Assignment w1 w2 G2H-N 109.342 8.632 V3H-N 123.457 7.516 V4H-N 125.375 8.81 I5H-N 127.18 8.8 L6H-N 129.025 9.424 V7H-N 123.364 8.653 L8H-N 130.56 9.069 T9H-N 112.81 8.028 G10H-N 107.74 7.827 D11H-N 119.119 7.642 R13H-N 121.589 8.593 I14H-N 119.911 7.823 A15H-N 121.015 7.61 E16H-N 117.655 7.808 E17H-N 119.648 8.002 L18H-N 119.118 8.554 R19H-N 122.158 8.274 K20H-N 118.13 7.977 E21H-N 120.451 7.813 V22H-N 119.654 8.146 Q23H-N 116.884 7.588 Q23HE21-NE2 111.133 6.851 Q23HE22-NE2 111.133 7.498 K24H-N 116.529 7.544 H25H-N 119.657 7.809 D26H-N 113.221 8.358 N28H-N 115.529 8.57 N28HD21-ND2 115.755 8.078 N28HD22-ND2 115.755 7.099 V29H-N 121.867 7.465 K30H-N 130.242 9.036 T31H-N 113.173 8.185 V32H-N 122.168 8.968 T34H-N 114.266 9.033 D36H-N 120.993 7.726 E38H-N 119.141 8.883 K39H-N 118.44 8.064 V40H-N 118.13 7.308 K41H-N 118.555 8.15 E42H-N 119.454 8.067 E43H-N 118.427 8.189 I44H-N 122.905 8.734 E45H-N 120.098 8.099 K46H-N 118.36 7.854 A47H-N 122.551 8.135 R48H-N 118.945 8.655 K49H-N 119.557 8.058 Q50H-N 115.215 7.938 Q50HE21-NE2 110.93 7.483 Q50HE22-NE2 110.93 6.891 G51H-N 109.413 8.07 R52H-N 119.414 7.95 I54H-N 115.161 7.718 V55H-N 126.019 8.352 V56H-N 127.584 9.291 F57H-N 125.432 8.585 V58H-N 123.763 9.008 R59H-N 127.924 8.82 G60H-N 110.441 8.2 G61H-N 109.411 7.995 D62H-N 122.92 8.09 D63H-N 121.058 8.023 E64H-N 119.564 8.76 R65H-N 119.839 7.643 A66H-N 118.984 7.782 K67H-N 117.711 8.01 D68H-N 119.581 7.999 I69H-N 119.307 8.283 A70H-N 121.395 8.2 E71H-N 116.21 8.402 Y72H-N 121.372 8.031 A73H-N 119.994 8.588 Q74H-N 116.775 8.382 Q74HE21-NE2 111.704 7.558 Q74HE22-NE2 111.704 6.947 K75H-N 122.969 8.248 E76H-N 117.058 7.522 G77H-N 106.537 7.797 L78H-N 121.257 8.008 R79H-N 121.135 8.062 V80H-N 123.517 8.377 I81H-N 129.083 8.812 V82H-N 126.531 9.085 I83H-N 127.143 9.391 I84H-N 126.75 8.714 V85H-N 127.16 8.464 S86H-N 121.723 8.725 Q87H-N 121.657 8.516 Q87HE21-NE2 111.954 7.63 Q87HE22-NE2 111.954 6.954 D88H-N 121.146 8.459 E89H-N 125.736 8.84 E90H-N 119.813 8.3 A91H-N 123.211 7.67 L92H-N 118.903 8.19 R93H-N 118.916 7.868 K94H-N 118.989 8.236 G95H-N 107.084 8.296 Y96H-N 121.591 8.372 E97H-N 117.883 8.205 D98H-N 117.644 8.139 K99H-N 116.691 7.886 K100H-N 120.645 8.395 K101H-N 119.297 7.713 K102H-N 116.847 7.124 G103H-N 105.781 7.771 Y104H-N 119.257 6.914 D105H-N 122.574 8.223 V106H-N 121.99 7.876 Y107H-N 125.444 9.4 T108H-N 111.1 8.801 S109H-N 114.65 8.565 R110H-N 119.807 8.948 N111H-N 110.69 7.426 N111HD21-ND2 114.278 7.606 N111HD22-ND2 114.278 7.005 E112H-N 119.451 9.529 D113H-N 120.739 8.256 E114H-N 119.817 8.577 A115H-N 121.47 8.358 K116H-N 117.285 8.35 K117H-N 118.433 7.345 K118H-N 118.166 8.13 L119H-N 120.654 8.592 K120H-N 118.314 7.753 E121H-N 118.446 7.777 A122H-N 121.333 8.229 L123H-N 118.79 8.177 E124H-N 120.881 8.393 K125H-N 119.526 8.29 S126H-N 114.103 7.702 G127H-N 108.584 7.933 S128H-N 115.99 8.091 L129H-N 125.492 8.262 E130H-N 121.006 8.398 H132H-N 125.794 7.935