Assignment w1 w2 A4H-N 125.7 8.32 A6H-N 124.0 8.27 A7H-N 122.8 8.17 E8H-N 119.4 8.18 M9H-N 123.3 8.4 G11H-N 107.8 8.22 I12H-N 123.2 8.19 T13H-N 127.1 8.74 I14H-N 126.4 8.99 I15H-N 126.1 9.3 S16H-N 119.4 7.98 A17H-N 131.3 8.81 S18H-N 118.3 9.77 Q19H-N 132.6 10.63 Q19HE21-NE2 113.4 6.96 Q19HE22-NE2 113.4 7.44 T20H-N 109.2 9.08 G21H-N 110.3 7.7 N22H-N 128.6 10.94 N22HD21-ND2 111.5 6.89 N22HD22-ND2 111.5 7.46 A23H-N 126.2 11.59 R24H-N 114.3 6.51 R25H-N 119.4 7.88 V26H-N 121.9 7.77 A27H-N 121.6 8.38 E28H-N 117.5 8.68 A29H-N 121.0 7.57 L30H-N 118.1 8.12 R31H-N 120.1 8.48 D32H-N 119.4 8.2 D33H-N 123.5 8.33 L34H-N 121.3 8.36 L35H-N 120.9 8.69 A36H-N 123.5 8.09 A37H-N 119.6 7.22 K38H-N 112.2 7.88 L39H-N 118.4 7.62 N40H-N 119.1 8.33 N40HD21-ND2 112.0 6.89 N40HD22-ND2 112.0 7.46 V41H-N 122.0 7.7 K42H-N 126.9 8.69 L43H-N 126.3 8.71 V44H-N 129.2 9.59 N45H-N 123.6 8.88 N45HD21-ND2 112.0 6.89 N45HD22-ND2 112.0 7.46 A46H-N 126.3 9.7 G47H-N 103.7 9.18 D48H-N 117.0 7.75 Y49H-N 122.2 7.52 K50H-N 130.1 7.95 F51H-N 121.4 6.64 K52H-N 119.3 7.95 Q53H-N 116.0 7.6 Q53HE21-NE2 111.4 6.7 Q53HE22-NE2 111.4 7.32 I54H-N 122.2 7.62 A55H-N 119.6 8.18 S56H-N 112.4 8.11 E57H-N 120.9 7.76 K58H-N 123.6 8.73 L59H-N 123.2 8.31 L60H-N 126.1 8.93 I61H-N 126.3 9.18 V62H-N 126.1 8.87 V63H-N 127.7 8.65 T64H-N 117.2 8.35 S65H-N 124.2 7.94 T66H-N 110.5 6.43 Q67H-N 127.3 8.94 Q67HE21-NE2 114.4 6.54 Q67HE22-NE2 114.4 8.34 G68H-N 102.7 7.6 E69H-N 118.5 9.44 G70H-N 105.3 8.2 E71H-N 120.7 6.9 E74H-N 123.5 8.39 E75H-N 114.5 8.77 A76H-N 120.4 8.34 V77H-N 122.5 7.42 A78H-N 122.0 8.61 L79H-N 121.2 8.14 H80H-N 119.7 8.46 K81H-N 116.8 8.8 F82H-N 118.4 7.95 L83H-N 119.1 8.24 F84H-N 114.5 7.71 S85H-N 117.4 7.47 K87H-N 116.6 7.6 A88H-N 123.5 6.6 K90H-N 114.4 7.44 L91H-N 124.5 8.22 E92H-N 118.4 7.8 N93H-N 118.0 8.76 N93HD21-ND2 112.2 6.89 N93HD22-ND2 112.2 7.58 T94H-N 117.7 7.96 A95H-N 131.2 8.4 F96H-N 117.8 8.83 A97H-N 119.9 8.37 V98H-N 120.4 9.18 F99H-N 130.4 8.9 S100H-N 122.1 7.87 L101H-N 122.7 8.3 G102H-N 112.5 8.25 D103H-N 120.2 8.67 T104H-N 123.1 9.31 S105H-N 119.2 9.11 Y106H-N 121.1 7.8 E107H-N 120.0 8.41 F108H-N 117.8 8.35 F109H-N 125.7 7.96 C110H-N 121.2 9.25 Q111H-N 116.6 6.72 Q111HE21-NE2 111.7 6.84 Q111HE22-NE2 111.7 7.52 S112H-N 112.2 8.29 G113H-N 105.5 6.69 K114H-N 121.7 7.76 D115H-N 120.9 8.69 F116H-N 116.1 8.24 D117H-N 116.0 8.53 S118H-N 110.9 8.26 K119H-N 123.3 8.3 L120H-N 116.6 8.1 A121H-N 117.9 6.57 E122H-N 123.8 8.27 L123H-N 116.0 7.93 G124H-N 106.4 7.79 G125H-N 109.6 8.57 E126H-N 125.0 9.02 R127H-N 129.1 8.62 L128H-N 128.7 9.53 L129H-N 113.7 6.77 D130H-N 119.9 8.3 R131H-N 125.9 9.12 V132H-N 125.8 6.72 D133H-N 127.8 8.2 A134H-N 128.9 8.77 D135H-N 122.5 8.24 V136H-N 117.3 9.24 E137H-N 118.1 7.98 Y138H-N 120.0 7.25 Q139H-N 123.4 8.24 Q139HE21-NE2 111.0 6.74 Q139HE22-NE2 111.0 7.27 A140H-N 123.5 8.76 A141H-N 122.2 8.55 A142H-N 119.9 9.09 S143H-N 114.3 8.31 E144H-N 122.0 8.02 W145H-N 120.3 8.45 R146H-N 117.0 8.71 A147H-N 117.3 6.95 R148H-N 117.9 7.54 V149H-N 122.8 8.59 V150H-N 120.0 7.91 D151H-N 117.0 7.38 A152H-N 121.2 7.99 L153H-N 117.5 8.31 K154H-N 119.0 8.47 S155H-N 111.7 7.5 R156H-N 119.8 7.29 A157H-N 125.0 7.8 V159H-N 119.7 7.95 A160H-N 127.6 8.28 A161H-N 124.6 8.2 S163H-N 115.7 8.33 Q164H-N 121.8 8.36 Q164HE21-NE2 112.2 6.83 Q164HE22-NE2 112.2 7.51 S165H-N 117.3 8.26 V166H-N 121.5 8.1 A167H-N 132.6 7.89