Assignment w1 w2 D2H-N 125.19 9.63 V3H-N 124.04 8.65 E4H-N 120.42 8.17 K5H-N 121.0 8.11 G6H-N 107.36 8.78 K7H-N 124.1 8.1 K8H-N 116.88 7.01 I9H-N 119.31 7.73 F10H-N 121.4 8.68 V11H-N 120.66 8.79 Q12H-N 117.62 7.96 Q12HE21-NE2 111.2 6.89 Q12HE22-NE2 111.2 7.5 K13H-N 113.61 8.96 C14H-N 115.9 8.37 A15H-N 121.7 7.4 Q16H-N 115.45 8.82 Q16HE21-NE2 111.87 7.09 Q16HE22-NE2 111.87 7.66 C17H-N 113.68 7.0 H18H-N 114.09 6.4 T19H-N 109.54 7.8 V20H-N 110.15 7.75 K22H-N 126.22 8.8 G23H-N 117.42 9.16 G24H-N 107.37 7.8 K25H-N 118.58 8.25 H26H-N 121.48 8.45 K27H-N 125.99 7.74 T28H-N 120.18 7.82 G29H-N 102.59 7.42 N31H-N 124.14 10.64 N31HD21-ND2 114.74 7.36 N31HD22-ND2 114.74 8.03 L32H-N 121.02 7.86 H33H-N 119.37 7.49 G34H-N 114.73 8.87 L35H-N 117.64 7.06 F36H-N 112.49 8.64 G37H-N 112.18 9.48 R38H-N 124.36 8.35 K39H-N 121.77 8.09 T40H-N 109.26 7.38 G41H-N 113.2 8.55 Q42H-N 114.23 8.49 Q42HE21-NE2 114.29 6.94 Q42HE22-NE2 114.29 7.46 A43H-N 126.45 8.62 G45H-N 112.1 9.12 F46H-N 120.32 7.17 T47H-N 123.9 7.22 Y48H-N 127.58 8.45 T49H-N 113.04 10.27 D50H-N 121.77 8.78 A51H-N 120.39 7.79 N52H-N 117.39 8.41 N52HD21-ND2 107.24 7.4 N52HD22-ND2 107.24 8.76 K53H-N 119.18 8.07 N54H-N 114.51 8.69 N54HD21-ND2 111.57 6.99 N54HD22-ND2 111.57 7.41 K55H-N 122.41 7.48 G56H-N 102.16 7.13 I57H-N 110.38 6.37 T58H-N 115.06 8.1 W59H-N 129.68 8.99 K60H-N 119.99 8.19 E61H-N 122.98 10.66 E62H-N 114.56 9.69 T63H-N 108.73 7.21 L64H-N 123.06 8.85 M65H-N 118.34 8.52 E66H-N 117.43 6.74 Y67H-N 120.33 8.22 L68H-N 109.88 8.29 E69H-N 119.29 6.9 N70H-N 105.67 6.21 N70HD21-ND2 111.52 6.65 N70HD22-ND2 111.52 7.71 K72H-N 113.65 7.67 K73H-N 118.74 6.97 Y74H-N 119.05 7.32 I75H-N 114.09 8.3 G77H-N 111.19 8.63 T78H-N 114.95 8.12 K79H-N 123.27 7.93 M80H-N 123.33 7.14 I81H-N 130.06 7.86 F82H-N 123.46 6.53 A83H-N 129.67 8.2 I85H-N 121.48 8.45 K86H-N 127.54 8.62 K87H-N 120.28 8.41 K88H-N 129.31 9.02 T89H-N 109.85 8.29 E90H-N 119.16 6.36 R91H-N 117.45 7.49 E92H-N 118.01 8.6 D93H-N 122.99 8.45 L94H-N 121.29 8.41 I95H-N 120.06 8.98 A96H-N 123.33 8.1 Y97H-N 118.3 8.19 L98H-N 119.34 9.09 K99H-N 123.92 8.99 K100H-N 117.01 6.83 A101H-N 119.71 8.62 T102H-N 102.15 7.91 N103H-N 118.65 7.06 N103HD21-ND2 114.28 6.48 N103HD22-ND2 114.28 7.91 E104H-N 