Assignment w1 w2 D2H-N 122.6 8.77 T3H-N 117.8 8.38 K4H-N 122.6 8.24 E5H-N 119.3 7.84 V6H-N 122.1 7.87 L7H-N 120.5 8.23 E8H-N 119.9 8.11 A9H-N 124.8 7.94 R10H-N 122.1 8.71 E11H-N 122.3 8.36 A12H-N 121.6 7.68 Y13H-N 119.5 7.17 F14H-N 119.2 8.07 K15H-N 124.5 8.47 S16H-N 119.6 7.52 L17H-N 126.6 7.69 G18H-N 107.6 9.19 G19H-N 111.1 8.59 S20H-N 121.3 8.31 M21H-N 120.8 8.69 K22H-N 122.3 8.33 A23H-N 124.1 8.3 M24H-N 118.6 9.43 T25H-N 117.5 8.53 G26H-N 109.3 7.67 V27H-N 123.8 7.75 A28H-N 120.8 8.58 K29H-N 116.0 7.32 A30H-N 126.1 7.57 F31H-N 125.3 8.5 D32H-N 128.1 5.44 A33H-N 128.9 8.93 E34H-N 118.8 8.08 A35H-N 125.7 8.08 A36H-N 120.2 8.16 K37H-N 118.7 7.95 A38H-N 123.5 7.83 E39H-N 117.3 8.23 A40H-N 125.7 9.02 A41H-N 121.2 7.87 K42H-N 119.0 7.16 L43H-N 122.2 8.08 E44H-N 120.3 8.61 K45H-N 117.7 7.05 I46H-N 122.5 7.69 L47H-N 119.6 8.66 A48H-N 121.1 7.23 T49H-N 117.3 7.55 D50H-N 129.6 8.58 V51H-N 123.8 8.12 A52H-N 125.6 8.22 L54H-N 114.5 7.51 F55H-N 116.3 7.66 A57H-N 125.1 8.69 G58H-N 108.3 8.23 T59H-N 104.2 6.35 S60H-N 118.4 8.5 S61H-N 115.8 9.8 T62H-N 118.5 8.12 D63H-N 122.7 7.19 L64H-N 119.2 8.04 G66H-N 113.9 9.35 Q67H-N 117.1 8.14 Q67HE21-NE2 113.1 7.72 Q67HE22-NE2 113.1 6.82 T68H-N 111.7 7.42 E69H-N 126.4 9.66 A70H-N 129.0 8.57 K71H-N 128.2 8.8 A72H-N 125.3 9.5 A73H-N 119.8 8.36 I74H-N 120.9 8.23 W75H-N 114.6 7.08 W75HE1-NE1 130.9 9.82 A76H-N 122.3 7.33 N77H-N 121.2 7.62 N77HD21-ND2 116.3 8.04 N77HD22-ND2 116.3 7.24 M78H-N 122.3 8.33 D79H-N 120.9 8.77 D80H-N 124.2 7.98 F81H-N 122.4 8.76 G82H-N 107.0 8.8 A83H-N 128.8 8.31 K84H-N 122.8 8.84 G85H-N 112.0 8.36 K86H-N 128.6 8.71 A87H-N 122.7 8.32 M88H-N 120.7 7.7 H89H-N 120.3 8.45 E90H-N 122.1 8.88 A91H-N 124.3 8.39 G92H-N 109.8 9.3 G93H-N 110.1 8.23 A94H-N 125.4 7.51 V95H-N 122.5 7.69 I96H-N 121.6 8.04 A97H-N 121.8 8.23 A98H-N 121.8 7.86 A99H-N 120.8 8.66 N100H-N 117.6 8.55 N100HD21-ND2 112.2 7.43 N100HD22-ND2 112.2 6.95 A101H-N 121.5 7.78 G102H-N 109.0 8.0 D103H-N 119.6 7.48 G104H-N 115.8 8.29 A105H-N 126.8 8.08 A106H-N 123.2 7.94 F107H-N 122.3 8.74 G108H-N 106.6 8.27 A109H-N 124.9 7.72 A110H-N 122.8 8.52 L111H-N 123.3 8.61 Q112H-N 120.8 7.64 Q112HE21-NE2 113.1 7.43 Q112HE22-NE2 113.1 6.86 K113H-N 121.4 7.5 L114H-N 122.0 8.67 G115H-N 108.3 8.86 G116H-N 109.1 7.86 T117H-N 116.2 8.09 C118H-N 124.2 7.96 K119H-N 118.1 6.81 A120H-N 118.1 7.65 C121H-N 113.8 6.44 H122H-N 118.9 6.82 D123H-N 116.8 8.49 D124H-N 116.6 6.33 Y125H-N 115.8 8.01 R126H-N 123.6 8.2 E127H-N 129.0 9.5 E128H-N 123.1 8.41 D129H-N 127.6 8.0