Assignment w1 w2 K3H-N 121.594 9.108 I4H-N 119.415 8.966 V5H-N 129.082 8.672 I6H-N 127.93 9.293 L7H-N 128.042 8.454 H9H-N 125.51 7.957 Q10H-N 125.332 8.658 Q10HE21-NE2 111.951 7.641 Q10HE22-NE2 111.951 6.788 D11H-N 114.719 8.433 L12H-N 119.643 9.206 C13H-N 108.984 8.4 D15H-N 114.977 8.692 G16H-N 108.464 8.031 A17H-N 119.917 8.627 V18H-N 120.213 8.447 L19H-N 125.836 9.327 E20H-N 121.478 8.513 A21H-N 126.933 8.694 N22H-N 120.894 9.418 N22HD21-ND2 113.84 7.494 N22HD22-ND2 113.84 6.974 S23H-N 116.561 8.793 G24H-N 115.918 9.104 E25H-N 122.546 7.859 T26H-N 111.68 8.66 I27H-N 118.983 8.214 L28H-N 115.72 7.648 D29H-N 119.248 8.226 A30H-N 122.266 7.984 A31H-N 122.162 8.226 L32H-N 118.492 9.218 R33H-N 118.079 7.893 N34H-N 116.607 7.399 N34HD21-ND2 115.218 8.371 N34HD22-ND2 115.218 7.102 G35H-N 106.319 7.71 I36H-N 122.565 8.107 E37H-N 127.535 8.18 I38H-N 124.921 7.403 E39H-N 132.311 9.05 C53H-N 122.447 9.634 I54H-N 119.436 9.335 V55H-N 129.517 8.558 R56H-N 125.963 7.883 E57H-N 116.148 7.928 G58H-N 109.488 8.82 F59H-N 125.775 9.184 D60H-N 115.633 8.916 S61H-N 114.946 7.897 L62H-N 124.875 7.205 E64H-N 124.021 8.697 S65H-N 118.991 8.553 S66H-N 118.302 8.424 E67H-N 120.467 8.91 Q68H-N 117.988 8.138 Q68HE21-NE2 111.409 7.547 Q68HE22-NE2 111.409 6.902 E69H-N 122.454 7.754 D70H-N 121.035 8.476 D71H-N 118.916 8.099 M72H-N 117.595 7.44 L73H-N 119.802 8.753 D74H-N 114.573 7.35 K75H-N 115.372 7.598 A76H-N 124.67 8.054 W77H-N 124.163 8.463 W77HE1-NE1 129.236 10.095 G78H-N 113.45 8.204 L79H-N 118.442 6.777 E80H-N 128.557 9.854 E82H-N 112.827 7.312 S83H-N 120.056 7.887 R84H-N 117.396 9.57 L85H-N 121.814 9.648 A89H-N 122.735 7.081 R90H-N 124.683 7.83 V91H-N 118.679 8.173 T92H-N 119.639 9.072 D93H-N 120.651 8.793 E94H-N 120.29 7.693 D95H-N 122.712 8.404 L96H-N 116.662 8.588 V97H-N 122.198 8.177 V98H-N 126.161 9.678 E99H-N 126.631 9.497 I100H-N 130.349 9.687 T104H-N 116.126 7.71 I105H-N 121.553 7.921 A108H-N 124.481 8.122 R109H-N 119.96 8.178 E110H-N 122.171 8.39 H111H-N 124.638 7.871