Assignment w1 w2 A5H-N 125.299 8.302 Q6H-N 119.424 8.236 A7H-N 125.056 8.212 R8H-N 120.156 8.192 S9H-N 115.687 8.086 W11H-N 112.678 7.094 W11HE1-NE1 127.032 10.221 S12H-N 112.206 7.309 D13H-N 113.656 7.419 T14H-N 114.727 8.739 A15H-N 124.476 8.27 T16H-N 118.434 8.609 A17H-N 125.681 8.19 D18H-N 116.416 8.278 A19H-N 120.172 7.643 F20H-N 119.587 9.101 I21H-N 119.438 8.77 Q22H-N 118.143 8.473 Q22HE21-NE2 114.23 7.738 Q22HE22-NE2 114.23 6.825 N23H-N 118.773 8.447 N23HD21-ND2 114.462 7.394 N23HD22-ND2 114.462 7.238 F24H-N 124.396 8.918 L25H-N 119.55 8.755 A26H-N 122.686 7.848 A27H-N 121.845 7.943 V28H-N 114.2 8.491 S29H-N 119.69 8.193 G30H-N 107.224 7.594 S31H-N 114.687 7.568 G32H-N 110.63 7.836 A33H-N 121.13 7.946 F34H-N 113.047 7.79 T35H-N 113.086 8.739 S36H-N 116.337 9.077 D37H-N 119.984 8.221 Q38H-N 119.582 7.567 Q38HE21-NE2 111.083 7.728 Q38HE22-NE2 111.083 6.787 L39H-N 119.916 8.392 D40H-N 122.183 8.241 D41H-N 122.303 7.922 M42H-N 120.235 8.475 S43H-N 113.182 7.965 T44H-N 114.196 7.572 I45H-N 122.658 8.097 G46H-N 108.644 8.182 D47H-N 121.932 7.893 T48H-N 118.254 8.12 I49H-N 122.733 8.463 M50H-N 119.159 8.629 S51H-N 115.166 8.242 A52H-N 125.06 7.801 M53H-N 118.317 8.702 D54H-N 120.237 7.855 K55H-N 118.71 7.899 M56H-N 117.384 8.398 A57H-N 123.236 8.015 R58H-N 116.054 7.668 S59H-N 113.839 7.522 K61H-N 118.609 7.799 S62H-N 117.452 8.774 S63H-N 121.827 8.94 H65H-N 120.076 7.905 K66H-N 120.178 8.324 L67H-N 117.7 8.097 Q68H-N 116.98 7.784 Q68HE21-NE2 112.448 7.555 Q68HE22-NE2 112.448 6.939 A69H-N 121.532 8.012 L70H-N 121.549 8.107 N71H-N 118.942 8.493 N71HD21-ND2 107.224 6.327 N71HD22-ND2 107.224 7.643 M72H-N 117.571 8.098 A73H-N 124.6 8.119 F74H-N 119.206 8.398 A75H-N 120.151 9.001 S76H-N 112.298 8.731 S77H-N 117.361 7.465 M78H-N 118.15 7.91 A79H-N 121.498 8.761 E80H-N 116.273 7.533 I81H-N 118.516 7.416 A82H-N 120.612 8.463 A83H-N 115.787 7.459 V84H-N 118.265 7.35 E85H-N 125.093 8.481 Q86H-N 121.618 8.218 Q86HE21-NE2 112.008 7.505 Q86HE22-NE2 112.008 6.87 G87H-N 111.129 8.601 G88H-N 109.163 8.444 M89H-N 120.16 8.226 S90H-N 116.97 8.316 V93H-N 119.155 7.62 K94H-N 120.198 8.221 T95H-N 115.625 8.785 N96H-N 120.33 8.294 N96HD21-ND2 112.021 7.626 N96HD22-ND2 112.021 6.894 A97H-N 121.915 7.991 I98H-N 120.844 8.282 V99H-N 121.383 8.518 D100H-N 120.007 8.783 G101H-N 109.354 8.508 L102H-N 123.481 8.987 N103H-N 118.005 8.489 N103HD21-ND2 113.281 7.997 N103HD22-ND2 113.281 6.946 S104H-N 116.341 8.704 A105H-N 123.071 8.775 F106H-N 121.698 8.911 Y107H-N 122.796 8.058 M108H-N 117.054 8.862 T109H-N 110.739 7.886 T110H-N 108.848 8.263 G111H-N 111.287 7.943 A112H-N 122.515 7.81 A113H-N 119.474 7.958 N114H-N 115.489 8.52 N114HD21-ND2 111.666 6.024 N114HD22-ND2 111.666 6.806 Q116H-N 117.398 8.199 Q116HE21-NE2 112.33 7.635 Q116HE22-NE2 112.33 6.832 F117H-N 120.191 7.347 V118H-N 118.465 7.775 N119H-N 118.212 8.629 N119HD21-ND2 112.427 7.586 N119HD22-ND2 112.427 6.952 E120H-N 122.018 8.044 M121H-N 118.775 8.327 R122H-N 119.745 8.785 S123H-N 114.867 7.894 L124H-N 122.914 8.402 I125H-N 117.982 8.683 S126H-N 115.273 8.086 M127H-N 121.786 8.146 I128H-N 120.726 8.378 S129H-N 115.352 8.273 A130H-N 123.622 7.79 A131H-N 120.953 7.769 S132H-N 113.779 7.998 A133H-N 124.625 7.978 N134H-N 117.062 8.169 N134HD21-ND2 112.177 6.896 N134HD22-ND2 112.177 7.519 E135H-N 120.898 8.214 V136H-N 120.99 8.098 S137H-N 119.864 8.201 Y138H-N 127.225 7.75