Assignment w1 w2 G3H-N 110.526 8.513 L4H-N 122.423 8.145 T6H-N 111.916 8.447 T7H-N 110.288 7.303 L8H-N 122.441 9.065 G9H-N 104.356 8.753 K10H-N 120.741 7.341 L11H-N 121.501 8.033 D12H-N 119.776 9.025 E13H-N 116.304 7.253 R14H-N 118.267 7.234 R14HH21-NH2 71.802 6.742 R14HE-NE 83.805 7.417 L15H-N 117.856 8.734 R16H-N 115.954 8.28 R16HH11-NH1 71.535 6.587 R16HH21-NH2 70.2 6.229 R16HE-NE 91.207 9.533 N17H-N 118.514 7.433 N17HD21-ND2 112.729 7.466 N17HD22-ND2 112.729 7.056 Y18H-N 121.714 8.945 L19H-N 119.284 8.293 K20H-N 117.005 7.322 K21H-N 115.946 7.435 G22H-N 105.432 8.29 T23H-N 107.608 7.148 K24H-N 118.924 8.414 N25H-N 116.576 7.823 N25HD21-ND2 110.263 7.535 N25HD22-ND2 110.263 6.831 S26H-N 118.968 8.557 A27H-N 125.334 8.133 Q28H-N 112.472 7.113 Q28HE21-NE2 112.434 7.163 Q28HE22-NE2 112.434 6.748 F29H-N 118.258 7.361 E30H-N 125.247 9.228 K31H-N 113.709 7.998 M32H-N 118.635 9.051 V33H-N 122.441 9.186 I34H-N 127.876 9.244 L35H-N 125.572 9.117 T36H-N 112.84 8.634 E37H-N 118.675 8.58 N38H-N 114.341 8.58 N38HD21-ND2 116.07 7.84 N38HD22-ND2 116.07 7.15 K39H-N 107.932 7.891 G40H-N 107.011 6.998 Y41H-N 129.822 7.679 Y42H-N 126.527 9.101 T43H-N 120.81 9.022 V44H-N 129.156 9.233 Y45H-N 128.465 9.384 L46H-N 119.547 8.524 N47H-N 116.407 8.599 N47HD21-ND2 111.798 7.747 N47HD22-ND2 111.798 6.986 T48H-N 111.551 7.429 L50H-N 126.341 9.049 A51H-N 129.745 8.415 E52H-N 121.424 8.739 D53H-N 114.043 8.511 R54H-N 118.147 7.8 R54HH21-NH2 69.95 6.681 R54HE-NE 85.075 7.162 K55H-N 116.576 7.335 N56H-N 114.341 8.347 N56HD21-ND2 112.835 7.587 N56HD22-ND2 112.835 6.911 V57H-N 121.424 6.985 E58H-N 129.489 8.777 L59H-N 124.395 8.23 L60H-N 119.734 7.777 G61H-N 103.707 7.224 K62H-N 118.635 8.771 M63H-N 123.413 9.188 Y64H-N 129.403 9.421 K65H-N 118.804 7.289 T66H-N 116.235 8.727 Y67H-N 125.256 8.969 F68H-N 118.574 9.189 F69H-N 119.573 8.976 K70H-N 125.614 9.479 K71H-N 121.057 8.068 G72H-N 114.112 8.899 E73H-N 119.538 8.047 S74H-N 115.383 8.742 K75H-N 121.04 7.608 S76H-N 121.783 8.231 S77H-N 106.276 8.333 Y78H-N 126.289 7.825 V79H-N 127.825 7.76 I80H-N 124.001 8.616 N81H-N 126.229 8.937 N81HD21-ND2 111.755 7.573 N81HD22-ND2 111.755 7.042 G82H-N 110.894 7.984 G84H-N 109.324 8.939 K85H-N 119.24 9.55 T86H-N 113.403 7.327 N87H-N 118.907 8.035 N87HD21-ND2 112.788 8.267 N87HD22-ND2 112.788 6.852 E88H-N 119.547 8.362 Y89H-N 118.293 7.918 A90H-N 126.212 8.285 Y91H-N 124.421 7.556