Assignment w1 w2 L2H-N 130.6 9.49 S3H-N 120.6 9.13 I4H-N 125.1 8.84 L5H-N 129.9 8.57 V6H-N 129.2 9.03 A7H-N 131.7 10.21 H8H-N 115.8 8.71 D9H-N 122.4 8.47 L10H-N 115.3 8.16 Q11H-N 118.9 9.48 Q11HE21-NE2 113.4 8.27 Q11HE22-NE2 113.4 7.09 R12H-N 109.1 8.14 R12HE-NE 83.6 5.88 V13H-N 123.2 9.41 I14H-N 113.7 8.42 G15H-N 106.8 7.05 F16H-N 119.0 8.64 E17H-N 129.6 9.92 N18H-N 112.1 9.31 N18HD21-ND2 110.5 7.49 N18HD22-ND2 110.5 6.68 Q19H-N 116.0 7.66 Q19HE21-NE2 112.0 7.46 Q19HE22-NE2 112.0 6.96 L20H-N 120.6 8.78 W22H-N 109.6 5.49 W22HE1-NE1 128.4 10.4 H23H-N 119.8 8.69 L24H-N 126.2 8.83 N26H-N 116.5 9.95 N26HD21-ND2 113.1 9.19 N26HD22-ND2 113.1 7.29 D27H-N 119.1 7.72 L28H-N 117.1 7.02 K29H-N 119.4 8.32 H30H-N 122.0 7.59 V31H-N 113.5 8.03 K32H-N 122.6 7.94 K33H-N 121.4 8.12 L34H-N 117.1 7.82 S35H-N 103.2 6.86 T36H-N 121.1 7.16 G37H-N 114.0 8.73 H38H-N 120.0 7.63 T39H-N 116.0 8.09 L40H-N 125.6 9.28 V41H-N 120.8 8.93 M42H-N 124.9 9.1 G43H-N 107.1 9.45 R44H-N 118.3 7.39 R44HE-NE 84.2 9.08 K45H-N 114.5 7.48 T46H-N 121.6 8.61 F47H-N 119.4 7.89 E48H-N 117.6 8.44 S49H-N 112.9 7.83 I50H-N 118.3 7.61 G51H-N 108.3 8.62 K52H-N 117.8 6.96 L54H-N 124.2 8.92 R57H-N 110.9 7.63 R57HE-NE 82.9 6.28 R58H-N 121.2 8.62 R58HE-NE 84.4 7.71 N59H-N 127.3 9.66 N59HD21-ND2 112.7 7.76 N59HD22-ND2 112.7 6.72 V60H-N 124.2 8.96 V61H-N 127.1 8.61 L62H-N 128.7 8.25 T63H-N 119.6 8.15 S64H-N 125.0 10.02 D65H-N 125.6 9.06 T66H-N 117.6 8.26 S67H-N 118.4 8.93 F68H-N 125.8 7.27 N69H-N 126.6 8.17 N69HD21-ND2 112.0 7.46 N69HD22-ND2 112.0 6.78 V70H-N 125.1 8.22 E71H-N 127.7 8.54 G72H-N 112.1 8.84 V73H-N 118.8 7.79 D74H-N 127.0 8.77 V75H-N 120.8 8.5 I76H-N 120.1 8.57 H77H-N 114.1 8.29 S78H-N 112.9 7.48 I79H-N 124.7 8.86 E80H-N 117.1 8.37 D81H-N 117.5 7.44 I82H-N 119.8 7.98 Y83H-N 114.7 6.75 Q84H-N 113.5 7.17 Q84HE21-NE2 112.5 7.62 Q84HE22-NE2 112.5 6.88 L85H-N 122.5 7.27 G87H-N 106.3 8.5 H88H-N 125.2 9.58 V89H-N 129.4 8.73 F90H-N 124.3 9.37 I91H-N 124.0 9.94 F92H-N 131.5 9.8 G93H-N 100.3 6.47 G94H-N 113.1 7.97 Q95H-N 123.2 7.27 Q95HE21-NE2 111.9 8.12 Q95HE22-NE2 111.9 6.92 T96H-N 112.9 9.48 L97H-N 123.1 6.82 Y98H-N 118.9 8.6 E99H-N 115.9 8.84 E100H-N 115.1 7.19 M101H-N 111.4 7.9 I102H-N 123.7 8.44 D103H-N 116.8 8.32 K104H-N 116.8 8.22 V105H-N 109.1 7.28 D106H-N 120.2 9.47 D107H-N 115.5 8.3 M108H-N 113.4 9.26 Y109H-N 124.9 9.58 I110H-N 125.5 8.72 T111H-N 126.9 9.28 V112H-N 127.7 9.15 I113H-N 130.8 8.71 E114H-N 128.3 8.38 G115H-N 110.5 8.43 K116H-N 118.4 7.9 F117H-N 125.2 9.65 R118H-N 121.3 8.33 G119H-N 108.2 8.25 D120H-N 116.4 9.44 T121H-N 113.1 7.4 F122H-N 122.3 8.95 F123H-N 124.4 9.61 Y126H-N 114.5 7.16 T127H-N 113.4 9.13 F128H-N 121.9 8.84 E129H-N 116.9 8.29 D130H-N 115.1 7.39 W131H-N 119.4 7.53 W131HE1-NE1 130.9 10.2 E132H-N 121.1 9.52 V133H-N 125.4 9.0 A134H-N 134.6 9.27 S135H-N 108.4 7.73 S136H-N 117.2 8.34 V137H-N 127.3 8.87 E138H-N 128.0 8.8 G139H-N 114.4 8.59 K140H-N 125.0 8.29 L141H-N 123.5 8.26 D142H-N 120.8 8.82 E143H-N 115.9 8.92 K144H-N 115.0 7.97 N145H-N 121.2 7.94 N145HD21-ND2 116.9 8.8 N145HD22-ND2 116.9 6.42 T146H-N 108.6 8.63 I147H-N 122.3 6.74 H149H-N 117.3 8.16 T150H-N 116.4 8.25 F151H-N 124.0 9.26 L152H-N 127.5 10.08 H153H-N 123.9 8.62 L154H-N 128.6 9.54 I155H-N 119.3 9.34 R156H-N 127.5 8.15 R156HE-NE 81.6 6.75 K157H-N 126.4 7.86 K158H-N 129.2 8.0