H-N 120.11 9.454 S8H-N 128.07 9.38 L9H-N 120.79 8.769 D10H-N 122.61 8.506 V11H-N 115.4 7.828 D12H-N 121.43 8.195 N13H-N 118.15 8.283 N13HD21-ND2 112.7 6.933 N13HD22-ND2 112.7 7.697 G14H-N 107.89 8.465 N15H-N 117.18 8.177 N15HD21-ND2 112.1 6.917 N15HD22-ND2 112.1 7.597 M16H-N 119.3 8.202 Y17H-N 120.76 8.197 K18H-N 118.67 8.368 S19H-N 119.19 8.785 I20H-N 122.38 9.222 L21H-N 126.86 8.367 V22H-N 127.72 9.269 T23H-N 115.89 8.887 S24H-N 114.89 8.126 Q25H-N 117.15 7.574 Q25HE21-NE2 112.6 6.869 Q25HE22-NE2 112.6 7.482 D26H-N 119.55 7.126 K27H-N 124.07 9.04 A28H-N 121.06 8.239 A30H-N 118.64 7.262 V31H-N 119.54 7.58 I32H-N 120.53 8.89 R33H-N 119.54 8.135 K34H-N 117.66 7.537 A35H-N 121.13 8.533 M36H-N 117.87 9.088 D37H-N 119.63 8.158 K38H-N 118.65 7.577 H39H-N 116.57 7.541 N40H-N 113.55 7.96 N40HD21-ND2 112.3 6.812 N40HD22-ND2 112.3 7.824 L41H-N 119.25 8.16 E42H-N 120.24 8.815 E43H-N 115.1 8.681 E44H-N 118.95 7.431 E45H-N 120.3 9.08 E47H-N 114.98 8.865 D48H-N 117.48 7.995 Y49H-N 119.24 8.094 E50H-N 116.37 9.18 L51H-N 123.28 9.317 L52H-N 123.16 9.056 Q53H-N 124.73 9.563 Q53HE21-NE2 106.1 7.086 Q53HE22-NE2 106.1 7.145 I54H-N 127.7 8.705 L55H-N 127.22 8.207 S56H-N 112.61 8.218 D57H-N 118.05 8.75 D58H-N 113.31 8.336 R59H-N 119.25 7.347 K60H-N 120.63 8.422 L61H-N 125.33 9.174 K62H-N 127.93 8.914 I63H-N 128.89 8.71 E65H-N 118.73 8.674 N66H-N 113.9 8.372 N66HD21-ND2 111.7 6.91 N66HD22-ND2 111.7 7.619 A67H-N 120.52 7.711 N68H-N 119.16 8.795 N68HD21-ND2 112.1 7.132 N68HD22-ND2 112.1 7.434 V69H-N 126.82 7.541 F70H-N 119.2 9.615 Y71H-N 113.09 7.545 A72H-N 121.21 8.055 M73H-N 114.8 7.857 N74H-N 120.31 9.627 N74HD21-ND2 111.9 7.001 N74HD22-ND2 111.9 7.291 S75H-N 119.16 8.746 T76H-N 113.12 8.175 A77H-N 125.15 7.484 N78H-N 115.59 8.039 N78HD21-ND2 113.2 6.909 N78HD22-ND2 113.2 7.644 Y79H-N 124.35 8.526 D80H-N 120.46 7.783 F81H-N 119.64 9.493 V82H-N 118.43 9.76 L83H-N 125.33 8.443 K84H-N 126.04 9.036 K85H-N 128.12 9.016 R86H-N 125.9 8.58 T87H-N 120.1 7.765