Assignment w1 w2 K3H-N 124.03 8.418 L4H-N 124.982 8.353 V5H-N 122.438 8.249 T6H-N 118.316 8.2 A7H-N 126.596 8.362 T8H-N 113.489 8.177 T9H-N 116.586 8.104 L10H-N 124.691 8.295 T11H-N 114.776 8.061 A12H-N 126.296 8.244 G13H-N 108.132 8.315 I14H-N 119.749 7.987 G15H-N 112.858 8.5 A16H-N 123.787 8.037 A17H-N 123.105 8.195 I18H-N 120.416 8.079 V19H-N 125.274 8.253 G20H-N 112.489 8.444 L21H-N 121.614 8.079 D22H-N 120.648 8.362 H23H-N 119.324 8.322 G24H-N 109.81 8.528 N25H-N 118.866 8.424 N25HD21-ND2 113.0 7.621 N25HD22-ND2 113.0 6.907 E26H-N 121.657 8.555 A27H-N 124.26 8.296 D28H-N 119.445 8.195 A29H-N 124.496 8.108 A30H-N 122.764 8.212 E31H-N 119.559 8.246 Q32H-N 121.08 8.335 Q32HE21-NE2 112.58 7.529 Q32HE22-NE2 112.58 6.852 T33H-N 115.718 8.181 Q34H-N 123.774 8.39 Q34HE21-NE2 112.6 7.529 Q34HE22-NE2 112.6 6.852 T36H-N 114.167 8.29 N37H-N 120.714 8.452 N37HD21-ND2 112.881 7.599 N37HD22-ND2 112.881 6.903 Q38H-N 120.788 8.392 Q38HE21-NE2 112.4 7.497 Q38HE22-NE2 112.4 6.835 S39H-N 117.329 8.427 T40H-N 115.597 8.24 T41H-N 116.235 8.148 Q42H-N 122.879 8.385 S43H-N 117.005 8.415 S45H-N 117.787 8.34 G46H-N 111.122 8.442 S47H-N 115.906 8.295 S48H-N 118.039 8.458 A49H-N 125.773 8.191 N50H-N 117.931 8.197 N50HD21-ND2 109.703 7.004 N50HD22-ND2 109.703 6.161 L51H-N 125.584 7.382 Y52H-N 120.9 7.811 T53H-N 118.082 8.233 A54H-N 129.467 8.187 G55H-N 109.331 5.12 Q56H-N 115.618 7.204 Q56HE21-NE2 113.412 7.684 Q56HE22-NE2 113.412 6.82 C57H-N 118.148 9.318 T58H-N 113.715 7.306 W59H-N 123.659 6.666 W59HE1-NE1 133.403 10.695 Y60H-N 115.787 7.715 V61H-N 116.886 7.46 Y62H-N 118.373 8.346 D63H-N 115.987 6.964 K64H-N 122.132 7.918 V65H-N 108.114 7.564 G66H-N 111.238 7.689 G67H-N 104.793 7.964 N68H-N 117.11 6.896 N68HD21-ND2 114.181 7.491 N68HD22-ND2 114.181 6.939 I69H-N 110.019 6.91 S71H-N 115.442 8.433 T72H-N 107.423 7.059 W73H-N 121.213 7.653 W73HE1-NE1 126.284 10.031 G74H-N 107.434 8.597 N75H-N 118.883 8.76 N75HD21-ND2 114.217 7.915 N75HD22-ND2 114.217 7.24 A76H-N 121.815 8.57 N77H-N 114.689 8.494 N77HD21-ND2 110.078 7.652 N77HD22-ND2 110.078 6.742 N78H-N 120.238 8.751 N78HD21-ND2 116.038 7.878 N78HD22-ND2 116.038 6.996 W79H-N 118.343 8.138 W79HE1-NE1 128.225 9.693 A80H-N 118.322 7.166 S81H-N 115.109 8.152 A82H-N 124.385 8.192 A83H-N 119.536 7.79 S84H-N 114.864 8.014 S85H-N 118.24 8.021 A86H-N 121.848 7.534 G87H-N 105.468 7.742 Y88H-N 120.593 8.333 T89H-N 121.053 9.388 V90H-N 130.103 8.514 N91H-N 124.668 8.962 N91HD21-ND2 115.672 7.953 N91HD22-ND2 115.672 7.35 N92H-N 115.387 8.351 N92HD21-ND2 110.701 7.734 N92HD22-ND2 110.701 6.745 S93H-N 117.1 8.28 E95H-N 114.99 5.928 A96H-N 131.626 9.472 G97H-N 112.401 9.116 S98H-N 112.234 7.408 I99H-N 117.047 8.217 L100H-N 130.449 8.471 Q101H-N 129.015 9.584 Q101HE21-NE2 104.8 7.775 Q101HE22-NE2 104.8 5.652 S102H-N 118.115 8.722 T103H-N 115.652 8.519 A104H-N 126.045 8.079 G105H-N 107.838 8.432 G106H-N 108.504 8.56 Y107H-N 117.603 8.396 G108H-N 106.335 7.352 H109H-N 117.77 8.36 V110H-N 117.03 5.985 A111H-N 120.886 8.878 Y112H-N 121.693 9.271 V113H-N 126.36 8.104 E114H-N 130.196 8.924 N115H-N 111.944 7.789 N115HD21-ND2 114.463 7.396 N115HD22-ND2 114.463 6.705 V116H-N 122.567 8.176 N117H-N 124.919 8.973 N117HD21-ND2 114.4 7.606 N117HD22-ND2 114.4 7.489 D119H-N 118.439 7.867 G120H-N 108.732 8.091 S121H-N 114.785 8.11 V122H-N 119.54 8.898 E123H-N 126.136 8.729 V124H-N 115.992 9.126 S125H-N 115.572 9.483 E126H-N 117.836 8.832 M127H-N 118.8 8.517 N128H-N 117.3 8.219 N128HD21-ND2 108.615 7.566 N128HD22-ND2 108.615 6.773 Y129H-N 120.069 8.929 N130H-N 117.814 8.164 N130HD21-ND2 112.015 7.427 N130HD22-ND2 112.015 6.782 G131H-N 108.036 7.975 G132H-N 108.402 8.296 F134H-N 113.472 8.353 S135H-N 115.622 7.908 V136H-N 130.031 8.854 S137H-N 122.964 9.291 E138H-N 118.341 8.202 R139H-N 121.754 8.249 R139HE-NE 86.72 9.369 T140H-N 120.169 8.555 I141H-N 131.43 9.877 S142H-N 122.851 8.895 A143H-N 123.756 8.849 G144H-N 103.703 8.568 E145H-N 121.187 7.588 A146H-N 122.787 8.687 S147H-N 110.57 7.929 S148H-N 116.18 7.916 Y149H-N 120.574 6.975 N150H-N 114.312 7.944 N150HD21-ND2 114.91 7.896 N150HD22-ND2 114.91 7.098 Y151H-N 117.445 9.457 I152H-N 123.218 9.4 H153H-N 125.97 8.763 L154H-N 124.533 9.151 N155H-N 118.812 8.588 N155HD21-ND2 112.89 7.577 N155HD22-ND2 112.89 6.85 L156H-N 122.858 8.3 E157H-N 120.669 8.431 H158H-N 118.952 8.177