Assignment w1 w2 G3H-N 109.7 8.66 S4H-N 115.4 8.2 M5H-N 122.3 8.43 K6H-N 122.9 8.31 K7H-N 123.4 8.36 S8H-N 120.9 8.84 A9H-N 125.7 8.78 R10H-N 117.0 8.24 R11H-N 121.7 8.12 Q12H-N 118.3 8.37 Q12HE21-NE2 112.1 7.21 Q12HE22-NE2 112.1 6.78 S13H-N 115.9 8.61 R14H-N 121.1 8.18 E15H-N 121.9 8.82 L16H-N 120.1 8.35 A17H-N 121.1 8.77 T18H-N 115.7 7.9 Q19H-N 120.3 7.64 G20H-N 107.2 8.99 L21H-N 122.0 8.83 Y22H-N 120.8 8.78 Q23H-N 116.3 7.68 Q23HE21-NE2 110.2 7.4 Q23HE22-NE2 110.2 6.78 W24H-N 123.6 8.78 W24HE1-NE1 130.7 10.19 L25H-N 120.1 9.05 L26H-N 117.4 7.58 S27H-N 111.5 8.02 N28H-N 120.9 8.68 N28HD21-ND2 111.7 7.36 N28HD22-ND2 111.7 6.66 A29H-N 119.4 7.13 A30H-N 122.4 8.47 G32H-N 102.9 8.84 E33H-N 122.0 7.5 I34H-N 121.3 7.65 D35H-N 118.7 8.43 A36H-N 118.8 7.41 Q37H-N 118.3 7.81 Q37HE21-NE2 109.9 7.4 Q37HE22-NE2 109.9 6.67 L38H-N 119.7 8.18 R39H-N 114.8 7.25 G40H-N 104.0 7.2 A41H-N 124.4 7.74 L42H-N 124.9 8.74 G43H-N 110.4 8.96 Y44H-N 121.7 7.89 D45H-N 113.6 8.72 K46H-N 118.0 7.48 A47H-N 120.4 7.19 D48H-N 119.2 7.04 T50H-N 116.1 7.97 L51H-N 125.1 8.15 L52H-N 116.8 7.55 D53H-N 117.0 7.88 T54H-N 114.4 8.11 I55H-N 117.8 8.04 L56H-N 118.6 8.37 H57H-N 111.3 7.76 G58H-N 109.7 7.49 V59H-N 120.8 8.0 I60H-N 116.4 6.88 R61H-N 118.3 7.93 E62H-N 115.5 8.18 H63H-N 120.9 7.7 A64H-N 120.0 8.49 T65H-N 113.2 7.61 L66H-N 124.0 8.64 A67H-N 119.9 8.68 E68H-N 117.8 7.59 A69H-N 120.7 7.62 I70H-N 115.7 7.84 S71H-N 113.4 8.01 S73H-N 111.8 8.13 L74H-N 118.4 7.6 D75H-N 118.1 7.95 R76H-N 117.2 7.53 I78H-N 124.2 8.84 D79H-N 116.3 7.98 Q80H-N 116.1 8.01 Q80HE21-NE2 112.2 7.76 Q80HE22-NE2 112.2 6.86 L81H-N 121.1 7.39 S82H-N 120.1 9.05 V84H-N 115.2 7.99 E85H-N 119.6 7.83 R86H-N 116.6 8.5 A87H-N 119.9 8.44 V88H-N 114.9 8.39 L89H-N 117.7 8.32 L90H-N 123.3 8.9 I91H-N 120.1 8.32 A92H-N 119.5 8.47 T93H-N 115.4 8.52 Y94H-N 127.9 8.99 E95H-N 119.4 8.96 L96H-N 119.6 9.44 T97H-N 112.5 7.84 H98H-N 113.4 7.95 Q99H-N 122.8 8.66 Q99HE21-NE2 110.8 7.82 Q99HE22-NE2 110.8 6.97 I100H-N 116.8 7.41 E101H-N 119.6 9.2 T102H-N 121.6 8.14 Y104H-N 123.3 9.39 R105H-N 119.7 7.55 V106H-N 118.6 6.93 I107H-N 118.8 6.81 I108H-N 117.3 8.06 N109H-N 118.2 8.3 N109HD21-ND2 111.8 7.69 N109HD22-ND2 111.8 6.9 E110H-N 118.3 8.48 A111H-N 122.7 8.01 V112H-N 118.3 8.65 E113H-N 118.6 7.89 L114H-N 121.9 8.36 A115H-N 121.1 8.59 T117H-N 116.4 8.11 F118H-N 115.2 8.1 G119H-N 108.6 8.19 G120H-N 107.3 8.39 S121H-N 116.5 8.8 D122H-N 119.3 8.72 G123H-N 110.1 8.18 Y124H-N 117.7 8.37 Y126H-N 121.7 7.82 V127H-N 117.3 8.32 N128H-N 117.3 8.38 N128HD21-ND2 113.4 7.47 N128HD22-ND2 113.4 7.1 G129H-N 105.6 7.87 V130H-N 121.1 7.57 L131H-N 118.2 8.34 D132H-N 119.0 8.02 K133H-N 117.7 7.1 A135H-N 120.6 8.78 V136H-N 113.8 6.73 K137H-N 116.6 6.97 L138H-N 115.4 8.28 R139H-N 117.5 8.14 A141H-N 118.8 8.11 E142H-N 117.2 7.87 T143H-N 107.7 7.59 Q144H-N 120.8 7.72 Q144HE21-NE2 112.3 7.49 Q144HE22-NE2 112.3 6.86 A145H-N 123.6 8.03 R146H-N 119.8 8.23 R147H-N 122.7 8.41 G148H-N 122.4 8.47 A149H-N 129.2 7.9