Assignment w1 w2 N3H-N 120.402 8.476 N3HD21-ND2 112.413 7.487 N3HD22-ND2 112.413 7.094 S4H-N 114.093 7.796 I5H-N 124.495 8.948 Y6H-N 127.314 8.571 V7H-N 128.184 8.794 G8H-N 116.801 6.915 D9H-N 123.72 8.672 K10H-N 117.938 7.919 G11H-N 106.705 8.266 V12H-N 120.64 8.547 M13H-N 114.433 8.835 N14H-N 119.642 7.659 N14HD21-ND2 112.464 7.016 N14HD22-ND2 112.464 6.719 Y15H-N 117.697 7.168 V16H-N 121.122 8.336 T17H-N 114.382 8.214 A18H-N 125.456 7.623 V19H-N 119.064 8.126 M20H-N 116.746 8.078 T21H-N 115.472 8.323 L22H-N 123.22 7.473 F23H-N 114.321 8.059 D24H-N 118.601 7.527 K25H-N 122.369 7.902 D27H-N 113.372 8.537 I28H-N 120.357 7.228 N29H-N 123.665 8.859 N29HD21-ND2 113.201 7.532 N29HD22-ND2 113.201 6.889 E30H-N 117.607 7.859 V31H-N 120.072 9.013 I32H-N 124.769 8.38 L33H-N 126.446 9.229 K34H-N 123.021 8.617 A35H-N 121.173 8.338 R36H-N 116.785 8.451 R36HE-NE 84.69 7.669 G37H-N 110.681 9.327 K38H-N 124.119 8.948 S39H-N 114.889 7.955 I40H-N 123.273 8.432 V41H-N 113.835 6.739 K42H-N 118.846 6.35 A43H-N 119.677 7.832 V44H-N 117.353 7.493 D45H-N 120.202 8.725 V46H-N 118.746 8.453 E47H-N 120.343 7.913 E48H-N 119.146 8.928 V49H-N 122.191 8.228 L50H-N 120.252 8.118 K51H-N 116.809 8.261 N52H-N 110.897 8.33 N52HD21-ND2 114.149 7.431 N52HD22-ND2 114.149 6.678 R53H-N 116.705 7.98 R53HE-NE 84.18 7.262 V54H-N 117.326 7.731 M55H-N 122.547 9.166 K56H-N 119.628 8.186 S57H-N 112.347 7.864 V58H-N 118.379 7.799 N59H-N 120.982 8.614 N59HD21-ND2 112.012 7.233 N59HD22-ND2 112.012 6.859 I60H-N 125.221 8.807 K61H-N 129.417 8.464 N62H-N 112.687 7.483 N62HD21-ND2 113.315 7.58 N62HD22-ND2 113.315 6.891 I63H-N 123.545 8.102 A64H-N 128.335 8.84 L65H-N 124.721 8.871 G66H-N 111.128 8.014 T67H-N 113.139 7.697 E68H-N 128.501 9.648 I69H-N 123.036 8.303 L70H-N 129.606 9.013 K71H-N 121.432 8.324 S72H-N 119.806 8.863 T74H-N 108.535 7.875 G75H-N 110.141 7.976 K76H-N 120.301 7.452 E77H-N 123.652 8.57 I78H-N 122.975 8.819 N79H-N 122.583 8.38 N79HD21-ND2 111.07 7.118 N79HD22-ND2 111.07 6.748 V80H-N 122.039 9.09 S81H-N 123.778 9.204 T82H-N 113.26 8.83 I83H-N 116.691 8.507 E84H-N 124.107 8.272 I85H-N 127.725 9.636 T86H-N 125.065 9.22 I87H-N 127.322 9.431 S88H-N 119.43 9.315 K89H-N 122.848 8.152 E90H-N 121.427 8.247 L91H-N 124.652 8.352 E92H-N 121.396 8.305 H93H-N 119.934 8.348 H98H-N 125.289 8.142