Assignment w1 w2 A4H-N 125.7 8.16 S5H-N 110.7 8.3 C6H-N 118.5 7.83 N8H-N 116.2 8.54 N8HD21-ND2 115.3 7.57 N8HD22-ND2 115.3 6.89 N9H-N 121.9 7.63 N9HD21-ND2 115.3 7.62 N9HD22-ND2 115.3 6.81 C10H-N 123.0 8.25 E11H-N 130.1 9.07 N12H-N 126.4 9.37 N12HD21-ND2 115.2 7.61 N12HD22-ND2 115.2 6.86 G13H-N 104.3 8.04 L14H-N 123.1 7.55 C15H-N 122.4 8.52 T16H-N 118.0 8.63 N17H-N 121.4 8.42 N17HD21-ND2 114.0 7.55 N17HD22-ND2 114.0 6.81 S18H-N 117.3 8.13 C19H-N 122.6 8.48 D20H-N 129.9 8.69 F21H-N 119.2 7.2 E22H-N 119.4 8.73 D23H-N 125.2 8.94 L24H-N 123.0 8.96 L25H-N 119.3 7.07 S26H-N 116.5 8.85 N27H-N 120.1 8.45 N27HD21-ND2 111.5 7.47 N27HD22-ND2 111.5 6.52 C28H-N 119.1 7.81 E29H-N 121.9 9.03 S30H-N 115.4 7.53 L31H-N 123.4 7.87 K32H-N 123.7 8.55 T33H-N 112.5 7.31 S34H-N 116.9 7.75 A35H-N 127.4 8.43 G36H-N 106.2 7.64 C37H-N 117.0 8.68 K38H-N 117.9 7.96 H39H-N 123.8 7.61 E40H-N 129.7 8.61 L42H-N 120.3 7.08 K43H-N 121.1 8.17 T44H-N 107.4 7.23 K45H-N 119.2 8.12 C46H-N 120.4 7.94 Q47H-N 119.3 8.98 Q47HE21-NE2 111.9 7.27 Q47HE22-NE2 111.9 6.71 A48H-N 122.3 7.61 T49H-N 121.1 9.87 C50H-N 115.6 8.27 L51H-N 119.0 8.26 C52H-N 118.5 7.81 E53H-N 122.6 8.17 D54H-N 122.0 8.43 K55H-N 122.2 8.0 I56H-N 122.7 7.99 H57H-N 128.7 7.97