Assignment w1 w2 M1H-N 120.24 8.42 G2H-N 108.98 8.53 S3H-N 115.29 8.33 S4H-N 117.38 8.54 H5H-N 119.81 8.59 H5HD1-ND1 191.978 11.525 H5HE2-ND1 177.51 12.386 H6H-N 118.94 8.63 H6HD1-ND1 191.978 11.525 H6HE2-ND1 177.51 12.386 H7H-N 119.28 8.71 H7HD1-ND1 191.978 11.525 H7HE2-ND1 177.51 12.386 H8H-N 119.28 8.71 H8HD1-ND1 191.978 11.525 H8HE2-ND1 177.51 12.386 H9H-N 119.34 8.72 H9HD1-ND1 191.978 11.525 H9HE2-ND1 177.51 12.386 H10H-N 119.86 8.73 H10HD1-ND1 191.978 11.525 H10HE2-ND1 177.51 12.386 S11H-N 117.32 8.6 S12H-N 118.16 8.59 G13H-N 109.5 8.45 L14H-N 121.91 8.11 V15H-N 119.97 8.12 R17H-N 121.95 8.5 R17HH11-NH1 73.004 6.815 R17HH12-NH1 73.004 6.76 R17HH21-NH2 73.959 6.761 R17HH22-NH2 73.959 6.737 G18H-N 108.8 8.4 S19H-N 114.83 8.33 H20H-N 120.45 8.62 H20HD1-ND1 191.978 11.525 H20HE2-ND1 177.51 12.386 M21H-N 121.31 8.4 W22H-N 123.64 8.32 W22HE1-NE1 129.539 10.63 V23H-N 122.23 8.12 R24H-N 124.81 7.91 R24HH11-NH1 73.004 6.815 R24HH12-NH1 73.004 6.76 R24HH21-NH2 73.959 6.761 R24HH22-NH2 73.959 6.737 S25H-N 116.8 8.47 K26H-N 123.89 8.43 L27H-N 123.42 8.3 K28H-N 122.39 8.39 I29H-N 121.82 8.22 T30H-N 116.37 8.32 E31H-N 122.72 8.39 V32H-N 120.3 8.2 A33H-N 128.84 8.38 K34H-N 120.59 8.17 R36H-N 121.8 8.48 R36HH11-NH1 73.004 6.815 R36HH12-NH1 73.004 6.76 R36HH21-NH2 73.959 6.761 R36HH22-NH2 73.959 6.737 T37H-N 112.95 8.09 I39H-N 120.82 8.25 A40H-N 129.58 8.39 G41H-N 106.54 8.34 A42H-N 124.64 8.18 S43H-N 114.55 8.33 T45H-N 112.32 8.32 E46H-N 122.49 8.39 N47H-N 120.19 8.58 N47HD21-ND2 112.876 7.59 N47HD22-ND2 112.876 7.01 M48H-N 120.87 8.47 G49H-N 108.58 8.4 I50H-N 119.79 7.98 F51H-N 125.37 8.46 Q52H-N 123.19 8.42 Q52HE21-NE2 111.898 7.5 Q52HE22-NE2 111.898 6.91 S53H-N 116.46 8.18 L54H-N 124.57 8.34 K55H-N 121.75 8.37 H56H-N 119.17 8.58 H56HD1-ND1 191.978 11.525 H56HE2-ND1 177.51 12.386 N57H-N 120.42 8.58 N57HD21-ND2 112.876 7.59 N57HD22-ND2 112.876 7.01 I58H-N 121.24 8.28 Q59H-N 124.88 8.5 Q59HE21-NE2 111.898 7.5 Q59HE22-NE2 111.898 6.91 K60H-N 122.83 8.37 A61H-N 126.25 8.39 R62H-N 120.31 8.36 R62HH11-NH1 73.004 6.815 R62HH12-NH1 73.004 6.76 R62HH21-NH2 73.959 6.761 R62HH22-NH2 73.959 6.737 D63H-N 120.31 8.58 Q64H-N 120.91 8.46 Q64HE21-NE2 111.898 7.5 Q64HE22-NE2 111.898 6.91 A65H-N 126.07 8.36 E66H-N 119.37 8.39 R67H-N 122.36 8.41 R67HH11-NH1 73.004 6.815 R67HH12-NH1 73.004 6.76 R67HH21-NH2 73.959 6.761 R67HH22-NH2 73.959 6.737 R68H-N 122.5 8.45 R68HH11-NH1 73.004 6.815 R68HH12-NH1 73.004 6.76 R68HH21-NH2 73.959 6.761 R68HH22-NH2 73.959 6.737 Q69H-N 121.86 8.5 Q69HE21-NE2 111.898 7.5 Q69HE22-NE2 111.898 6.91 L70H-N 123.7 8.34 M71H-N 121.03 8.46 Q72H-N 121.63 8.47 Q72HE21-NE2 111.898 7.5 Q72HE22-NE2 111.898 6.91 D73H-N 120.34 8.61 N74H-N 119.54 8.56 N74HD21-ND2 112.876 7.59 N74HD22-ND2 112.876 7.01 E75H-N 120.52 8.39 K76H-N 122.68 8.41 K77H-N 122.85 8.39 L78H-N 123.71 8.33 Q79H-N 121.23 8.49 Q79HE21-NE2 111.898 7.5 Q79HE22-NE2 111.898 6.91 E80H-N 121.55 8.41 S81H-N 116.4 8.4 F82H-N 122.87 8.36 K83H-N 123.95 8.35 E84H-N 121.05 8.14 K85H-N 122.85 8.42 R86H-N 122.33 8.43 R86HH11-NH1 73.004 6.815 R86HH12-NH1 73.004 6.76 R86HH21-NH2 73.959 6.761 R86HH22-NH2 73.959 6.737 Q87H-N 121.74 8.5 Q87HE21-NE2 111.898 7.5 Q87HE22-NE2 111.898 6.91 N88H-N 120.47 8.57 N88HD21-ND2 112.876 7.59 N88HD22-ND2 112.876 7.01 S89H-N 115.93 8.46 K90H-N 123.78 8.39 I91H-N 121.42 8.19 K92H-N 126.03 8.4 I93H-N 121.71 8.16 V94H-N 123.5 8.23 H95H-N 122.18 8.61 H95HD1-ND1 191.978 11.525 H95HE2-ND1 177.51 12.386 K96H-N 123.01 8.44 S97H-N 116.8 8.51 N98H-N 120.82 8.48 N98HD21-ND2 112.876 7.59 N98HD22-ND2 112.876 7.01 F99H-N 121.08 8.29 I100H-N 122.57 8.16 N101H-N 123.09 8.28 N101HD21-ND2 112.876 7.59 N101HD22-ND2 112.876 7.01 N102H-N 119.61 8.52 N102HD21-ND2 112.876 7.59 N102HD22-ND2 112.876 7.01 K103H-N 122.1 8.39 K104H-N 123.0 8.43