Assignment w1 w2 N6H-N 120.187 8.501 N6HD21-ND2 112.383 6.892 N6HD22-ND2 112.383 7.713 R7H-N 119.966 8.102 Y8H-N 117.9 7.76 S9H-N 115.048 7.973 K10H-N 116.855 8.28 E11H-N 120.429 8.133 M16H-N 117.941 7.918 M17H-N 116.118 7.91 K18H-N 118.176 7.72 D19H-N 119.192 8.054 L20H-N 120.807 7.855 E21H-N 121.31 8.226 G22H-N 106.974 8.38 L23H-N 120.269 7.696 H24H-N 117.102 8.078 R25H-N 119.905 8.212 A26H-N 122.659 8.074 E27H-N 117.904 8.225 Q28H-N 118.156 8.095 Q28HE21-NE2 111.317 7.413 Q28HE22-NE2 111.317 6.785 S29H-N 115.95 8.207 L30H-N 122.04 8.309 H31H-N 117.163 8.159 D32H-N 120.695 8.353 L33H-N 121.77 8.165 Q34H-N 118.293 8.374 E35H-N 118.598 7.949 R36H-N 120.088 8.021 K39H-N 118.785 7.567 A40H-N 121.697 7.976 Q41H-N 117.07 8.176 E42H-N 119.335 7.991 E43H-N 116.976 7.939 H44H-N 116.728 7.957 R45H-N 119.854 8.178 T46H-N 113.874 8.061 V47H-N 121.087 7.992 E48H-N 124.355 8.29 V49H-N 120.618 7.952 E50H-N 122.992 8.507 K51H-N 121.08 8.16 E55H-N 117.004 8.287 K57H-N 117.955 8.17 R59H-N 119.417 8.135 I62H-N 119.729 8.338 N63H-N 118.351 8.086 L64H-N 121.342 7.867 A65H-N 122.273 8.316 K66H-N 116.685 8.408 Q67H-N 118.055 7.875 Q67HE21-NE2 111.589 7.485 Q67HE22-NE2 111.589 6.793 E68H-N 120.005 8.286 A69H-N 122.011 8.51 Q70H-N 116.129 7.981 R71H-N 120.051 7.842 L72H-N 119.299 8.163 K73H-N 118.827 8.096 E74H-N 118.307 8.129 R76H-N 117.974 7.844 E77H-N 119.855 7.978 G78H-N 108.804 8.262 T79H-N 112.686 7.896 E80H-N 122.242 8.527 N81H-N 118.726 8.289 N81HD21-ND2 112.932 7.556 N81HD22-ND2 112.932 6.899 E82H-N 121.136 8.341 R83H-N 121.643 8.269 S84H-N 116.918 8.271 R85H-N 122.12 8.212 Q86H-N 120.425 8.189 K87H-N 120.857 8.024 Y88H-N 119.748 7.912 A89H-N 123.401 8.396 E90H-N 119.912 8.495 E91H-N 118.786 7.725 L93H-N 120.31 8.414 V96H-N 120.562 7.858 R97H-N 118.975 8.33 E98H-N 117.754 8.13 A99H-N 122.919 7.935 L100H-N 118.01 8.278 R101H-N 118.672 8.198 A103H-N 122.134 8.18 E104H-N 117.783 8.469 E106H-N 117.841 8.381 E108H-N 118.513 8.218 S109H-N 112.816 7.825 H110H-N 119.134 7.856 S111H-N 115.153 7.96 W113H-N 121.475 7.869 W113HE1-NE1 128.588 9.973 Y114H-N 118.269 7.419 A115H-N 130.113 7.493