Assignment w1 w2 A2H-N 126.379 8.378 N3H-N 118.329 8.443 N3HD21-ND2 112.482 7.505 N3HD22-ND2 112.482 6.855 T4H-N 114.519 8.117 A5H-N 126.186 8.313 S6H-N 114.732 8.217 Q7H-N 121.817 8.258 Q7HE21-NE2 112.095 7.508 Q7HE22-NE2 112.095 6.829 Q8H-N 121.597 8.294 Q8HE21-NE2 109.555 7.347 Q8HE22-NE2 109.555 6.757 L9H-N 123.322 8.295 S10H-N 117.966 9.51 L11H-N 127.394 8.836 D12H-N 121.984 8.349 K14H-N 116.231 8.059 Q15H-N 117.985 7.365 Q15HE21-NE2 112.172 7.52 Q15HE22-NE2 112.172 6.949 R16H-N 121.002 8.804 R16HE-NE 82.912 7.301 S17H-N 113.054 8.189 K18H-N 120.203 6.686 Q19H-N 120.191 7.798 I20H-N 121.278 8.657 L21H-N 117.513 7.967 S22H-N 113.568 7.816 N23H-N 118.668 7.452 N23HD21-ND2 112.364 7.58 N23HD22-ND2 112.364 6.876 L24H-N 123.238 7.432 K25H-N 122.105 8.316 K26H-N 120.904 8.114 S27H-N 119.541 8.209 L30H-N 123.424 8.68 N31H-N 118.599 8.608 N31HD21-ND2 112.407 7.516 N31HD22-ND2 112.407 6.792 L32H-N 119.917 8.305 N33H-N 118.956 8.736 N33HD21-ND2 112.13 7.482 N33HD22-ND2 112.13 6.795 I34H-N 117.931 7.369 S35H-N 120.928 8.431 L36H-N 125.56 8.527 T38H-N 120.751 8.839 D39H-N 118.735 8.557 L40H-N 119.823 7.611 T41H-N 103.077 7.559 S42H-N 115.762 7.227 T43H-N 113.979 8.041 D44H-N 124.948 8.529 A46H-N 119.998 8.142 K47H-N 119.578 7.431 Q48H-N 121.077 8.112 Q48HE21-NE2 112.202 7.182 Q48HE22-NE2 112.202 6.994 Q49H-N 118.164 8.489 Q49HE21-NE2 111.231 7.474 Q49HE22-NE2 111.231 6.935 A50H-N 120.44 7.601 A51H-N 120.898 7.813 L52H-N 119.839 8.55 F53H-N 119.55 8.64 Q54H-N 115.803 7.394 Q54HE21-NE2 111.557 7.567 Q54HE22-NE2 111.557 6.931 V55H-N 119.618 8.261 I56H-N 118.928 9.031 A57H-N 123.871 8.036 A58H-N 119.13 7.426 L59H-N 120.844 8.338 Q60H-N 118.798 8.754 Q60HE21-NE2 107.505 7.827 Q60HE22-NE2 107.505 6.119 K61H-N 116.728 7.917 H62H-N 116.738 7.95 F63H-N 114.024 7.759 K64H-N 119.944 7.807 T65H-N 114.69 8.343 N66H-N 118.949 8.751 N66HD21-ND2 112.273 7.468 N66HD22-ND2 112.273 6.935 M67H-N 117.305 8.095 E68H-N 120.421 8.2 N69H-N 117.833 8.164 N69HD21-ND2 113.758 7.667 N69HD22-ND2 113.758 7.039 V70H-N 119.417 8.191 N71H-N 123.687 8.849 N71HD21-ND2 113.187 7.801 N71HD22-ND2 113.187 7.227 Y72H-N 126.744 8.876 D73H-N 121.628 8.295 L74H-N 121.35 7.567 L75H-N 119.463 8.275 Q76H-N 115.541 7.979 Q76HE21-NE2 111.227 7.253 Q76HE22-NE2 111.227 6.919 K77H-N 119.439 7.389 Q78H-N 120.497 8.724 Q78HE21-NE2 106.54 7.654 Q78HE22-NE2 106.54 4.875 V79H-N 118.747 8.535 K80H-N 118.615 7.803 Y81H-N 118.894 7.969 I82H-N 113.659 7.634 M83H-N 124.522 8.986 D84H-N 121.89 9.33 S85H-N 113.192 7.564 N86H-N 117.557 7.699 N86HD21-ND2 111.983 7.466 N86HD22-ND2 111.983 7.193 M87H-N 119.188 7.878 L88H-N 110.79 8.362 N89H-N 110.902 7.324 N89HD21-ND2 114.913 7.656 N89HD22-ND2 114.913 7.291 L90H-N 123.012 7.596 Q92H-N 113.825 8.98 Q92HE21-NE2 111.627 7.774 Q92HE22-NE2 111.627 6.883 F93H-N 117.122 7.288 Q94H-N 116.342 8.029 Q94HE21-NE2 110.414 7.893 Q94HE22-NE2 110.414 6.959 H95H-N 112.383 7.699 L96H-N 121.22 7.199 Q98H-N 122.018 8.914 Q98HE21-NE2 112.272 7.606 Q98HE22-NE2 112.272 7.047 E99H-N 117.253 9.462 E100H-N 119.335 7.351 K101H-N 120.437 8.112 M102H-N 115.463 7.754 S103H-N 114.651 7.955 A104H-N 124.658 8.481 I105H-N 118.472 7.927 L106H-N 119.366 8.296 A107H-N 119.898 8.497 M108H-N 117.339 8.1 L109H-N 119.428 8.459 N110H-N 113.596 8.699 N110HD21-ND2 109.005 7.326 N110HD22-ND2 109.005 6.471 S111H-N 115.501 7.632 N112H-N 122.139 6.997 N112HD21-ND2 111.722 5.317 N112HD22-ND2 111.722 6.927 S113H-N 121.874 8.968 D114H-N 117.834 8.082 T115H-N 103.641 7.459 A116H-N 125.726 7.063 L117H-N 119.34 8.277 S118H-N 113.89 7.777 V119H-N 121.853 8.005 H122H-N 118.649 8.516 D123H-N 121.849 8.444 S124H-N 116.398 8.344 T125H-N 120.758 7.872