Assignment w1 w2 S2H-N 115.657 8.741 H3H-N 120.853 8.789 M4H-N 121.827 8.53 S5H-N 116.42 8.388 D6H-N 122.076 8.235 N7H-N 119.61 8.25 N7HD21-ND2 110.891 7.399 N7HD22-ND2 110.891 6.998 N8H-N 119.188 8.363 N8HD21-ND2 114.335 7.653 N8HD22-ND2 114.335 7.279 T9H-N 118.725 8.478 I10H-N 118.953 8.891 F11H-N 123.73 9.572 V12H-N 128.193 9.08 Q13H-N 122.557 8.846 Q13HE21-NE2 113.695 7.956 Q13HE22-NE2 113.695 7.04 G14H-N 109.248 8.343 L15H-N 116.86 8.261 G16H-N 105.038 8.038 E17H-N 117.386 8.366 G18H-N 109.145 8.719 V19H-N 119.79 7.012 S20H-N 118.758 7.729 T21H-N 116.533 9.191 D22H-N 120.392 8.407 Q23H-N 118.673 7.725 Q23HE21-NE2 109.595 7.305 Q23HE22-NE2 109.595 6.613 V24H-N 120.609 7.888 G25H-N 107.321 8.705 E26H-N 119.752 8.218 F27H-N 118.576 7.593 F28H-N 112.399 7.999 K29H-N 119.345 8.142 Q30H-N 115.545 7.479 Q30HE21-NE2 111.959 7.554 Q30HE22-NE2 111.959 6.744 I31H-N 116.07 7.777 G32H-N 107.158 7.351 I33H-N 117.513 8.109 I34H-N 132.012 8.774 K35H-N 130.921 8.727 T36H-N 119.728 8.599 N37H-N 124.903 8.735 N37HD21-ND2 111.836 7.009 N37HD22-ND2 111.836 6.678 K38H-N 128.294 9.043 K39H-N 117.437 8.338 T40H-N 105.715 7.499 G41H-N 111.342 8.653 K42H-N 119.893 7.694 M44H-N 125.553 9.04 I45H-N 125.385 7.644 N46H-N 125.747 8.692 N46HD21-ND2 111.815 7.054 N46HD22-ND2 111.815 6.726 L47H-N 124.072 8.615 Y48H-N 122.831 8.035 T49H-N 116.036 8.935 D50H-N 123.945 8.754 K51H-N 128.08 8.993 D52H-N 118.152 8.586 T53H-N 108.243 8.397 G54H-N 111.037 8.38 K55H-N 120.702 7.886 K57H-N 120.38 8.37 G58H-N 109.085 8.729 E59H-N 115.835 7.162 A60H-N 122.523 8.958 T61H-N 108.607 8.642 V62H-N 120.142 8.043 S63H-N 121.543 7.785 F64H-N 122.569 8.976 D65H-N 120.388 8.448 D66H-N 117.395 8.583 S69H-N 114.612 8.116 A70H-N 122.442 7.513 K71H-N 116.223 7.13 A72H-N 119.877 7.854 A73H-N 120.203 8.114 I74H-N 119.625 7.528 D75H-N 118.239 8.087 W76H-N 117.05 8.586 W76HE1-NE1 128.101 9.863 F77H-N 112.215 8.358 D78H-N 118.386 8.081 G79H-N 115.738 8.843 K80H-N 119.722 7.902 E81H-N 116.65 8.058 F82H-N 125.017 9.412 H83H-N 125.633 9.222 G84H-N 103.092 8.578 N85H-N 119.384 7.812 N85HD21-ND2 113.193 7.981 N85HD22-ND2 113.193 7.286 I86H-N 123.379 8.675 I87H-N 122.166 8.481 K88H-N 121.695 8.351 V89H-N 125.972 9.548 S90H-N 119.623 8.931 F91H-N 119.951 8.933 A92H-N 124.43 8.563 T93H-N 115.093 8.333 R94H-N 123.29 8.177 R95H-N 124.572 8.524 E97H-N 126.318 8.02