Assignment w1 w2 I4H-N 126.185 8.747 V5H-N 126.007 8.612 I6H-N 128.384 9.451 I7H-N 128.657 8.917 V8H-N 121.432 8.176 M17H-N 118.49 7.535 I20H-N 118.48 7.563 L21H-N 118.732 7.924 K22H-N 115.689 7.837 E23H-N 118.722 7.488 I24H-N 118.224 7.938 G25H-N 109.751 7.678 V26H-N 122.103 8.622 D27H-N 117.259 8.78 R28H-N 116.775 7.864 I29H-N 117.38 7.235 V30H-N 125.494 8.603 I31H-N 126.099 8.348 I32H-N 127.413 8.925 T33H-N 118.833 8.899 S34H-N 115.806 7.245 N35H-N 124.704 8.687 N35HD21-ND2 112.575 7.522 N35HD22-ND2 112.575 8.038 Q37H-N 118.431 8.096 Q37HE21-NE2 113.512 7.857 Q37HE22-NE2 113.512 6.918 L38H-N 123.193 7.493 A39H-N 121.376 8.147 E40H-N 117.38 7.978 R41H-N 121.85 8.006 A42H-N 120.166 8.7 K43H-N 119.439 7.704 E44H-N 121.11 7.787 L45H-N 118.591 7.62 G46H-N 103.455 7.509 V47H-N 120.622 7.666 D48H-N 124.967 8.452 R49H-N 119.056 7.678 I50H-N 122.83 7.509 F51H-N 126.705 9.288 L52H-N 127.189 8.523 L53H-N 126.24 8.374 T54H-N 108.541 8.586 D55H-N 121.861 7.238 D56H-N 125.057 8.746 E57H-N 120.014 8.327 L58H-N 118.978 7.88 I59H-N 118.512 7.816 A60H-N 120.189 8.347 E61H-N 116.048 7.773 I62H-N 121.74 8.01 V63H-N 119.318 7.977 K64H-N 118.712 7.843 K65H-N 121.376 8.435 L66H-N 117.017 8.203 G67H-N 106.361 7.84 A68H-N 118.591 6.758 D69H-N 117.017 8.863 I70H-N 118.228 7.394 V71H-N 125.933 9.039 F72H-N 126.725 9.511 S73H-N 118.245 7.926 E74H-N 125.514 8.634 N75H-N 125.756 9.304 N75HD21-ND2 112.92 7.245 N75HD22-ND2 112.92 7.815 R76H-N 120.008 8.084 D77H-N 119.681 8.017 I78H-N 119.923 8.299 A79H-N 120.65 7.699 K80H-N 114.474 7.996 K81H-N 117.986 7.634 I82H-N 117.623 8.162 I83H-N 118.228 8.03 R84H-N 117.38 7.399 K85H-N 117.138 7.438 L86H-N 121.134 8.303 K87H-N 119.318 8.134 N88H-N 115.443 8.756 N88HD21-ND2 113.372 6.906 N88HD22-ND2 113.372 7.685 I89H-N 119.318 7.269 I90H-N 124.888 7.855 I91H-N 126.51 8.816 L92H-N 126.012 9.298 S93H-N 110.72 8.266 N94H-N 122.365 8.139 N94HD21-ND2 111.225 7.933 N94HD22-ND2 111.225 7.213 D95H-N 121.561 8.131 E96H-N 126.341 8.953 Q97H-N 118.228 8.189 Q97HE21-NE2 112.678 6.913 Q97HE22-NE2 112.678 7.819 L98H-N 122.83 7.73 V99H-N 118.228 7.869 K100H-N 117.259 7.696 E101H-N 119.318 8.049 L102H-N 119.318 8.625 Q103H-N 117.017 8.167 Q103HE21-NE2 111.225 7.145 Q103HE22-NE2 111.225 6.701 K104H-N 116.654 7.369 E105H-N 116.896 7.521 A106H-N 122.83 7.971 D108H-N 119.197 8.54 A109H-N 122.103 7.75 R110H-N 121.611 8.435 V111H-N 120.232 7.308 F112H-N 123.092 8.924 N113H-N 120.428 8.938 N113HD21-ND2 107.35 7.255 N113HD22-ND2 107.35 6.575 V114H-N 122.607 8.545 Q115H-N 120.642 9.249 Q115HE21-NE2 114.615 8.191 Q115HE22-NE2 114.615 7.069 T116H-N 108.541 8.066 Q118H-N 119.027 8.287 Q118HE21-NE2 113.404 7.777 Q118HE22-NE2 113.404 6.946 D119H-N 118.732 7.97 F120H-N 119.701 7.865 K121H-N 118.543 8.155 D122H-N 118.349 8.661 L123H-N 120.429 7.804 I124H-N 117.929 7.964 E125H-N 119.201 7.799 K126H-N 118.712 8.287 I127H-N 123.919 7.835 L128H-N 120.408 7.979 H133H-N 116.533 7.705 H134H-N 119.802 8.204 H135H-N 125.736 7.954