Assignment w1 w2 S12H-N 113.69 8.26 N13H-N 119.54 8.44 N13HD21-ND2 110.89 6.89 N13HD22-ND2 110.89 7.59 I15H-N 120.59 8.23 G17H-N 108.2 8.52 L18H-N 119.99 7.95 D19H-N 118.78 8.46 E20H-N 119.28 8.28 L21H-N 120.14 8.16 G22H-N 107.58 8.28 V23H-N 116.75 7.95 G24H-N 110.49 8.52 N25H-N 117.43 8.26 N25HD21-ND2 110.38 7.58 N25HD22-ND2 110.38 6.91 S26H-N 114.99 8.38 D27H-N 120.94 8.37 A28H-N 122.35 8.06 A29H-N 121.07 8.12 A30H-N 123.18 7.97 G32H-N 105.21 8.39 T33H-N 116.41 9.23 R34H-N 124.56 9.37 R34HE-NE 82.4 7.35 V35H-N 121.83 8.75 I36H-N 114.26 7.63 D37H-N 117.61 6.99 A38H-N 119.33 7.61 A39H-N 119.34 7.64 T40H-N 113.68 9.21 S41H-N 111.71 8.48 M42H-N 120.92 7.99 R44H-N 118.27 8.05 R44HE-NE 85.2 8.73 K45H-N 122.88 8.6 V46H-N 115.72 9.23 R47H-N 118.28 8.95 R47HE-NE 81.9 7.36 I48H-N 123.03 8.66 V49H-N 120.93 9.16 Q50H-N 119.33 7.64 Q50HE21-NE2 109.87 7.73 Q50HE22-NE2 109.87 6.82 I51H-N 123.39 8.78 N52H-N 119.97 8.22 N52HD21-ND2 109.62 6.8 N52HD22-ND2 109.62 7.44 E53H-N 119.74 8.52 I54H-N 118.04 7.9 F55H-N 119.97 7.98 Q56H-N 119.03 8.1 Q56HE21-NE2 109.62 7.48 Q56HE22-NE2 109.62 6.74 V57H-N 117.75 7.88 E58H-N 120.84 8.5 T59H-N 112.69 7.93 D60H-N 121.18 8.68 Q61H-N 117.16 8.34 F62H-N 117.79 8.13 T63H-N 114.02 8.19 Q64H-N 119.14 7.99 L65H-N 117.56 7.74 L66H-N 118.76 7.8 D67H-N 119.78 8.46 A68H-N 118.27 7.48 D69H-N 117.51 8.25 I70H-N 115.98 7.87 R71H-N 120.81 8.09 R71HE-NE 83.9 7.32 V72H-N 119.06 8.48 G73H-N 115.71 8.88 S74H-N 116.7 8.37 E75H-N 123.57 8.82 V76H-N 114.91 8.86 E77H-N 118.93 8.62 I78H-N 114.2 8.69 V79H-N 121.02 8.32 D80H-N 124.46 8.15 R81H-N 124.18 8.45 R81HE-NE 83.0 7.16 D82H-N 122.92 8.91 G83H-N 104.73 8.88 H84H-N 116.64 7.67 I85H-N 126.93 9.69 T86H-N 122.24 8.8 L87H-N 125.78 8.94 S88H-N 116.88 9.23 H89H-N 122.6 9.16 N90H-N 124.12 9.28 N90HD21-ND2 109.11 7.34 N90HD22-ND2 109.11 6.8 G91H-N 102.75 8.79 K92H-N 119.79 7.8 D93H-N 120.31 8.35 V94H-N 121.32 9.25 E95H-N 126.67 8.68 L96H-N 124.63 8.82 L97H-N 123.1 8.52 D98H-N 118.78 8.63 D99H-N 115.98 8.77 L100H-N 119.03 7.8 A101H-N 118.68 8.25 H102H-N 109.79 7.76 T103H-N 108.86 7.75 I104H-N 121.87 7.61 R105H-N 122.59 8.68 R105HE-NE 82.4 7.19 I106H-N 113.84 9.36 E107H-N 117.94 9.29 E108H-N 118.66 8.55 L109H-N 124.82 8.67