Assignment w1 w2 D2H-N 120.7 8.7 D3H-N 121.759 8.46 I4H-N 120.26 8.137 Y5H-N 121.885 7.837 K6H-N 121.243 8.021 A7H-N 120.77 7.846 A8H-N 120.225 7.473 V9H-N 119.237 7.953 E10H-N 118.553 7.657 Q11H-N 114.888 7.354 Q11HE21-NE2 112.402 6.804 Q11HE22-NE2 112.402 7.492 L12H-N 120.99 7.37 T13H-N 113.745 8.862 E14H-N 121.998 9.047 E15H-N 117.628 8.699 Q16H-N 119.429 7.858 Q16HE21-NE2 111.453 7.529 Q16HE22-NE2 111.453 6.803 K17H-N 119.349 8.617 N18H-N 117.658 8.656 N18HD21-ND2 111.846 7.646 N18HD22-ND2 111.846 7.021 E19H-N 123.81 7.928 F20H-N 117.384 8.265 K21H-N 122.286 8.992 A22H-N 121.972 7.978 A23H-N 119.603 8.023 F24H-N 121.725 8.957 D25H-N 117.437 8.793 I26H-N 119.289 7.179 F27H-N 125.572 8.192 V28H-N 105.133 7.642 L29H-N 126.43 7.167 G30H-N 114.261 8.993 A31H-N 124.641 8.278 E32H-N 125.855 9.372 D33H-N 114.797 8.036 G34H-N 105.866 7.408 C35H-N 114.501 7.391 I36H-N 119.704 8.949 S37H-N 126.311 9.39 T38H-N 110.792 8.696 K39H-N 123.727 8.009 E40H-N 120.384 7.819 L41H-N 119.068 8.512 G42H-N 106.023 8.467 K43H-N 119.892 7.084 V44H-N 119.907 7.539 M45H-N 118.026 8.768 R46H-N 118.882 8.01 R46HE-NE 85.144 7.344 M47H-N 122.675 7.79 L48H-N 117.94 7.481 G49H-N 107.573 7.883 Q50H-N 117.441 7.808 Q50HE21-NE2 112.329 7.203 Q50HE22-NE2 112.329 6.819 N51H-N 116.428 9.019 N51HD21-ND2 112.696 7.607 N51HD22-ND2 112.696 6.735 T53H-N 114.298 9.052 E55H-N 117.713 8.728 E56H-N 122.126 7.85 L57H-N 116.836 8.041 Q58H-N 117.452 7.779 Q58HE21-NE2 116.53 8.01 Q58HE22-NE2 116.53 6.922 E59H-N 119.793 8.093 M60H-N 119.539 8.223 I61H-N 118.057 7.504 D62H-N 119.524 8.777 E63H-N 118.15 7.862 V64H-N 109.486 7.116 D65H-N 122.887 7.943 E66H-N 128.584 7.987 D67H-N 114.438 8.106 G68H-N 109.361 7.795 S69H-N 117.384 8.585 G70H-N 116.716 10.777 T71H-N 106.769 7.49 V72H-N 126.822 9.482 D73H-N 129.397 8.823 F74H-N 118.006 8.371 D75H-N 118.548 7.641 E76H-N 120.602 8.546 F77H-N 123.335 8.88 L78H-N 120.597 8.333 V79H-N 116.815 7.013 M80H-N 119.439 7.339 M81H-N 120.106 8.136 V82H-N 117.307 7.919 R83H-N 120.77 7.826 R83HE-NE 83.953 7.033 C84H-N 117.221 8.248 M85H-N 120.328 8.228 K86H-N 118.915 7.756 D87H-N 120.136 8.161 D88H-N 120.7 8.374 S89H-N 116.751 8.298 K90H-N 122.531 8.391 G91H-N 108.253 7.95 A92H-N 123.748 8.121 G93H-N 108.074 8.278 A94H-N 123.714 7.965 G95H-N 108.372 8.426 V96H-N 119.201 7.865 R97H-N 122.549 7.944 R97HE-NE 84.584 7.178 I98H-N 121.416 7.399 S99H-N 119.932 8.316 A100H-N 129.661 8.705 D101H-N 116.48 8.464 A102H-N 122.136 7.823 M103H-N 117.237 7.801 M104H-N 116.65 8.455 Q105H-N 118.383 8.33 Q105HE21-NE2 112.228 7.522 Q105HE22-NE2 112.228 6.764 A106H-N 121.562 7.786 L107H-N 115.731 7.947 L108H-N 114.778 8.3 G109H-N 109.942 7.872 A110H-N 125.115 8.368 R111H-N 117.793 7.96 R111HE-NE 84.63 7.447 A112H-N 123.647 7.939 K113H-N 121.185 8.436 E114H-N 121.7 8.878 S115H-N 115.836 8.407 L116H-N 123.226 7.873 D117H-N 120.789 8.17 L118H-N 122.986 8.148 R119H-N 119.101 8.14 R119HE-NE 84.925 7.493 A120H-N 122.451 7.97 H121H-N 117.341 8.146 L122H-N 121.373 7.965 K123H-N 120.973 8.029 Q124H-N 121.311 8.193 Q124HE21-NE2 112.679 7.539 Q124HE22-NE2 112.679 6.883 V125H-N 122.083 8.144 K126H-N 126.06 8.371 K127H-N 124.929 8.459 E128H-N 123.651 8.526 D129H-N 127.232 8.017