Assignment w1 w2 M1H-N 120.7 8.1 A2H-N 126.6 8.36 C3H-N 115.3 7.94 W4H-N 129.1 9.21 W4HE1-NE1 127.9 9.47 A5H-N 122.7 5.8 Q6H-N 122.7 7.26 Q6HE21-NE2 111.7 7.39 Q6HE22-NE2 111.7 6.83 S7H-N 115.9 8.12 Q8H-N 118.1 7.66 Q8HE21-NE2 110.9 7.11 Q8HE22-NE2 110.9 7.77 G9H-N 105.5 7.74 Y10H-N 118.4 7.45 N11H-N 115.6 8.72 N11HD21-ND2 113.4 7.52 N11HD22-ND2 113.4 6.93 C12H-N 117.1 8.36 C13H-N 121.2 8.45 N14H-N 123.0 9.4 N14HD21-ND2 114.0 7.06 N14HD22-ND2 114.0 7.58 N15H-N 115.2 8.99 N15HD21-ND2 113.2 7.57 N15HD22-ND2 113.2 6.83 S17H-N 111.4 8.44 S18H-N 114.2 7.64 T19H-N 120.3 7.26 K20H-N 129.1 8.65 V21H-N 126.8 8.62 E22H-N 129.8 9.59 Y23H-N 117.8 8.04 T24H-N 119.7 7.69 D25H-N 127.3 9.11 A26H-N 118.1 8.14 S27H-N 113.0 8.26 G28H-N 107.2 7.4 Q29H-N 116.9 8.17 Q29HE21-NE2 112.1 7.62 Q29HE22-NE2 112.1 6.91 W30H-N 121.0 9.05 W30HE1-NE1 130.0 9.98 G31H-N 110.9 9.42 V32H-N 118.1 8.78 Q33H-N 124.2 8.72 Q33HE21-NE2 112.7 7.31 Q33HE22-NE2 112.7 7.57 N34H-N 130.0 9.58 N34HD21-ND2 113.4 7.61 N34HD22-ND2 113.4 6.87 G35H-N 102.8 8.48 Q36H-N 119.1 7.58 Q36HE21-NE2 113.2 7.57 Q36HE22-NE2 113.2 6.86 W37H-N 123.8 8.42 W37HE1-NE1 127.8 9.62 C38H-N 116.9 9.58 G39H-N 108.9 8.51 I40H-N 128.4 8.84 D41H-N 131.7 8.73 Y42H-N 124.5 9.01 S43H-N 116.0 9.03 Y44H-N 125.0 7.9 G45H-N 112.6 7.76 Q46H-N 119.1 7.97 Q46HE21-NE2 112.1 6.83 Q46HE22-NE2 112.1 7.52 N47H-N 119.8 8.53 N47HD21-ND2 113.0 6.9 N47HD22-ND2 113.0 7.57 Q48H-N 120.5 8.4 Q48HE21-NE2 112.1 6.8 Q48HE22-NE2 112.1 7.42 G49H-N 109.7 8.45 N50H-N 118.9 8.33 E51H-N 120.2 8.32 S52H-N 116.4 8.21 C53H-N 117.7 8.7 T54H-N 116.3 7.37 G55H-N 113.3 8.84 N56H-N 116.9 8.61 N56HD21-ND2 113.4 6.96 N56HD22-ND2 113.4 7.65 G57H-N 107.0 8.88 S58H-N 117.0 8.08 Y59H-N 117.9 7.77 C61H-N 117.9 8.76 C62H-N 123.3 9.45 N63H-N 125.7 11.39 N63HD21-ND2 114.6 6.98 N63HD22-ND2 114.6 7.59 T64H-N 115.1 8.53 C65H-N 120.2 8.42 Q66H-N 123.9 8.53 Q66HE21-NE2 113.1 6.88 Q66HE22-NE2 113.1 7.61 A67H-N 129.0 8.4 T68H-N 111.6 9.39 Y69H-N 124.4 8.19 T70H-N 123.8 7.59 D71H-N 126.8 9.01 G72H-N 105.8 8.54 D73H-N 119.1 8.33 G74H-N 108.6 7.82 D75H-N 118.9 7.9 W76H-N 123.0 9.45 W76HE1-NE1 131.6 10.21 A77H-N 122.7 9.38 F78H-N 120.6 7.81 E79H-N 125.9 8.21 N80H-N 122.1 9.32 N80HD21-ND2 114.4 6.86 N80HD22-ND2 114.4 7.72 G81H-N 102.2 8.19 N82H-N 117.4 6.99 N82HD21-ND2 113.4 7.0 N82HD22-ND2 113.4 7.57 W83H-N 121.5 8.18 W83HE1-NE1 129.1 9.91 C84H-N 118.1 9.77 G85H-N 107.8 9.41 I86H-N 128.8 7.58 K87H-N 130.1 9.63 N88H-N 123.0 8.49 N88HD21-ND2 112.8 7.04 N88HD22-ND2 112.8 7.62 S89H-N 113.7 8.55 C90H-N 120.4 7.66 K91H-N 118.3 7.64 Q92H-N 119.8 7.87 Q92HE21-NE2 112.3 6.82 Q92HE22-NE2 112.3 7.49 Q93H-N 122.3 8.25 Q93HE21-NE2 112.1 6.79 Q93HE22-NE2 112.1 7.47 Q95H-N 120.5 8.5 N96H-N 119.8 8.41