Assignment w1 w2 D8H-N 120.977 8.157 A9H-N 122.955 8.155 F10H-N 116.699 8.274 T11H-N 112.454 7.417 D12H-N 122.317 8.633 Q13H-N 117.568 8.258 Q13HE21-NE2 111.985 7.465 Q13HE22-NE2 111.985 6.858 K14H-N 119.091 7.608 I15H-N 121.591 7.981 R16H-N 116.248 7.989 R16HE-NE 85.303 7.498 Q17H-N 116.709 7.758 Q17HE21-NE2 111.509 6.782 Q17HE22-NE2 111.509 7.413 R18H-N 120.567 7.704 Y19H-N 114.327 6.778 A20H-N 123.136 7.089 D21H-N 113.108 8.479 L22H-N 122.913 7.648 G24H-N 108.492 8.168 E25H-N 118.566 8.173 L26H-N 130.9 8.764 H27H-N 126.301 9.037 I28H-N 120.665 8.041 I29H-N 119.777 9.061 E30H-N 119.551 8.047 L31H-N 122.475 8.67 E32H-N 121.455 8.489 K33H-N 122.464 8.825 D34H-N 121.884 8.379 K35H-N 118.021 8.294 N36H-N 116.217 8.68 N36HD21-ND2 115.558 6.985 N36HD22-ND2 115.558 7.991 G37H-N 109.7 8.167 L40H-N 118.58 7.643 S41H-N 118.596 8.594 L42H-N 125.897 8.887 A43H-N 121.28 8.989 G44H-N 105.536 8.035 N45H-N 119.508 9.01 N45HD21-ND2 114.784 7.333 N45HD22-ND2 114.784 8.247 K46H-N 126.224 8.871 D47H-N 120.146 9.188 R48H-N 123.411 8.504 S49H-N 114.937 8.648 R50H-N 123.046 7.981 M51H-N 122.249 8.498 S52H-N 118.461 8.087 I53H-N 124.11 8.26 F54H-N 123.523 9.252 V55H-N 119.747 8.857 V56H-N 123.214 8.755 G57H-N 109.937 7.679 I58H-N 122.556 8.381 N59H-N 128.411 8.398 N59HD21-ND2 112.888 7.066 N59HD22-ND2 112.888 7.819 E61H-N 115.191 8.307 G62H-N 106.708 7.57 A64H-N 119.777 7.717 A65H-N 125.682 8.592 A66H-N 120.679 7.773 D67H-N 116.507 7.741 G68H-N 102.836 7.389 R69H-N 119.229 7.901 R69HE-NE 86.12 9.053 M70H-N 118.766 8.935 R71H-N 121.058 8.948 I72H-N 120.347 8.191 G73H-N 117.614 9.613 D74H-N 122.679 7.775 E75H-N 121.913 8.592 L76H-N 125.649 8.749 L77H-N 118.639 8.887 E78H-N 115.422 7.802 I79H-N 119.303 8.296 N80H-N 126.047 9.835 N80HD21-ND2 111.103 7.007 N80HD22-ND2 111.103 8.086 I83H-N 124.726 8.758 L84H-N 128.126 8.498 Y85H-N 120.338 7.499 G86H-N 117.938 9.037 R87H-N 120.512 8.406 S88H-N 112.721 8.174 H89H-N 119.757 9.232 Q90H-N 121.964 8.044 Q90HE21-NE2 110.25 6.571 Q90HE22-NE2 110.25 7.426 N91H-N 119.759 7.827 N91HD21-ND2 112.579 7.14 N91HD22-ND2 112.579 7.653 A92H-N 121.224 7.956 S93H-N 113.655 8.45 A94H-N 124.669 7.634 I95H-N 120.084 7.805 I96H-N 119.342 8.133 K97H-N 119.347 7.928 T98H-N 106.349 7.51 A99H-N 125.703 7.289 S101H-N 110.006 8.011 K102H-N 118.115 7.459 V103H-N 125.945 9.14 K104H-N 128.171 8.675 L105H-N 128.706 9.596 V106H-N 121.464 8.495 F107H-N 124.669 9.192 I108H-N 118.778 9.582 R109H-N 132.624 9.36 R109HE-NE 84.179 9.597 N110H-N 128.808 9.121 N110HD21-ND2 113.693 7.291 N110HD22-ND2 113.693 7.888 E111H-N 127.972 9.431 D112H-N 117.194 8.244 A113H-N 122.83 7.876 V114H-N 111.472 7.342 N115H-N 117.18 7.742 N115HD21-ND2 115.064 7.019 N115HD22-ND2 115.064 7.906 Q116H-N 118.0 7.737 Q116HE21-NE2 111.838 6.817 Q116HE22-NE2 111.838 7.514 M117H-N 117.89 7.178 A118H-N 125.453 8.457 S119H-N 113.792 7.974 G120H-N 109.809 8.228