Assignment w1 w2 D2H-N 120.18 8.51 Q3H-N 119.7 8.268 Q3HE21-NE2 111.81 7.404 Q3HE22-NE2 111.81 6.713 L4H-N 122.92 8.178 T5H-N 112.56 8.552 E6H-N 120.07 8.909 E7H-N 118.95 8.5 Q8H-N 119.69 7.598 Q8HE21-NE2 110.72 7.304 Q8HE22-NE2 110.72 6.66 I9H-N 118.746 8.211 A10H-N 120.73 7.947 E11H-N 119.1 7.721 F12H-N 119.51 8.469 K13H-N 123.357 9.173 E14H-N 119.99 7.85 A15H-N 121.08 7.95 F16H-N 118.3 8.687 S17H-N 112.93 8.048 L18H-N 119.71 7.345 F19H-N 112.67 7.104 D20H-N 116.37 7.657 K21H-N 124.048 7.759 D22H-N 113.695 7.975 G23H-N 108.78 7.59 D24H-N 120.41 8.384 G25H-N 112.42 10.494 T26H-N 111.83 8.144 I27H-N 126.016 9.801 T28H-N 115.98 8.304 T29H-N 112.12 9.043 K30H-N 120.4 7.53 E31H-N 121.4 7.627 L32H-N 120.3 8.555 G33H-N 105.19 8.659 T34H-N 117.67 7.894 V35H-N 121.799 7.432 M36H-N 116.57 8.218 R37H-N 118.3 8.479 S38H-N 118.0 7.891 L39H-N 118.63 7.238 G40H-N 105.51 7.645 Q41H-N 117.57 7.78 Q41HE21-NE2 110.51 7.189 Q41HE22-NE2 110.51 6.372 N42H-N 116.13 8.554 N42HD21-ND2 111.6 7.378 N42HD22-ND2 111.6 6.591 T44H-N 112.21 8.634 E45H-N 120.17 8.667 A46H-N 120.15 8.109 E47H-N 118.18 7.469 L48H-N 118.72 7.93 Q49H-N 117.74 8.109 Q49HE21-NE2 112.28 7.391 Q49HE22-NE2 112.28 6.776 D50H-N 120.18 7.965 M51H-N 119.4 7.882 I52H-N 118.19 7.786 N53H-N 117.58 8.672 N53HD21-ND2 111.05 7.745 N53HD22-ND2 111.05 6.842 E54H-N 116.065 7.585 V55H-N 110.47 7.153 D56H-N 121.218 7.698 A57H-N 131.06 8.094 D58H-N 113.56 8.182 G59H-N 108.15 7.524 N60H-N 118.4 8.121 N60HD21-ND2 114.66 7.644 N60HD22-ND2 114.66 6.882 G61H-N 113.01 10.518 T62H-N 107.88 7.594 I63H-N 122.99 8.697 D64H-N 128.0 8.876 F65H-N 118.01 8.893 E67H-N 117.3 8.137 F68H-N 122.91 8.607 L69H-N 119.45 8.776 T70H-N 114.11 7.53 M71H-N 120.12 7.114 M72H-N 117.64 7.899 A73H-N 119.75 8.089 R74H-N 115.62 7.148 K75H-N 117.41 7.876 M76H-N 117.91 7.965 K77H-N 119.45 7.613 D78H-N 119.45 7.824 T79H-N 113.151 7.82 D80H-N 122.7 8.283 S81H-N 116.82 8.32 E82H-N 122.84 8.73 E83H-N 117.54 8.41 E84H-N 118.2 7.66 I85H-N 121.0 8.076 R86H-N 120.53 8.444 E87H-N 116.52 8.028 A88H-N 121.1 8.101 F89H-N 118.067 8.515 R90H-N 114.88 7.699 V91H-N 117.49 7.247 F92H-N 113.01 6.78 D93H-N 115.98 7.745 K94H-N 125.32 7.629 D95H-N 113.811 8.182 G96H-N 108.7 7.69 N97H-N 119.22 8.314 N97HD21-ND2 116.37 7.965 N97HD22-ND2 116.37 7.321 G98H-N 112.11 10.489 Y99H-N 116.02 7.661 I100H-N 126.84 10.022 S101H-N 123.52 8.93 A102H-N 122.78 9.267 A103H-N 117.95 8.126 E104H-N 119.99 7.831 L105H-N 120.48 8.165 R106H-N 117.82 8.779 H107H-N 119.68 8.127 V108H-N 118.5 7.817 M109H-N 114.85 8.137 T110H-N 115.45 8.553 N111H-N 123.01 7.944 N111HD21-ND2 109.909 7.294 N111HD22-ND2 109.909 6.353 L112H-N 118.02 7.707 G113H-N 104.58 7.614 E114H-N 120.34 7.86 K115H-N 124.62 8.424 L116H-N 124.263 7.915 T117H-N 113.61 9.01 D118H-N 120.65 8.772 E119H-N 118.79 8.556 E120H-N 119.73 7.614 V121H-N 120.1 7.893 D122H-N 119.6 7.985 E123H-N 118.66 7.902 M124H-N 118.66 7.589 I125H-N 117.77 7.71 R126H-N 118.15 8.128 E127H-N 116.84 7.678 A128H-N 116.84 7.232 D129H-N 117.92 7.9 I130H-N 127.438 8.222 D131H-N 116.6 8.278 G132H-N 108.08 7.603 D133H-N 120.147 8.283 G134H-N 111.93 10.008 Q135H-N 115.09 7.951 Q135HE21-NE2 108.09 6.479 Q135HE22-NE2 108.09 5.854 V136H-N 125.15 9.117 N137H-N 128.713 9.518 N137HD21-ND2 108.43 7.11 N137HD22-ND2 108.43 6.82 Y138H-N 118.1 8.201 E139H-N 118.16 8.02 E140H-N 119.52 8.725 F141H-N 124.02 8.602 V142H-N 119.15 8.716 Q143H-N 119.18 7.755 Q143HE21-NE2 110.94 7.241 Q143HE22-NE2 110.94 6.644 M144H-N 118.34 7.532 M145H-N 114.79 7.74 T146H-N 108.27 7.658 A147H-N 126.062 7.312 K148H-N 125.77 7.84