Assignment w1 w2 T3H-N 115.173 8.15 Y4H-N 122.062 8.11 S5H-N 117.361 8.725 M6H-N 121.232 8.716 C7H-N 124.694 9.584 D8H-N 122.531 8.768 K9H-N 124.911 8.488 T10H-N 111.661 9.18 K11H-N 121.378 7.161 F12H-N 116.949 8.627 K13H-N 117.537 8.539 W14H-N 121.576 8.933 W14HE1-NE1 129.219 10.141 K15H-N 126.081 9.024 R16H-N 120.245 8.694 R16HE-NE 84.636 7.517 V17H-N 119.299 7.959 V19H-N 120.245 8.564 D20H-N 123.886 8.44 S21H-N 122.44 8.978 G22H-N 110.859 8.948 H23H-N 116.939 8.043 D24H-N 116.711 9.414 T25H-N 105.528 7.13 V26H-N 121.891 9.273 V27H-N 118.597 8.56 M28H-N 114.82 8.068 E29H-N 117.459 9.503 V30H-N 118.625 9.143 S31H-N 116.465 9.299 Y32H-N 123.067 8.813 T33H-N 116.15 8.427 G34H-N 105.941 5.045 S35H-N 113.402 8.659 D36H-N 124.348 9.848 K37H-N 116.538 7.178 C39H-N 113.909 8.486 R40H-N 120.538 9.111 R40HE-NE 84.512 7.167 I41H-N 126.531 8.42 V43H-N 124.357 7.938 R44H-N 124.254 9.136 R44HE-NE 83.984 6.883 A45H-N 119.208 8.541 V46H-N 113.426 9.121 A47H-N 126.804 9.448 H48H-N 119.91 8.757 G49H-N 111.39 8.836 V50H-N 120.244 7.943 T52H-N 106.179 7.496 I53H-N 120.799 6.861 N54H-N 125.934 8.852 N54HD21-ND2 113.558 7.328 N54HD22-ND2 113.558 7.729 V55H-N 119.532 9.061 A56H-N 122.464 7.784 M57H-N 124.478 8.251 L58H-N 125.857 8.879 I59H-N 126.656 8.667 T60H-N 111.176 7.514 N62H-N 115.268 8.732 N62HD21-ND2 113.186 7.68 N62HD22-ND2 113.186 6.744 T64H-N 119.159 8.599 I65H-N 123.47 8.758 E66H-N 124.459 8.137 T67H-N 113.739 9.149 S68H-N 112.555 7.712 G69H-N 109.918 8.047 G70H-N 108.486 8.381 G71H-N 106.607 8.79 F72H-N 124.218 8.409 I73H-N 126.348 7.967 E74H-N 126.356 8.234 M75H-N 123.039 9.327 Q76H-N 121.536 9.31 Q76HE21-NE2 111.6 6.819 Q76HE22-NE2 111.6 7.524 L77H-N 125.259 8.659 G80H-N 110.85 8.86 D81H-N 119.981 8.444 N82H-N 123.735 8.939 N82HD21-ND2 111.647 5.775 N82HD22-ND2 111.647 6.808 I83H-N 121.593 9.614 I84H-N 127.048 8.711 Y85H-N 124.044 9.064 V86H-N 123.108 8.389 G87H-N 111.207 8.132 D88H-N 126.335 8.562 L89H-N 123.917 8.342 S90H-N 115.118 8.326 Q91H-N 121.401 8.879 Q91HE21-NE2 112.492 7.703 Q91HE22-NE2 112.492 6.906 Q92H-N 128.491 8.946 Q92HE21-NE2 112.247 7.851 Q92HE22-NE2 112.247 6.699 W93H-N 125.745 9.114 W93HE1-NE1 128.594 10.062 F94H-N 130.298 7.857 Q95H-N 128.945 8.532 Q95HE21-NE2 116.454 7.577 Q95HE22-NE2 116.454 7.266 K96H-N 129.749 8.68 G97H-N 108.268 8.406 S98H-N 115.452 8.466 T99H-N 116.71 8.567 I100H-N 123.047 8.169 G101H-N 113.662 8.54 R102H-N 125.707 7.824 R102HE-NE 85.196 7.219