Assignment w1 w2 S4H-N 116.143 8.319 R5H-N 121.761 8.327 Y6H-N 120.186 8.505 I7H-N 127.428 8.936 T8H-N 117.2 8.717 D9H-N 124.413 8.34 M10H-N 115.48 8.715 T11H-N 113.52 8.816 I12H-N 120.247 8.671 E13H-N 122.63 8.312 E14H-N 119.718 7.596 L15H-N 117.156 8.124 S16H-N 108.757 7.54 R17H-N 124.591 7.36 D18H-N 124.729 8.663 W19H-N 120.059 8.298 W19HE1-NE1 129.351 9.702 F20H-N 120.864 8.455 M21H-N 120.839 8.136 L22H-N 127.106 9.608 M23H-N 119.14 8.712 K25H-N 123.17 8.322 Q26H-N 125.568 8.731 Q26HE21-NE2 112.062 7.351 Q26HE22-NE2 112.062 6.872 K27H-N 125.825 9.388 V28H-N 124.76 8.692 E29H-N 129.972 8.599 G30H-N 118.387 8.878 L32H-N 121.001 7.521 C33H-N 120.683 9.093 I34H-N 128.931 9.284 R35H-N 126.82 9.281 R35HE-NE 84.81 7.077 I36H-N 119.897 8.734 D37H-N 122.281 8.075 Q38H-N 125.835 9.113 Q38HE21-NE2 111.718 7.111 Q38HE22-NE2 111.718 6.99 A39H-N 119.974 8.497 I40H-N 117.228 6.805 M41H-N 128.093 8.477 D42H-N 113.91 6.933 K43H-N 117.863 9.345 N44H-N 119.441 8.518 N44HD21-ND2 113.784 7.682 N44HD22-ND2 113.784 6.893 I45H-N 125.323 9.144 M46H-N 128.492 9.337 L47H-N 126.245 8.972 K48H-N 120.726 8.908 A49H-N 123.571 10.647 N50H-N 117.674 8.668 N50HD21-ND2 110.553 7.862 N50HD22-ND2 110.553 6.511 F51H-N 120.377 9.045 S52H-N 115.555 9.63 V53H-N 119.131 8.67 I54H-N 123.454 8.661 F55H-N 124.453 8.856 D56H-N 114.814 8.634 R57H-N 117.052 8.191 L58H-N 122.882 7.976 E59H-N 129.421 9.476 T60H-N 112.339 7.416 L61H-N 132.65 12.56 I62H-N 127.608 8.652 L63H-N 114.505 7.715 L64H-N 127.476 8.43 R65H-N 125.689 9.55 R65HE-NE 84.8 7.855 A66H-N 124.132 7.773 F67H-N 121.763 9.093 T68H-N 112.406 9.383 E69H-N 122.936 9.336 E70H-N 115.769 8.117 G71H-N 108.093 8.145 A72H-N 122.83 7.408 V74H-N 115.293 8.204 G75H-N 105.759 6.771 E76H-N 120.923 9.322 I77H-N 123.552 9.053 S78H-N 119.79 9.089 L80H-N 125.81 8.156 S82H-N 109.804 7.82 F83H-N 120.396 7.723 G85H-N 106.263 7.872 H86H-N 114.515 7.598 T87H-N 110.753 9.685 I88H-N 120.338 9.11 E89H-N 121.84 7.899 D90H-N 119.339 7.697 V91H-N 120.703 7.812 K92H-N 119.714 8.757 N93H-N 118.326 8.367 N93HD21-ND2 113.089 7.81 N93HD22-ND2 113.089 7.108 A94H-N 122.03 8.085 I95H-N 119.174 8.716 G96H-N 106.409 8.125 V97H-N 123.448 7.749 L98H-N 122.824 8.163 I99H-N 118.036 9.085 G100H-N 105.45 8.269 G101H-N 108.307 8.143 L102H-N 121.034 8.153 E103H-N 121.912 9.319 R104H-N 120.077 7.76 N105H-N 117.815 6.941 N105HD21-ND2 112.003 7.889 N105HD22-ND2 112.003 6.499 D106H-N 111.755 7.812 N107H-N 112.783 7.116 N107HD21-ND2 113.87 7.516 N107HD22-ND2 113.87 6.771 T108H-N 119.254 8.774 V109H-N 127.434 9.398 R110H-N 127.83 8.999 V111H-N 116.851 8.61 S112H-N 121.855 7.958 K113H-N 120.87 9.079 T114H-N 110.723 8.032 L115H-N 126.091 8.218 Q116H-N 119.008 8.685 Q116HE21-NE2 112.311 7.383 Q116HE22-NE2 112.311 6.943 R117H-N 117.42 7.714 F118H-N 112.839 8.401 A119H-N 120.88 8.544 W120H-N 117.341 7.993 W120HE1-NE1 129.059 10.26 G121H-N 109.129 7.897 S122H-N 114.409 8.084 S123H-N 117.632 8.473 N124H-N 120.328 8.486 N124HD21-ND2 112.846 7.58 N124HD22-ND2 112.846 6.909 E125H-N 121.392 8.516 N126H-N 118.622 8.419 N126HD21-ND2 112.85 7.592 N126HD22-ND2 112.85 6.912 G127H-N 108.671 8.266 R128H-N 121.419 8.214 L131H-N 122.215 8.329 T132H-N 114.989 8.128 L133H-N 124.394 8.276 E134H-N 121.371 8.347