Assignment w1 w2 S2H-N 112.92 8.03 S4H-N 113.64 7.82 G5H-N 107.07 8.31 A6H-N 125.4 8.63 A7H-N 120.09 8.36 I8H-N 125.38 9.3 F9H-N 128.79 8.46 E10H-N 126.46 8.76 K11H-N 105.93 7.9 V12H-N 123.84 7.9 S13H-N 122.06 8.88 G14H-N 113.17 8.29 I15H-N 123.13 8.27 I16H-N 127.61 9.39 A17H-N 127.93 8.96 I18H-N 122.5 8.69 N19H-N 127.57 9.36 N19HD21-ND2 110.85 7.69 N19HD22-ND2 110.85 6.85 E20H-N 121.55 9.04 D21H-N 121.09 8.7 V22H-N 113.08 6.81 S23H-N 115.02 8.04 A25H-N 120.42 7.93 E26H-N 115.42 7.84 L27H-N 124.42 8.86 T28H-N 121.65 9.25 W29H-N 128.98 9.44 W29HE1-NE1 126.16 9.45 R30H-N 126.35 7.58 R30HE-NE 111.05 7.11 S31H-N 118.52 8.06 T32H-N 119.27 8.53 D33H-N 117.3 8.21 G34H-N 109.22 7.92 D35H-N 118.02 8.24 K36H-N 120.31 7.75 V37H-N 121.79 8.52 H38H-N 126.44 9.63 T39H-N 124.23 8.32 V40H-N 126.01 9.37 V41H-N 129.82 9.04 L42H-N 130.2 9.17 S43H-N 109.67 6.94 T44H-N 110.3 7.63 I45H-N 121.01 7.1 D46H-N 126.4 9.32 K47H-N 112.75 7.6 L48H-N 122.0 8.69 Q49H-N 123.73 9.25 Q49HE21-NE2 111.5 7.53 Q49HE22-NE2 111.5 6.85 A50H-N 127.48 8.9 T51H-N 114.09 8.19 S54H-N 107.74 7.63 S55H-N 117.05 7.66 E56H-N 125.67 8.92 K57H-N 118.95 7.97 M58H-N 124.75 8.82 M59H-N 122.57 8.4 L60H-N 121.62 9.14 R61H-N 122.32 9.26 L62H-N 125.86 9.33 I63H-N 124.2 8.95 G64H-N 115.65 9.31 K65H-N 119.47 8.33 V66H-N 122.0 8.61 E68H-N 124.42 8.73 S69H-N 115.82 8.47 K70H-N 121.85 7.69 K71H-N 121.28 7.8 R72H-N 122.29 8.42 K73H-N 121.3 8.4 D74H-N 121.94 8.56 N75H-N 116.36 8.41 N75HD21-ND2 113.12 7.63 N75HD22-ND2 113.12 6.94 E76H-N 119.07 8.14 G77H-N 108.13 8.1 N78H-N 119.83 8.53 N78HD21-ND2 117.08 8.21 N78HD22-ND2 117.08 7.05 E79H-N 121.59 8.69 K83H-N 122.11 8.3 Q85H-N 121.48 8.5 Q85HE21-NE2 112.76 7.6 Q85HE22-NE2 112.76 7.03 R86H-N 121.19 8.24 H87H-N 121.59 8.69 M88H-N 125.27 8.53 F89H-N 122.03 8.93 S90H-N 116.89 8.74 F91H-N 119.97 8.74 N92H-N 115.96 9.1 N92HD21-ND2 111.4 7.59 N92HD22-ND2 111.4 6.79 N93H-N 118.48 7.25 N93HD21-ND2 114.01 7.88 N93HD22-ND2 114.01 7.19 R94H-N 129.09 9.3 R94HE-NE 110.01 7.45 T95H-N 115.71 7.97 V96H-N 121.75 7.55 M97H-N 117.5 7.29 D98H-N 118.09 8.65 N99H-N 120.28 8.09 N99HD21-ND2 111.5 7.4 N99HD22-ND2 111.5 6.93 I100H-N 121.0 8.02 K101H-N 120.71 8.86 M102H-N 116.98 8.01 T103H-N 118.12 7.68 L104H-N 119.27 8.53 Q105H-N 118.13 8.75 Q105HE21-NE2 111.9 7.39 Q105HE22-NE2 111.9 6.85 Q106H-N 118.12 7.55 Q106HE21-NE2 111.3 7.36 Q106HE22-NE2 111.3 6.83 I107H-N 120.31 7.75 I108H-N 117.08 8.73 S109H-N 114.65 7.84 R110H-N 121.11 7.54 R110HE-NE 111.09 7.04 Y111H-N 117.12 7.41 K112H-N 120.99 7.72 D113H-N 120.86 8.32 A114H-N 123.63 8.04 D115H-N 119.25 8.21 G116H-N 108.95 8.24 N117H-N 118.82 8.32 N117HD21-ND2 113.51 7.64 N117HD22-ND2 113.51 6.93 S118H-N 116.65 8.32 S119H-N 123.3 8.01