Assignment w1 w2 R2H-N 118.08 9.06 E3H-N 124.23 8.95 M4H-N 130.09 7.62 G6H-N 109.41 8.42 G7H-N 108.23 7.96 V9H-N 109.09 7.01 R11H-N 118.18 8.55 K12H-N 115.55 7.53 H13H-N 114.39 8.39 Y14H-N 120.16 7.0 I15H-N 128.6 8.32 T16H-N 117.43 9.27 Y17H-N 117.44 8.66 R18H-N 119.03 8.36 I19H-N 127.2 9.18 N20H-N 128.51 9.69 N20HD21-ND2 111.4 7.6 N20HD22-ND2 111.4 6.99 N21H-N 113.29 7.82 N21HD21-ND2 114.2 7.54 N21HD22-ND2 114.2 7.05 Y22H-N 114.59 8.58 D25H-N 121.86 8.83 M26H-N 113.33 6.97 N27H-N 118.8 8.93 N27HD21-ND2 112.1 7.47 N27HD22-ND2 112.1 6.84 R28H-N 126.02 8.98 E29H-N 116.4 9.09 D30H-N 119.79 7.5 V31H-N 123.99 7.79 D32H-N 118.59 8.42 Y33H-N 119.72 8.23 A34H-N 121.47 8.08 I35H-N 114.08 8.09 R36H-N 119.83 8.29 K37H-N 119.29 8.55 A38H-N 123.2 8.0 F39H-N 113.9 7.72 Q40H-N 119.1 8.11 Q40HE21-NE2 112.6 6.92 Q40HE22-NE2 112.6 7.62 V41H-N 117.17 7.7 W42H-N 116.91 6.73 W42HE1-NE1 127.6 9.92 S43H-N 118.49 9.08 N44H-N 115.22 7.97 N44HD21-ND2 114.4 7.96 N44HD22-ND2 114.4 6.91 V45H-N 106.34 7.17 T46H-N 110.44 7.49 L48H-N 116.36 7.01 K49H-N 122.8 8.25 F50H-N 119.37 8.24 S51H-N 116.77 8.1 K52H-N 127.66 8.15 I53H-N 123.71 8.75 N54H-N 119.44 8.84 N54HD21-ND2 110.0 7.93 N54HD22-ND2 110.0 6.67 T55H-N 111.66 7.48 G56H-N 109.87 8.3 M57H-N 119.19 8.28 A58H-N 127.23 7.95 D59H-N 121.54 8.11 I60H-N 124.13 8.87 L61H-N 130.08 7.69 V62H-N 125.5 8.79 V63H-N 126.84 8.63 F64H-N 125.68 8.58 A65H-N 126.02 9.11 R66H-N 118.19 8.84 G67H-N 108.41 9.53 A68H-N 134.12 9.21 H69H-N 120.79 9.33 G70H-N 106.01 8.6 D71H-N 120.95 8.15 F72H-N 122.63 8.22 H73H-N 122.0 8.22 A74H-N 123.3 8.3 F75H-N 121.32 8.27 D76H-N 116.5 8.25 G77H-N 110.06 8.8 K78H-N 124.29 8.75 G79H-N 121.28 10.98 G80H-N 110.4 8.54 I81H-N 132.14 10.79 L82H-N 126.6 8.31 A83H-N 120.93 8.37 H84H-N 115.9 8.86 A85H-N 121.08 9.08 F86H-N 135.9 11.78 G87H-N 108.2 8.32 G89H-N 109.99 5.75 S90H-N 114.65 8.09 G91H-N 111.35 9.24 I92H-N 133.47 9.04 G93H-N 105.28 7.81 G94H-N 115.85 8.13 D95H-N 122.47 8.28 A96H-N 119.89 8.63 H97H-N 120.88 9.0 F98H-N 122.75 9.14 D99H-N 122.57 8.04 E100H-N 130.44 9.56 D101H-N 119.5 9.08 E102H-N 116.7 7.39 F103H-N 126.33 8.44 W104H-N 131.5 9.24 W104HE1-NE1 127.2 10.2 T105H-N 109.61 8.3 T106H-N 109.83 8.33 H107H-N 122.64 8.0 S108H-N 114.39 7.99 G109H-N 112.33 9.02 G110H-N 108.04 8.0 T111H-N 124.63 9.17 N112H-N 125.65 8.41 N112HD21-ND2 110.8 7.99 N112HD22-ND2 110.8 6.37 L113H-N 132.06 8.7 F114H-N 120.81 9.37 L115H-N 118.04 9.09 T116H-N 115.53 7.66 A117H-N 125.45 9.44 V118H-N 118.6 8.56 H119H-N 116.93 6.88 I121H-N 115.89 8.92 G122H-N 108.56 7.49 H123H-N 118.5 6.99 S124H-N 122.0 8.46 L125H-N 114.58 7.8 G126H-N 119.51 7.89 L127H-N 120.94 8.13 G128H-N 110.08 8.83 H129H-N 115.58 8.54 S130H-N 114.53 7.12 S131H-N 120.14 8.87 D132H-N 126.56 8.94 K134H-N 116.89 8.31 A135H-N 123.95 8.19 V136H-N 131.32 11.38 M137H-N 115.15 7.91 F138H-N 128.35 8.01 T140H-N 111.88 6.39 Y141H-N 127.95 8.41 K142H-N 127.45 7.42 Y143H-N 123.25 8.54 V144H-N 124.13 5.87 D145H-N 118.51 7.85 I146H-N 124.23 7.77 N147H-N 118.56 8.59 N147HD21-ND2 115.0 7.05 N147HD22-ND2 115.0 7.95 T148H-N 108.86 7.54 F149H-N 123.2 7.19 R150H-N 126.25 7.18 L151H-N 120.94 8.18 S152H-N 118.21 9.0 A153H-N 123.68 8.86 D154H-N 117.49 8.3 D155H-N 118.83 7.43 I156H-N 118.8 7.92 R157H-N 119.23 8.48 G158H-N 108.17 8.31 I159H-N 123.36 8.58 Q160H-N 123.72 8.68 Q160HE21-NE2 113.8 7.75 Q160HE22-NE2 113.8 6.97 S161H-N 115.85 7.98 L162H-N 119.0 6.98 Y163H-N 114.63 7.75 G164H-N 115.84 8.15