Assignment w1 w2 G4H-N 110.417 8.373 S5H-N 117.002 8.174 V7H-N 122.064 8.084 S8H-N 120.861 8.396 Y9H-N 120.699 8.5 Y10H-N 122.06 8.803 F11H-N 127.349 8.704 S12H-N 120.175 8.678 Y13H-N 117.874 8.184 A14H-N 126.733 8.637 D15H-N 114.163 7.862 G16H-N 108.719 8.252 G17H-N 108.995 8.425 T18H-N 105.027 8.502 S19H-N 116.137 7.815 H20H-N 122.292 7.566 T21H-N 124.831 7.925 E22H-N 125.496 8.381 Y23H-N 121.046 8.554 D25H-N 110.595 7.835 D26H-N 115.508 7.761 S27H-N 119.304 8.596 S28H-N 118.465 8.219 A29H-N 123.306 8.422 G30H-N 108.012 6.848 S31H-N 111.208 8.285 F32H-N 116.532 8.863 I33H-N 119.376 8.513 L34H-N 127.317 9.195 D35H-N 122.774 8.7 I36H-N 125.777 8.297 T37H-N 126.558 8.957 S38H-N 119.982 8.937 Y39H-N 124.391 8.905 K40H-N 116.255 9.202 K41H-N 125.154 9.157 T42H-N 121.608 8.491 G43H-N 117.318 9.061 N44H-N 123.9 8.739 N44HD21-ND2 112.884 6.868 N44HD22-ND2 112.884 7.536 S45H-N 115.964 8.04 T46H-N 116.914 8.458 K47H-N 123.525 8.771 A48H-N 128.893 8.7 L49H-N 119.668 7.609 S50H-N 121.328 8.884 W51H-N 113.514 7.401 W51HE1-NE1 126.981 9.179 N52H-N 117.619 8.446 N52HD21-ND2 113.657 6.794 N52HD22-ND2 113.657 7.51 A53H-N 122.705 8.694 S54H-N 114.209 8.223 G55H-N 111.123 8.439 D56H-N 122.033 7.754 S57H-N 113.994 8.653 W58H-N 115.435 6.789 W58HE1-NE1 130.058 10.486 I59H-N 119.905 6.69 H60H-N 125.127 9.082 H60HD1-ND1 218.986 8.904 V61H-N 126.727 9.112 N62H-N 127.701 8.868 N62HD21-ND2 112.479 6.774 N62HD22-ND2 112.479 7.574 G63H-N 116.501 8.957 S64H-N 127.241 9.195 S65H-N 116.272 7.91 V66H-N 127.651 8.591 S67H-N 120.843 8.906 Y68H-N 118.584 8.316 D69H-N 120.917 8.527 E70H-N 118.925 8.56 N71H-N 125.422 8.89 N71HD21-ND2 109.395 6.416 N71HD22-ND2 109.395 6.756 A73H-N 123.026 7.226 K74H-N 116.805 8.322 E75H-N 117.013 7.136 R76H-N 122.836 8.147 R77H-N 120.812 8.761 T78H-N 118.073 8.659 G79H-N 117.842 9.591 L80H-N 123.877 9.256 V81H-N 121.607 9.158 T82H-N 120.959 8.887 L83H-N 129.86 9.23 K84H-N 123.371 8.953 Q85H-N 132.111 8.867 Q85HE21-NE2 116.85 6.499 Q85HE22-NE2 116.85 8.243 D86H-N 130.148 8.536 E87H-N 114.329 8.221 S88H-N 117.944 8.728 G89H-N 110.22 7.342 K90H-N 120.658 8.104 T91H-N 107.27 8.167 L92H-N 119.616 8.651 S93H-N 113.411 8.405 L94H-N 132.093 9.074 K95H-N 127.543 8.756 I96H-N 122.404 8.543 V97H-N 128.424 7.928 Q98H-N 130.005 9.426 Q98HE21-NE2 111.943 6.734 Q98HE22-NE2 111.943 7.5 G100H-N 105.438 8.059 K101H-N 123.066 8.588 T102H-N 116.852 8.313 S103H-N 117.66 8.046 I104H-N 121.534 8.168 D105H-N 128.701 7.853