124.86 7.27 D2H-N 125.34 9.65 V3H-N 124.03 8.64 E4H-N 120.48 8.17 K5H-N 121.2 8.12 G6H-N 107.36 8.78 K7H-N 124.15 8.08 K8H-N 117.05 7.02 I9H-N 119.43 7.76 F10H-N 121.44 8.69 V11H-N 120.75 8.79 Q12H-N 117.74 7.97 Q12HE21-NE2 111.19 6.9 Q12HE22-NE2 111.19 7.49 K13H-N 113.71 8.96 C14H-N 115.94 8.37 A15H-N 121.72 7.41 Q16H-N 115.52 8.82 Q16HE21-NE2 111.83 7.09 Q16HE22-NE2 111.83 7.66 C17H-N 113.74 7.01 H18H-N 114.15 6.4 T19H-N 109.57 7.79 V20H-N 110.23 7.72 K22H-N 126.25 8.8 G23H-N 117.37 9.14 G24H-N 107.4 7.81 K25H-N 118.63 8.25 H26H-N 121.53 8.44 K27H-N 126.06 7.74 T28H-N 120.25 7.81 G29H-N 102.69 7.42 N31H-N 124.2 10.64 N31HD21-ND2 114.78 7.37 N31HD22-ND2 114.78 8.03 L32H-N 121.12 7.87 H33H-N 119.42 7.49 G34H-N 114.83 8.87 L35H-N 117.73 7.07 F36H-N 112.58 8.64 G37H-N 112.25 9.48 R38H-N 124.4 8.35 K39H-N 121.83 8.08 T40H-N 109.36 7.39 G41H-N 113.21 8.54 Q42H-N 114.31 8.49 Q42HE21-NE2 114.26 6.94 Q42HE22-NE2 114.26 7.47 A43H-N 126.49 8.62 G45H-N 112.13 9.12 F46H-N 120.36 7.18 T47H-N 123.93 7.2 Y48H-N 127.65 8.45 T49H-N 113.08 10.27 D50H-N 121.8 8.78 A51H-N 120.42 7.78 N52H-N 117.43 8.41 N52HD21-ND2 107.27 7.4 N52HD22-ND2 107.27 8.77 K53H-N 119.19 8.08 N54H-N 114.55 8.68 N54HD21-ND2 111.55 6.99 N54HD22-ND2 111.55 7.41 K55H-N 122.48 7.49 G56H-N 102.16 7.13 I57H-N 110.45 6.38 T58H-N 115.06 8.09 W59H-N 129.77 9.0 K60H-N 120.14 8.21 E61H-N 123.09 10.74 E62H-N 114.63 9.72 T63H-N 108.8 7.21 L64H-N 123.12 8.86 M65H-N 118.41 8.52 E66H-N 117.46 6.74 Y67H-N 120.3 8.22 L68H-N 109.82 8.29 E69H-N 119.31 6.9 N70H-N 105.64 6.21 N70HD21-ND2 111.62 6.66 N70HD22-ND2 111.62 7.7 K72H-N 113.7 7.66 K73H-N 118.82 6.99 Y74H-N 119.15 7.33 I75H-N 114.18 8.3 G77H-N 111.17 8.63 T78H-N 115.0 8.12 K79H-N 123.36 7.94 M80H-N 123.39 7.15 I81H-N 130.13 7.85 F82H-N 123.57 6.51 A83H-N 129.77 8.2 I85H-N 121.53 8.44 K86H-N 127.94 8.63 K87H-N 120.28 8.4 K88H-N 129.45 9.06 T89H-N 110.63 8.4 E90H-N 119.33 6.39 R91H-N 117.52 7.53 E92H-N 118.13 8.62 D93H-N 123.07 8.48 L94H-N 121.41 8.43 I95H-N 120.14 8.98 A96H-N 123.4 8.12 Y97H-N 118.39 8.2 L98H-N 119.42 9.1 K99H-N 123.97 9.0 K100H-N 117.08 6.83 A101H-N 119.74 8.63 T102H-N 102.18 7.91 N103H-N 118.7 7.07 N103HD21-ND2 114.25 6.48 N103HD22-ND2 114.25 7.9 E104H-N 124.93 7.27