Assignment w1 w2 E2H-N 121.9 9.46 A3H-N 121.0 8.02 F4H-N 111.3 8.02 C5H-N 116.7 7.44 A6H-N 129.5 8.42 T7H-N 115.5 7.85 W8H-N 127.8 9.71 W8HE1-NE1 129.3 10.07 K9H-N 121.1 9.81 L10H-N 125.7 7.77 T11H-N 118.2 9.54 N12H-N 118.4 7.65 N12HD21-ND2 111.1 7.77 N12HD22-ND2 111.1 7.23 Q14H-N 127.3 9.34 Q14HE21-NE2 112.1 7.64 Q14HE22-NE2 112.1 6.89 N15H-N 122.6 9.42 N15HD21-ND2 114.6 7.38 N15HD22-ND2 114.6 6.77 F16H-N 119.8 8.74 D17H-N 119.8 8.7 E18H-N 117.9 8.25 Y19H-N 121.0 7.61 M20H-N 116.9 8.24 K21H-N 119.0 8.52 A22H-N 124.0 8.07 L23H-N 116.3 7.38 G24H-N 106.0 7.61 V25H-N 122.0 7.55 G26H-N 115.8 8.94 F27H-N 121.0 8.69 A28H-N 120.8 8.83 T29H-N 115.8 7.61 R30H-N 122.9 8.44 Q31H-N 116.2 7.73 Q31HE21-NE2 113.5 6.84 Q31HE22-NE2 113.5 6.82 V32H-N 116.9 6.8 G33H-N 110.7 8.87 N34H-N 116.8 8.29 N34HD21-ND2 112.8 7.41 N34HD22-ND2 112.8 6.8 V35H-N 112.3 7.27 T36H-N 117.8 7.48 T39H-N 117.6 8.56 V40H-N 128.7 9.78 I41H-N 128.2 9.82 I42H-N 130.2 8.37 S43H-N 121.9 9.26 Q44H-N 118.0 8.5 Q44HE21-NE2 110.5 6.75 Q44HE22-NE2 110.5 7.33 E45H-N 125.7 8.52 G46H-N 117.2 8.97 D47H-N 126.7 8.75 K48H-N 118.6 7.79 V49H-N 125.2 8.59 V50H-N 125.0 8.59 I51H-N 122.5 8.64 R52H-N 132.4 9.48 R52HE-NE 85.1 7.29 T53H-N 121.6 9.01 L54H-N 127.5 9.74 S55H-N 115.6 8.56 F57H-N 120.4 7.66 K58H-N 115.6 6.88 N59H-N 123.3 8.61 N59HD21-ND2 110.9 7.4 N59HD22-ND2 110.9 6.46 T60H-N 112.3 9.4 E61H-N 122.7 8.68 I62H-N 119.0 8.38 S63H-N 115.4 8.11 F64H-N 119.6 8.07 Q65H-N 117.6 8.86 Q65HE21-NE2 111.7 7.54 Q65HE22-NE2 111.7 6.79 L66H-N 126.5 9.21 G67H-N 110.1 9.52 E68H-N 120.3 7.76 E69H-N 130.7 8.97 F70H-N 123.6 9.45 D71H-N 119.9 8.51 E72H-N 125.8 8.71 T73H-N 125.8 9.02 T74H-N 118.8 8.87 A75H-N 122.5 9.49 D76H-N 110.2 9.07 D77H-N 115.1 7.98 R78H-N 116.5 7.39 R78HH21-NH2 72.8 6.15 R78HH22-NH2 72.8 6.15 R78HE-NE 89.4 9.53 N79H-N 122.1 8.71 N79HD21-ND2 113.4 7.53 N79HD22-ND2 113.4 6.92 C80H-N 120.8 9.19 K81H-N 123.3 9.05 S82H-N 124.5 9.05 V83H-N 117.3 8.22 V84H-N 130.8 9.77 S85H-N 120.6 9.16 L86H-N 122.5 8.79 D87H-N 126.8 9.03 G88H-N 114.9 8.79 D89H-N 126.0 8.66 K90H-N 119.1 7.91 L91H-N 122.9 8.49 V92H-N 131.0 9.64 H93H-N 131.1 9.14 H93HE2-ND1 163.2 11.93 I94H-N 126.6 9.27 Q95H-N 126.2 8.53 Q95HE21-NE2 112.9 6.98 Q95HE22-NE2 112.9 6.28 K96H-N 121.2 8.7 W97H-N 128.0 8.36 W97HE1-NE1 129.2 10.16 D98H-N 122.1 9.21 G99H-N 103.9 8.39 K100H-N 122.9 8.41 E101H-N 110.7 8.1 T102H-N 117.5 9.01 N103H-N 120.0 8.01 N103HD21-ND2 115.8 7.78 N103HD22-ND2 115.8 6.87 F104H-N 119.3 9.33 V105H-N 127.3 9.36 R106H-N 127.1 9.23 E107H-N 121.0 8.93 I108H-N 123.9 9.05 K109H-N 128.5 9.12 G111H-N 102.9 8.31 K112H-N 121.3 7.92 M113H-N 122.1 8.21 V114H-N 128.7 9.21 M115H-N 130.3 9.73 T116H-N 124.9 9.35 L117H-N 132.7 9.87 T118H-N 116.6 8.82 F119H-N 131.7 9.75 G120H-N 119.0 9.12 D121H-N 126.2 8.63 V122H-N 123.6 8.48 V123H-N 127.4 8.36 A124H-N 130.7 9.7 V125H-N 119.4 8.56 R126H-N 128.5 9.54 H127H-N 121.9 8.64 Y128H-N 120.5 9.46 E129H-N 120.0 9.16 K130H-N 125.1 9.21 A131H-N 133.4 8.48