Assignment w1 w2 E2H-N 120.35 8.63 F3H-N 124.46 8.65 K4H-N 127.6 6.44 A5H-N 122.69 7.66 G6H-N 110.81 8.1 S7H-N 120.01 9.4 A8H-N 131.91 9.23 K9H-N 119.15 8.15 K10H-N 120.08 7.69 G11H-N 107.67 8.66 A12H-N 125.21 8.0 T13H-N 115.81 7.21 L14H-N 123.71 7.83 F15H-N 120.42 8.61 K16H-N 120.79 8.44 T17H-N 107.61 7.88 R18H-N 116.04 8.19 C19H-N 114.61 7.89 L20H-N 123.46 8.02 Q21H-N 117.87 9.98 Q21HE21-NE2 111.24 6.88 Q21HE22-NE2 111.24 7.59 C22H-N 113.77 9.73 H23H-N 119.95 11.0 T24H-N 110.55 10.11 V25H-N 110.16 8.55 E26H-N 120.87 9.55 K27H-N 125.87 8.97 G28H-N 118.3 9.49 G29H-N 108.59 8.23 H31H-N 121.46 8.75 K32H-N 125.77 8.31 V33H-N 121.95 7.52 G34H-N 102.86 7.49 N36H-N 127.64 11.68 N36HD21-ND2 116.0 8.13 N36HD22-ND2 116.0 8.8 L37H-N 122.24 9.48 H38H-N 119.15 8.15 G39H-N 116.29 9.25 I40H-N 116.26 7.14 F41H-N 116.54 8.0 G42H-N 110.45 8.81 R43H-N 121.31 7.95 H44H-N 117.87 8.18 S45H-N 116.5 8.66 G46H-N 109.86 8.92 Q47H-N 113.13 7.84 Q47HE21-NE2 112.34 6.76 Q47HE22-NE2 112.34 7.29 A48H-N 124.57 8.12 E49H-N 125.47 8.81 G50H-N 113.5 9.05 Y51H-N 119.59 6.94 S52H-N 122.32 6.46 Y53H-N 124.91 7.69 T54H-N 112.32 9.62 D55H-N 120.93 8.61 A56H-N 119.63 8.01 N57H-N 117.87 8.34 N57HD21-ND2 109.24 7.06 N57HD22-ND2 109.24 7.38 I58H-N 121.01 7.62 K59H-N 119.28 9.03 K60H-N 118.58 7.39 N61H-N 112.38 7.29 N61HD21-ND2 109.52 6.48 N61HD22-ND2 109.52 7.51 V62H-N 114.42 7.28 L63H-N 127.42 8.26 W64H-N 127.86 7.91 D65H-N 125.59 9.85 E66H-N 116.86 10.05 N67H-N 115.91 8.16 N67HD21-ND2 113.86 7.11 N67HD22-ND2 113.86 7.74 N68H-N 122.02 9.43 N68HD21-ND2 110.33 7.0 N68HD22-ND2 110.33 7.38 M69H-N 121.46 8.74 S70H-N 113.93 7.48 E71H-N 121.07 7.65 Y72H-N 122.28 8.39 L73H-N 112.88 8.1 T74H-N 116.0 7.41 N75H-N 109.05 6.82 N75HD21-ND2 111.9 7.1 N75HD22-ND2 111.9 7.95 K77H-N 115.07 9.34 K78H-N 118.84 7.84 Y79H-N 120.65 8.27 I80H-N 115.04 9.46 G82H-N 111.86 9.31 T83H-N 115.34 9.07 K84H-N 122.75 8.08 M85H-N 122.78 8.81 A86H-N 138.99 8.2 F87H-N 122.75 8.7 G89H-N 103.57 4.91 L90H-N 122.25 8.05 K91H-N 122.99 8.26 K92H-N 119.93 8.74 E93H-N 129.23 8.87 K94H-N 116.83 8.59 D95H-N 115.69 6.24 R96H-N 118.05 7.25 N97H-N 118.0 8.53 N97HD21-ND2 110.46 7.1 N97HD22-ND2 110.46 7.13 D98H-N 125.49 8.51 L99H-N 120.45 8.19 I100H-N 119.99 8.74 T101H-N 117.79 7.97 Y102H-N 119.65 7.63 L103H-N 120.13 9.02 K104H-N 121.21 8.56 K105H-N 115.66 6.47 A106H-N 119.89 8.36 T107H-N 102.5 7.44 