Assignment w1 w2 D3H-N 120.9 8.36 S4H-N 123.3 8.2 T5H-N 120.0 8.05 W6H-N 131.9 9.41 W6HE1-NE1 130.3 9.83 K7H-N 126.7 9.9 V8H-N 131.6 8.79 D9H-N 131.3 9.65 R10H-N 116.3 7.75 R10HE-NE 87.7 7.2 S11H-N 117.0 8.5 E12H-N 126.3 9.4 N13H-N 125.4 9.26 N13HD21-ND2 114.5 6.82 N13HD22-ND2 114.5 8.04 Y14H-N 123.2 8.28 D15H-N 121.8 8.52 K16H-N 123.0 7.93 F17H-N 124.3 7.69 M18H-N 121.4 8.14 E19H-N 123.6 8.37 K20H-N 126.3 8.0 M21H-N 118.4 7.44 G22H-N 111.2 7.66 V23H-N 124.5 7.36 N24H-N 131.4 8.77 I25H-N 126.1 8.49 V26H-N 124.3 7.53 K27H-N 122.0 7.58 R28H-N 122.4 8.55 K29H-N 122.2 7.66 L30H-N 121.7 7.19 A31H-N 124.5 8.55 A32H-N 120.2 7.41 H33H-N 121.1 7.39 D34H-N 122.0 7.27 N35H-N 121.4 8.83 N35HD21-ND2 115.0 7.18 N35HD22-ND2 115.0 6.68 L36H-N 122.3 6.82 K37H-N 131.1 9.4 L38H-N 126.4 9.3 T39H-N 124.6 9.12 I40H-N 132.0 8.57 T41H-N 125.0 8.69 Q42H-N 130.7 8.95 Q42HE21-NE2 110.5 7.49 Q42HE22-NE2 110.5 6.28 E43H-N 132.6 8.81 G44H-N 120.7 8.87 N45H-N 128.9 8.72 N45HD21-ND2 115.5 7.76 N45HD22-ND2 115.5 6.89 K46H-N 124.1 7.88 F47H-N 130.0 9.12 T48H-N 118.5 8.35 V49H-N 131.3 9.61 K50H-N 130.7 9.13 E51H-N 133.3 9.03 S52H-N 125.3 9.0 S53H-N 124.5 9.05 T54H-N 115.0 8.94 F55H-N 119.5 7.91 R56H-N 115.4 7.44 R56HE-NE 86.8 6.62 N57H-N 121.7 8.34 N57HD21-ND2 116.2 7.48 N57HD22-ND2 116.2 6.83 I58H-N 120.2 8.91 E59H-N 126.7 8.44 V60H-N 130.9 9.45 V61H-N 128.9 8.11 F62H-N 125.1 8.43 E63H-N 123.8 9.48 L64H-N 128.1 8.79 G65H-N 112.1 9.23 V66H-N 125.8 7.96 T67H-N 132.8 8.67 F68H-N 129.1 9.5 N69H-N 120.0 8.33 N69HD21-ND2 114.5 7.33 N69HD22-ND2 114.5 6.69 Y70H-N 126.4 8.88 N71H-N 127.7 7.69 L72H-N 125.2 8.92 A73H-N 124.7 8.91 D74H-N 117.1 7.14 G75H-N 112.1 7.85 T76H-N 123.2 7.74 E77H-N 133.1 8.62 L78H-N 128.5 9.21 R79H-N 122.6 8.48 G80H-N 118.3 8.8 T81H-N 109.6 6.75 W82H-N 124.0 9.05 W82HE1-NE1 134.5 10.44 S83H-N 118.9 9.0 L84H-N 129.5 8.8 E85H-N 131.4 8.93 N87H-N 126.0 8.7 N87HD21-ND2 115.8 7.49 N87HD22-ND2 115.8 6.86 K88H-N 122.1 7.97 L89H-N 127.1 8.49 I90H-N 128.5 9.56 G91H-N 125.2 9.76 K92H-N 131.0 7.69 F93H-N 126.2 8.39 K94H-N 124.1 8.84 R95H-N 126.3 8.69 R95HE-NE 87.9 9.05 T96H-N 120.6 8.47 D97H-N 124.3 8.88 N98H-N 119.9 8.52 N98HD21-ND2 109.6 7.48 N98HD22-ND2 109.6 5.49 G99H-N 111.8 7.74 N100H-N 122.8 8.35 N100HD21-ND2 110.7 6.65 N100HD22-ND2 110.7 6.49 E101H-N 123.2 8.62 L102H-N 128.8 8.95 N103H-N 127.5 8.52 N103HD21-ND2 116.4 7.41 N103HD22-ND2 116.4 7.32 T104H-N 120.7 8.96 V105H-N 130.3 8.13 R106H-N 128.0 9.34 R106HE-NE 83.5 5.95 E107H-N 124.3 8.53 I108H-N 128.3 8.75 I109H-N 133.5 8.88 G110H-N 122.7 8.98 D111H-N 127.8 8.65 E112H-N 122.1 7.88 L113H-N 127.4 7.88 V114H-N 132.0 9.26 Q115H-N 133.6 9.33 Q115HE21-NE2 113.8 6.91 Q115HE22-NE2 113.8 6.81 T116H-N 124.2 8.71 Y117H-N 129.6 9.28 V118H-N 124.1 9.12 Y119H-N 131.4 8.99 E120H-N 129.7 9.47 G121H-N 105.7 8.26 V122H-N 126.9 8.28 E123H-N 130.6 8.48 A124H-N 129.8 9.21 K125H-N 119.3 8.56 R126H-N 123.2 9.12 R126HE-NE 86.4 6.03 I127H-N 126.7 8.69 F128H-N 130.2 10.01 K129H-N 122.4 8.9 K130H-N 127.1 8.99 D131H-N 133.9 8.09