Assignment w1 w2 N3H-N 120.6 8.57 N3HD21-ND2 113.0 7.005 N3HD22-ND2 113.0 7.645 N4H-N 119.5 8.42 N4HD21-ND2 112.9 6.973 N4HD22-ND2 112.9 7.671 N5H-N 120.7 9.04 N5HD21-ND2 113.9 7.024 N5HD22-ND2 113.9 7.917 S6H-N 115.4 7.99 F7H-N 121.9 9.08 S8H-N 112.4 9.77 A9H-N 124.2 7.84 I10H-N 119.5 7.96 Y11H-N 120.8 8.82 K12H-N 119.2 8.2 E13H-N 119.4 7.39 W14H-N 123.4 8.48 W14HE1-NE1 129.3 10.14 Y15H-N 120.1 9.18 E16H-N 115.3 7.75 H17H-N 116.8 7.38 K18H-N 118.9 7.61 K19H-N 116.0 7.42 Q20H-N 115.6 7.15 Q20HE21-NE2 112.0 6.791 Q20HE22-NE2 112.0 7.441 V21H-N 112.3 7.43 W22H-N 122.8 7.2 W22HE1-NE1 127.3 9.83 S23H-N 117.7 8.78 V24H-N 122.8 8.96 G25H-N 110.3 8.94 Y26H-N 124.7 7.88 A27H-N 120.0 8.62 T28H-N 116.3 8.49 E29H-N 124.2 7.69 L30H-N 122.9 8.3 A31H-N 120.9 8.1 K32H-N 118.1 7.71 M33H-N 118.3 7.88 F34H-N 118.1 8.43 D35H-N 121.2 9.16 D36H-N 115.4 8.52 D37H-N 114.6 7.67 I38H-N 115.1 7.16 L39H-N 120.9 9.67 I41H-N 112.7 7.08 I42H-N 106.7 7.16 G43H-N 109.3 8.78 G44H-N 104.5 8.57 L45H-N 121.5 7.38 E46H-N 122.9 8.83 I47H-N 125.0 8.76 Q48H-N 118.8 8.97 Q48HE21-NE2 112.2 7.111 Q48HE22-NE2 112.2 7.45 D49H-N 119.6 8.11 I50H-N 120.3 7.15 E51H-N 128.1 8.86 M53H-N 113.1 8.71 Q54H-N 117.5 7.53 Q54HE21-NE2 112.1 6.872 Q54HE22-NE2 112.1 7.57 L55H-N 118.2 7.24 L56H-N 120.0 8.56 E57H-N 117.7 7.22 V58H-N 116.6 7.17 I59H-N 118.2 7.34 R60H-N 120.2 8.96 R60HE-NE 84.7 7.51 R61H-N 117.4 7.27 R61HE-NE 85.0 7.94 F62H-N 114.2 7.03 E63H-N 120.4 8.26 D64H-N 120.2 9.07 R65H-N 115.4 7.11 R65HE-NE 84.5 7.05 G66H-N 109.2 8.12 A67H-N 126.1 7.91 M68H-N 119.8 7.8 E69H-N 120.6 8.63 R70H-N 120.4 7.86 A71H-N 120.8 7.91 N72H-N 115.6 7.47 N72HD21-ND2 113.9 6.992 N72HD22-ND2 113.9 7.656 K73H-N 120.1 7.86 A74H-N 121.5 8.44 R75H-N 118.4 8.0 R75HE-NE 82.5 7.4 R76H-N 118.3 8.0 R77H-N 119.8 9.0 C78H-N 115.8 8.56 G79H-N 106.4 8.31 E80H-N 120.9 7.89 V81H-N 121.7 7.23 F82H-N 116.7 8.02 R83H-N 118.5 8.68 Y84H-N 121.1 7.98 A85H-N 123.2 8.45 I86H-N 119.7 8.37 V87H-N 120.1 8.47 T88H-N 106.6 7.33 G89H-N 109.1 7.71 R90H-N 118.8 8.67 R90HE-NE 81.5 6.24 A91H-N 117.4 7.34 K92H-N 116.4 9.1 Y93H-N 120.7 7.83 N94H-N 124.1 8.04 N94HD21-ND2 109.5 6.641 N94HD22-ND2 109.5 7.658 A96H-N 121.5 7.48 D98H-N 116.8 7.44 L99H-N 120.0 7.68 A100H-N 121.8 7.91 D101H-N 117.5 8.02 A102H-N 123.1 7.92 M103H-N 116.7 8.03 K104H-N 120.6 8.01 G105H-N 108.1 8.19 Y106H-N 120.6 7.88 R107H-N 122.0 8.08 K108H-N 121.9 8.06 K109H-N 121.8 8.18 N110H-N 119.4 8.35 N110HD21-ND2 113.0 6.852 N110HD22-ND2 113.0 7.523 L111H-N 122.3 8.16 E112H-N 120.7 8.24 H113H-N 119.6 8.19 H114H-N 125.4 8.06