Assignment w1 w2 M2H-N 119.3 8.56 A3H-N 125.5 8.49 H4H-N 121.1 8.72 E5H-N 122.8 8.48 E6H-N 120.7 8.81 G8H-N 109.2 8.33 C10H-N 125.3 8.48 N11H-N 125.4 6.91 N11HD21-ND2 114.1 7.58 N11HD22-ND2 114.1 7.18 S12H-N 111.0 7.99 N13H-N 118.0 8.1 N13HD21-ND2 114.1 6.89 N13HD22-ND2 114.1 6.13 A14H-N 126.2 8.44 C16H-N 106.9 7.62 Y17H-N 123.4 8.18 H18H-N 122.1 7.99 C19H-N 118.0 8.42 D20H-N 119.7 8.76 A21H-N 120.2 8.48 N22H-N 114.3 8.37 N22HD21-ND2 114.2 8.03 N22HD22-ND2 114.2 6.81 G23H-N 108.7 8.33 E24H-N 118.8 8.04 N25H-N 115.7 9.07 N25HD21-ND2 117.6 7.83 N25HD22-ND2 117.6 7.1 C26H-N 118.6 8.96 S27H-N 116.5 8.28 C28H-N 118.2 8.81 N29H-N 115.3 7.81 N29HD21-ND2 112.9 7.78 N29HD22-ND2 112.9 7.23 C30H-N 126.1 9.35 E31H-N 119.0 8.64 L32H-N 117.0 7.2 F33H-N 123.9 6.97 D34H-N 129.4 8.83 C35H-N 124.2 8.69 E36H-N 116.7 8.58 A37H-N 122.3 7.64 K38H-N 121.2 8.88 K39H-N 121.5 8.96 D41H-N 112.5 7.41 G42H-N 108.9 8.37 S43H-N 117.4 8.23 Y44H-N 119.3 8.65 A45H-N 125.2 8.63 H46H-N 123.5 9.74 H46HE2-ND1 163.4 11.23 C48H-N 117.4 10.34 R49H-N 120.2 6.94 R49HE-NE 84.4 6.11 R50H-N 130.4 9.11 R50HE-NE 85.6 7.42 C51H-N 121.9 8.89 D52H-N 123.8 8.31 A53H-N 119.7 8.31 N54H-N 115.7 8.29 N54HD21-ND2 114.4 7.79 N54HD22-ND2 114.4 6.9 N55H-N 114.5 8.31 N55HD21-ND2 111.9 7.52 N55HD22-ND2 111.9 6.73 I56H-N 120.0 8.18 C57H-N 128.5 8.82 K58H-N 121.7 8.6 C59H-N 117.2 8.69 S60H-N 112.6 6.96 T62H-N 109.7 7.89 A63H-N 122.8 7.32 I64H-N 120.7 6.82 C66H-N 120.2 9.19 N67H-N 126.2 7.67 N67HD21-ND2 114.5 7.81 N67HD22-ND2 114.5 7.09 E68H-N 115.9 9.08 D69H-N 116.8 7.99 H70H-N 126.8 8.48 H70HE2-ND1 164.5 11.29 C72H-N 119.5 11.4 H73H-N 120.2 7.74 E78H-N 122.9 8.59 D79H-N 122.1 8.73 D80H-N 118.8 8.35 G81H-N 107.4 8.21 D82H-N 121.3 8.03 T83H-N 115.1 8.41 H84H-N 121.5 8.7 H95H-N 125.2 9.27 H96H-N 120.7 7.69 D97H-N 121.3 8.67 D98H-N 123.7 8.88 D99H-N 118.0 8.42 T100H-N 117.3 7.3 H101H-N 127.5 8.78 G102H-N 110.1 6.13 E103H-N 115.3 7.03 C104H-N 123.7 10.06 T105H-N 119.3 6.88 K106H-N 116.4 7.43 K107H-N 118.7 7.5 A108H-N 123.5 8.25 C110H-N 108.1 7.2 W111H-N 119.7 7.53 W111HE1-NE1 131.0 10.16 R112H-N 127.3 8.5 R112HE-NE 85.4 7.47 C113H-N 123.5 8.63 E114H-N 119.2 8.21 Y115H-N 127.3 9.01 N116H-N 127.2 6.64 A117H-N 127.4 8.63 D118H-N 116.7 7.9 L119H-N 118.7 7.56 G125H-N 110.1 8.06 C126H-N 113.5 8.76 E127H-N 116.2 7.47 C128H-N 128.7 9.8 S129H-N 115.3 9.18 K130H-N 119.2 7.2 L131H-N 122.2 7.38 C133H-N 120.9 9.12 N134H-N 125.8 7.57 N134HD21-ND2 113.5 7.66 N134HD22-ND2 113.5 7.18 D135H-N 114.6 7.99 E136H-N 118.0 7.87 H137H-N 126.7 8.53 H137HE2-ND1 163.7 10.69 C139H-N 116.2 11.1 Y140H-N 120.3 7.58 R141H-N 126.6 8.14 R141HE-NE 85.2 7.08 K142H-N 120.5 8.28 E143H-N 125.7 8.35 G144H-N 117.4 9.24 G145H-N 106.3 8.56 V146H-N 121.1 7.61 V147H-N 127.9 8.53 S148H-N 120.1 8.4 C149H-N 119.9 8.61 D150H-N 120.4 7.98 C151H-N 127.3 9.08 K152H-N 115.5 8.62 T153H-N 106.5 7.16 I154H-N 123.5 6.87 T155H-N 125.7 8.78 C156H-N 124.1 9.33 N157H-N 127.6 7.79 N157HD21-ND2 113.7 7.73 N157HD22-ND2 113.7 7.19 E158H-N 115.7 9.05 D159H-N 116.7 7.86 H160H-N 126.7 8.45 H160HE2-ND1 164.0 11.14 C162H-N 118.8 11.81 Y163H-N 122.7 8.02 H164H-N 123.7 7.79 S165H-N 112.7 8.32 Y166H-N 119.6 8.69 E167H-N 119.6 8.46 E168H-N 125.3 8.85 D169H-N 127.2 9.45 G170H-N 103.3 8.72 V171H-N 120.2 7.76 T172H-N 121.5 8.4 K173H-N 130.0 8.91 S174H-N 109.2 7.8 D175H-N 114.4 8.09 C176H-N 114.1 8.54 D177H-N 124.7 9.55 C178H-N 123.4 8.66 E179H-N 117.7 9.25 H180H-N 108.0 6.96 H180HD1-ND1 174.5 11.92 S181H-N 114.1 9.01 G183H-N 106.3 7.4 S185H-N 117.3 8.77 E186H-N 127.1 8.08