Assignment w1 w2 I2H-N 121.345 8.983 K3H-N 119.692 8.422 Q4H-N 117.063 7.824 Q4HE21-NE2 112.816 7.296 Q4HE22-NE2 112.816 6.745 Y5H-N 119.74 7.274 S6H-N 118.94 9.328 Q7H-N 121.362 9.045 Q7HE21-NE2 111.666 7.372 Q7HE22-NE2 111.666 6.963 E8H-N 117.075 8.559 E9H-N 119.186 7.669 L10H-N 120.13 8.176 K11H-N 115.085 7.643 E12H-N 115.043 7.073 M13H-N 120.384 7.293 A14H-N 124.835 8.642 L15H-N 123.065 8.485 V16H-N 113.897 8.885 E17H-N 119.792 7.083 I18H-N 120.036 7.529 A19H-N 119.118 8.602 H20H-N 115.835 8.498 E21H-N 116.408 7.819 L22H-N 121.681 8.526 F23H-N 119.068 8.718 E24H-N 118.35 8.143 E25H-N 117.485 7.686 H26H-N 116.341 8.55 K27H-N 113.278 8.893 K28H-N 117.529 7.46 V30H-N 117.42 8.976 F32H-N 124.807 9.7 Q33H-N 114.052 9.317 Q33HE21-NE2 112.485 7.724 Q33HE22-NE2 112.485 6.928 E34H-N 117.748 6.979 L35H-N 122.675 7.911 L36H-N 116.639 7.992 N37H-N 116.921 7.778 N37HD22-ND2 112.275 7.293 E38H-N 121.572 8.147 I39H-N 120.657 8.295 A40H-N 120.951 8.514 S41H-N 111.172 7.785 L42H-N 123.266 7.928 L43H-N 116.405 7.88 G44H-N 108.122 7.906 V45H-N 112.12 7.763 K46H-N 120.084 8.438 K47H-N 123.193 9.035 E48H-N 116.806 9.379 E49H-N 118.471 7.905 L50H-N 118.314 7.673 G51H-N 105.811 7.588 D52H-N 124.458 8.993 R53H-N 117.684 8.22 R53HE-NE 83.996 7.244 I54H-N 119.706 7.649 A55H-N 122.791 8.092 Q56H-N 117.5 7.834 Q56HE21-NE2 115.571 8.026 Q56HE22-NE2 115.571 6.86 F57H-N 120.296 7.974 Y58H-N 118.266 8.36 T59H-N 116.582 7.896 D60H-N 122.777 8.715 L61H-N 120.072 8.076 N62H-N 112.417 7.018 N62HD21-ND2 112.678 7.091 N62HD22-ND2 112.678 5.373 I63H-N 113.809 7.743 D64H-N 124.195 8.02 G65H-N 110.323 8.783 R66H-N 118.022 9.066 F67H-N 119.054 8.232 L68H-N 122.527 8.712 A69H-N 128.807 8.113 L70H-N 125.523 8.18 S71H-N 114.85 8.268 D72H-N 119.733 8.125 Q73H-N 110.862 8.166 Q73HE21-NE2 112.832 7.506 Q73HE22-NE2 112.832 6.789 T74H-N 110.291 7.224 W75H-N 121.65 8.588 W75HE1-NE1 126.499 9.885 G76H-N 104.321 8.558 L77H-N 115.96 4.067 R78H-N 122.556 8.112 R78HE-NE 83.672 7.098 S79H-N 111.914 8.165 W80H-N 120.941 7.214 W80HE1-NE1 129.723 10.458 Y81H-N 117.67 7.613 Y83H-N 120.399 8.269 D84H-N 121.02 8.242 Q85H-N 119.88 8.102 Q85HE21-NE2 112.56 7.561 Q85HE22-NE2 112.56 6.761 L86H-N 122.941 8.22 D87H-N 121.223 8.27 E88H-N 121.262 8.392 E89H-N 120.588 8.439 T90H-N 114.166 8.044 Q91H-N 121.628 8.234 Q91HE21-NE2 112.435 7.463 Q91HE22-NE2 112.435 6.796 L92H-N 121.99 8.065 E93H-N 120.008 8.206 H94H-N 118.737 8.189 H95H-N 125.289 8.115 H96H-N 114.149 8.787