Assignment w1 w2 G12H-N 111.2 8.6 S13H-N 115.75 8.41 N14H-N 121.12 8.65 N14HD21-ND2 112.26 7.66 N14HD22-ND2 112.26 6.94 N15H-N 120.0 8.51 N15HD21-ND2 112.03 7.72 N15HD22-ND2 112.03 6.9 K16H-N 122.1 8.38 Y18H-N 121.2 7.93 E19H-N 118.5 8.1 L20H-N 120.0 8.19 F21H-N 122.1 7.94 M22H-N 117.48 8.4 K23H-N 118.55 7.94 S24H-N 114.3 7.52 L25H-N 125.6 8.59 I26H-N 120.9 8.79 E27H-N 119.7 7.78 N28H-N 119.7 7.99 C29H-N 117.43 8.71 K30H-N 120.6 8.01 K31H-N 121.2 8.01 R32H-N 115.75 7.28 N33H-N 115.6 8.04 N33HD21-ND2 112.26 7.52 N33HD22-ND2 112.26 6.82 M34H-N 116.9 8.04 L36H-N 125.2 8.6 Q37H-N 125.0 8.57 Q37HE21-NE2 111.3 7.46 Q37HE22-NE2 111.3 6.85 S38H-N 112.1 7.67 I39H-N 124.0 8.46 E41H-N 117.3 8.22 I42H-N 120.43 8.21 G43H-N 120.3 9.37 N44H-N 116.57 8.7 N44HD21-ND2 111.8 7.55 N44HD22-ND2 111.8 6.89 R45H-N 119.6 7.78 K46H-N 124.8 8.6 I47H-N 123.8 8.34 N48H-N 124.6 8.57 L49H-N 126.6 9.26 F50H-N 118.55 7.75 Y51H-N 119.5 7.81 L52H-N 118.08 8.24 Y53H-N 118.3 8.31 M54H-N 116.0 8.31 L55H-N 122.41 8.37 V56H-N 118.1 7.9 Q57H-N 118.5 8.04 K58H-N 123.2 7.92 F59H-N 116.72 7.34 G60H-N 104.5 7.5 G61H-N 110.34 8.31 A62H-N 122.71 9.4 D63H-N 119.35 9.31 Q64H-N 121.8 7.97 V65H-N 122.2 8.07 T66H-N 116.0 8.44 R67H-N 123.2 8.68 T68H-N 106.45 7.69 Q69H-N 117.7 7.76 Q70H-N 114.9 8.47 Q70HE21-NE2 111.8 7.69 Q70HE22-NE2 111.8 7.02 W71H-N 121.8 7.92 W71HE1-NE1 130.08 10.51 S72H-N 112.95 8.19 M73H-N 123.53 6.96 V74H-N 120.5 7.45 A75H-N 118.5 8.12 Q76H-N 118.5 8.16 Q76HE21-NE2 110.86 7.52 Q76HE22-NE2 110.86 6.89 R77H-N 119.19 7.81 L78H-N 118.6 7.41 Q79H-N 114.6 7.91 I80H-N 119.3 8.05 S81H-N 120.74 8.53 D82H-N 121.7 7.46 Y83H-N 122.4 7.87 Q84H-N 124.22 8.24 Q84HE21-NE2 110.62 7.23 Q84HE22-NE2 110.62 6.65 Q85H-N 120.1 7.55 Q85HE21-NE2 110.86 7.35 Q85HE22-NE2 110.86 6.78 L86H-N 120.5 7.35 E87H-N 119.48 8.02 S88H-N 112.76 7.4 I89H-N 122.2 8.05 Y90H-N 121.4 8.59 F91H-N 118.8 9.02 R92H-N 116.3 8.04 I93H-N 113.9 8.16 L94H-N 116.6 7.66 L95H-N 123.1 8.39 Y97H-N 118.1 6.84 E98H-N 122.2 9.0 R99H-N 115.7 8.53 H100H-N 118.15 7.75 M101H-N 119.0 8.21 I102H-N 120.25 8.18 S103H-N 116.8 7.88 Q104H-N 120.5 8.06 E105H-N 119.4 8.06 G106H-N 108.8 8.18 I107H-N 120.4 7.86 K108H-N 124.3 8.3 E109H-N 121.3 8.33 T110H-N 115.0 8.15 Q111H-N 122.3 8.32 Q111HE21-NE2 111.83 7.4 Q111HE22-NE2 111.83 6.9 A112H-N 124.55 8.19 K113H-N 119.9 8.13 R114H-N 122.1 8.19 I115H-N 122.37 8.15 L116H-N 126.2 8.24 Q117H-N 122.1 8.26 Q117HE21-NE2 111.86 7.52 Q117HE22-NE2 111.86 6.85 S119H-N 115.4 8.33 L120H-N 124.1 8.24 I121H-N 121.24 8.02 S122H-N 124.14 8.04