Assignment w1 w2 N14H-N 119.7 7.84 N14HD21-ND2 111.9 7.43 N14HD22-ND2 111.9 6.7 C16H-N 118.7 7.98 L17H-N 122.4 7.42 S18H-N 114.7 8.81 E19H-N 123.5 9.69 S20H-N 118.1 8.59 D21H-N 122.7 8.63 A22H-N 121.1 8.06 S23H-N 115.0 7.44 R25H-N 121.2 8.08 C26H-N 116.7 7.39 L27H-N 121.8 7.63 D28H-N 118.8 7.99 E29H-N 116.6 7.77 N30H-N 117.4 7.47 N30HD21-ND2 120.0 7.84 N30HD22-ND2 120.0 7.27 N31H-N 117.1 8.44 N31HD21-ND2 112.3 7.55 N31HD22-ND2 112.3 6.79 Y32H-N 110.3 8.64 D33H-N 118.8 7.19 R34H-N 124.7 8.36 E35H-N 118.4 8.26 R36H-N 119.0 7.73 C37H-N 114.0 7.3 S38H-N 119.1 7.73 Y40H-N 120.3 7.19 F41H-N 120.2 7.64 L42H-N 121.6 8.32 R43H-N 118.2 7.7 Y44H-N 117.7 7.66 N46H-N 117.7 8.64 N46HD21-ND2 110.9 7.81 N46HD22-ND2 110.9 6.72 C47H-N 124.8 8.28 R48H-N 121.1 8.0 R49H-N 118.8 8.15 F50H-N 121.0 7.89 W51H-N 118.9 8.06 W51HE1-NE1 128.8 10.64 N52H-N 118.4 8.55 N52HD21-ND2 111.8 6.8 N52HD22-ND2 111.8 7.64 S53H-N 116.0 7.57 I54H-N 124.7 7.02 V55H-N 121.6 8.54 M56H-N 116.3 7.86 Q57H-N 119.9 7.61 Q57HE21-NE2 112.2 7.56 Q57HE22-NE2 112.2 6.88 R58H-N 121.5 8.48 R59H-N 119.0 8.65 K60H-N 120.0 7.7 N61H-N 114.1 7.73 N61HD21-ND2 112.2 7.53 N61HD22-ND2 112.2 6.88 G62H-N 110.9 7.85 V63H-N 124.1 8.54 K64H-N 122.1 7.67 F66H-N 123.5 8.16 M67H-N 114.7 7.83 T69H-N 111.1 8.26 A70H-N 123.1 8.9 A71H-N 118.6 8.51 E72H-N 118.7 7.18 R73H-N 119.1 8.85 D74H-N 117.9 7.7 E75H-N 119.3 7.2 I76H-N 122.8 8.36 L77H-N 118.2 8.59 R78H-N 119.4 7.91 A79H-N 120.1 7.66 V80H-N 115.4 7.49 G81H-N 107.5 7.45 N82H-N 120.4 7.86 N82HD21-ND2 112.7 7.34 N82HD22-ND2 112.7 6.72 M83H-N 121.8 8.37 Y85H-N 119.8 6.4