Assignment w1 w2 E3H-N 123.75 8.66 K4H-N 123.22 8.27 V5H-N 123.47 8.1 I6H-N 126.83 8.25 I7H-N 127.01 8.2 E8H-N 126.7 8.42 K9H-N 123.93 8.3 A10H-N 126.77 8.36 A11H-N 124.48 8.29 G12H-N 108.63 8.27 D13H-N 121.52 8.2 A14H-N 124.21 8.17 E15H-N 119.6 8.22 A16H-N 124.77 8.22 I17H-N 123.89 8.55 A18H-N 127.51 8.33 F19H-N 118.73 8.95 D20H-N 123.29 8.03 G21H-N 112.98 7.83 R22H-N 120.12 8.07 T23H-N 119.47 7.79 Y24H-N 127.09 7.89 M25H-N 115.43 8.94 E26H-N 120.52 8.71 Y27H-N 123.05 8.85 H28H-N 121.23 9.62 N29H-N 127.14 8.87 N29HD21-ND2 112.87 6.71 N29HD22-ND2 112.87 7.51 A30H-N 123.24 8.21 V31H-N 128.84 9.7 T32H-N 113.16 9.15 S34H-N 112.62 8.35 E35H-N 120.58 8.11 A37H-N 127.04 8.52 L38H-N 118.52 7.79 Q39H-N 125.85 9.31 S40H-N 116.0 8.16 N41H-N 122.3 8.96 H42H-N 116.32 7.35 F43H-N 124.38 9.22 E44H-N 121.23 8.92 L45H-N 116.57 8.42 S46H-N 115.8 8.26 I47H-N 117.76 8.97 K48H-N 123.46 8.01 T49H-N 123.86 9.7 E50H-N 123.02 8.52 A51H-N 129.67 9.04 T52H-N 105.12 8.14 Q53H-N 118.43 7.45 G54H-N 108.53 8.37 L55H-N 128.05 8.3 I56H-N 120.5 9.15 L57H-N 127.76 8.3 W58H-N 112.45 7.6 W58HE1-NE1 130.63 7.32 S59H-N 112.66 7.48 G60H-N 106.56 9.6 K61H-N 121.36 7.95 G62H-N 112.76 9.13 L63H-N 122.95 8.19 E64H-N 123.94 8.63 R65H-N 117.81 8.65 S66H-N 115.38 7.6 D67H-N 123.62 8.8 Y68H-N 116.41 7.98 I69H-N 115.81 8.17 A70H-N 123.33 7.51 L71H-N 122.41 9.47 A72H-N 125.23 8.94 I73H-N 121.81 9.36 V74H-N 125.76 8.71 D75H-N 129.33 8.63 G76H-N 101.35 8.93 F77H-N 118.61 7.56 V78H-N 126.1 10.0 Q79H-N 116.55 8.05 M80H-N 125.48 7.69 M81H-N 125.58 8.63 Y82H-N 127.98 8.24 D83H-N 123.32 8.55 L84H-N 117.92 7.51 G85H-N 116.0 9.27 S86H-N 116.4 8.34 K87H-N 127.28 7.95 V89H-N 124.16 7.64 V90H-N 124.07 7.58 L91H-N 129.0 9.26 R92H-N 123.4 8.54 S93H-N 117.82 8.22 T94H-N 115.64 9.7 V95H-N 125.23 7.96 I97H-N 122.65 7.94 N98H-N 122.03 8.99 T99H-N 109.35 7.88 N100H-N 120.99 8.62 N100HD21-ND2 109.28 6.58 N100HD22-ND2 109.28 7.18 H101H-N 114.7 7.68 W102H-N 127.17 8.86 W102HE1-NE1 130.63 10.26 T103H-N 123.01 9.81 H104H-N 128.51 9.29 I105H-N 126.68 9.13 K106H-N 125.81 8.72 A107H-N 131.08 9.23 Y108H-N 126.32 8.9 R109H-N 116.16 8.16 V110H-N 120.33 8.47 Q111H-N 123.29 8.13 Q111HE21-NE2 112.12 6.76 Q111HE22-NE2 112.12 7.38 R112H-N 122.66 8.67 E113H-N 127.28 7.89 G114H-N 116.63 9.33 S115H-N 115.8 8.69 L116H-N 128.98 9.07 Q117H-N 126.4 9.0 V118H-N 132.43 10.14 G119H-N 114.27 9.18 N120H-N 124.0 8.8 N120HD21-ND2 112.75 7.52 N120HD22-ND2 112.75 6.83 E121H-N 120.86 7.53 A122H-N 125.79 8.27 I124H-N 127.75 9.3 T125H-N 115.41 8.14 G126H-N 108.32 7.97 S127H-N 113.24 8.41 S128H-N 119.7 8.7 L130H-N 121.88 8.22 G131H-N 110.25 8.03 A132H-N 124.91 7.84 T133H-N 120.4 8.9 Q134H-N 128.9 9.19 Q134HE21-NE2 112.33 6.69 Q134HE22-NE2 112.33 7.59 L135H-N 122.02 8.72 D136H-N 122.15 8.84 T137H-N 116.76 8.56 D138H-N 122.07 8.53 G139H-N 107.57 8.62 A140H-N 124.62 7.81 L141H-N 115.29 9.16 W142H-N 127.49 9.63 W142HE1-NE1 130.11 10.28 L143H-N 122.78 9.87 G144H-N 109.65 8.62 G145H-N 106.3 7.38 M146H-N 114.02 7.13 E147H-N 123.46 7.36 R148H-N 119.39 7.56 L149H-N 122.65 7.3 S150H-N 113.5 7.48 V151H-N 124.25 8.91 A152H-N 126.99 8.66 H153H-N 123.34 7.43 K154H-N 116.86 7.46 L155H-N 124.03 7.8 K157H-N 127.26 8.96 A158H-N 123.7 8.8 Y159H-N 111.43 7.85 S160H-N 111.21 7.54 T161H-N 119.39 7.35 G162H-N 116.5 8.87 F163H-N 127.35 8.8 I164H-N 126.16 6.2 G165H-N 115.63 8.08 C166H-N 118.54 9.3 I167H-N 120.87 9.1 R168H-N 121.84 8.86 D169H-N 118.37 8.68 V170H-N 120.35 8.86 I171H-N 130.5 9.47 V172H-N 127.9 8.85 D173H-N 129.95 9.69 R174H-N 107.79 8.35 Q175H-N 121.38 7.95 Q175HE21-NE2 112.46 7.99 Q175HE22-NE2 112.46 6.76 L177H-N 122.5 9.05 H178H-N 118.16 8.68 L179H-N 125.23 8.56 V180H-N 114.96 8.27 E181H-N 118.73 8.8 D182H-N 115.01 8.58 A183H-N 122.92 6.94 L184H-N 120.61 8.98 N185H-N 115.13 8.53 N186H-N 116.71 8.6 T188H-N 118.33 8.48 I189H-N 128.05 8.3 L190H-N 131.41 9.16 H191H-N 120.01 8.68 C192H-N 122.03 8.28 S193H-N 121.18 8.58 A194H-N 127.45 8.28 K195H-N 125.71 7.78