E108H-N 127.28 6.87 E2H-N 120.36 8.62 F3H-N 124.44 8.64 K4H-N 127.63 6.47 A5H-N 122.75 7.66 G6H-N 110.85 8.09 S7H-N 120.1 9.37 A8H-N 132.03 9.18 K9H-N 119.41 8.08 K10H-N 120.26 7.63 G11H-N 107.71 8.63 A12H-N 125.23 7.98 T13H-N 116.0 7.21 L14H-N 123.77 7.85 F15H-N 120.39 8.6 K16H-N 120.86 8.43 T17H-N 107.8 7.89 R18H-N 116.15 8.2 C19H-N 114.67 7.89 L20H-N 123.49 8.02 Q21H-N 117.87 9.98 Q21HE21-NE2 111.26 6.88 Q21HE22-NE2 111.26 7.58 C22H-N 113.87 9.73 H23H-N 120.02 10.99 T24H-N 110.61 10.12 V25H-N 110.13 8.5 E26H-N 120.88 9.56 K27H-N 125.94 8.97 G28H-N 118.39 9.5 G29H-N 108.68 8.23 H31H-N 121.51 8.75 K32H-N 125.79 8.3 V33H-N 121.96 7.51 G34H-N 102.91 7.48 N36H-N 127.75 11.69 N36HD21-ND2 116.0 8.13 N36HD22-ND2 116.0 8.78 L37H-N 122.27 9.47 H38H-N 119.31 8.13 G39H-N 116.29 9.23 I40H-N 116.27 7.14 F41H-N 116.61 7.99 G42H-N 110.53 8.8 R43H-N 121.37 7.94 H44H-N 117.92 8.17 S45H-N 116.68 8.66 G46H-N 109.89 8.93 Q47H-N 113.19 7.84 Q47HE21-NE2 112.31 6.76 Q47HE22-NE2 112.31 7.29 A48H-N 124.61 8.11 E49H-N 125.54 8.81 G50H-N 113.56 9.06 Y51H-N 119.64 6.94 S52H-N 122.33 6.45 Y53H-N 125.03 7.7 T54H-N 112.35 9.62 D55H-N 120.98 8.61 A56H-N 119.63 8.0 N57H-N 117.93 8.33 N57HD21-ND2 109.34 7.06 N57HD22-ND2 109.34 7.38 I58H-N 121.1 7.62 K59H-N 119.25 9.02 K60H-N 118.63 7.38 N61H-N 112.32 7.28 N61HD21-ND2 109.47 6.47 N61HD22-ND2 109.47 7.5 V62H-N 114.38 7.27 L63H-N 127.45 8.25 W64H-N 127.9 7.91 D65H-N 125.61 9.84 E66H-N 116.94 10.05 N67H-N 116.0 8.16 N67HD21-ND2 113.89 7.1 N67HD22-ND2 113.89 7.74 N68H-N 122.13 9.44 N68HD21-ND2 110.36 6.99 N68HD22-ND2 110.36 7.37 M69H-N 121.51 8.73 S70H-N 113.97 7.48 E71H-N 121.2 7.65 Y72H-N 122.4 8.39 L73H-N 112.95 8.1 T74H-N 116.02 7.4 N75H-N 109.01 6.8 N75HD21-ND2 111.98 7.05 N75HD22-ND2 111.98 7.9 K77H-N 115.14 9.35 K78H-N 118.91 7.84 Y79H-N 120.71 8.26 I80H-N 115.1 9.46 G82H-N 111.85 9.31 T83H-N 115.43 9.07 K84H-N 122.93 8.09 M85H-N 122.91 8.83 A86H-N 139.06 8.2 F87H-N 122.86 8.68 L90H-N 122.41 8.05 K91H-N 122.98 8.38 K92H-N 119.96 8.65 E93H-N 129.34 8.84 K94H-N 116.71 8.65 D95H-N 115.75 6.23 R96H-N 118.06 7.24 N97H-N 118.04 8.51 N97HD21-ND2 110.49 7.09 N97HD22-ND2 110.49 7.13 D98H-N 125.5 8.51 L99H-N 120.52 8.18 I100H-N 120.07 8.72 T101H-N 117.81 7.96 Y102H-N 119.69 7.62 L103H-N 120.15 9.02 K104H-N 121.26 8.56 K105H-N 115.64 6.46 A106H-N 119.93 8.36 T107H-N 102.68 7.43 E108H-N 127.33 6.87