Assignment w1 w2 R5H-N 123.607 9.161 L6H-N 122.412 8.775 W8H-N 114.197 7.595 W8HE1-NE1 128.89 10.052 Y10H-N 120.786 7.929 V11H-N 114.828 8.291 Y12H-N 119.177 7.712 Q13H-N 118.873 8.076 Q13HE21-NE2 111.901 7.432 Q13HE22-NE2 111.901 6.701 L14H-N 121.381 7.772 L15H-N 116.801 7.546 S16H-N 112.511 7.277 D17H-N 122.234 7.353 S18H-N 120.139 8.691 R19H-N 122.716 8.586 R19HE-NE 84.437 7.59 Y20H-N 116.201 8.291 E21H-N 120.803 7.513 N22H-N 114.531 8.649 N22HD21-ND2 112.348 7.234 N22HD22-ND2 112.348 6.418 F23H-N 115.501 8.555 I24H-N 120.734 8.428 R25H-N 121.187 8.671 R25HE-NE 84.916 7.245 W26H-N 122.024 9.159 W26HE1-NE1 130.421 10.019 E27H-N 125.331 9.504 D28H-N 116.213 7.846 K29H-N 127.762 9.216 E30H-N 119.601 8.34 S31H-N 113.301 7.463 K32H-N 115.17 7.752 I33H-N 118.274 8.262 F34H-N 128.285 9.936 R35H-N 120.953 9.43 R35HE-NE 83.906 7.893 I36H-N 125.455 8.639 V37H-N 129.251 7.839 D38H-N 114.991 7.279 N40H-N 115.439 8.121 N40HD21-ND2 112.0 7.583 N40HD22-ND2 112.0 6.909 G41H-N 111.317 8.622 L42H-N 122.892 8.881 A43H-N 120.112 8.072 R44H-N 117.916 7.769 L45H-N 121.489 7.903 W46H-N 121.466 8.633 W46HE1-NE1 129.127 10.48 G47H-N 105.142 8.828 N48H-N 120.327 8.212 N48HD21-ND2 111.187 7.572 N48HD22-ND2 111.187 6.864 H49H-N 121.871 8.094 K50H-N 115.181 7.482 N51H-N 116.362 7.753 N51HD21-ND2 111.904 7.363 N51HD22-ND2 111.904 6.702 R52H-N 117.723 8.476 T53H-N 114.109 8.333 N54H-N 118.768 8.521 N54HD21-ND2 112.487 7.568 N54HD22-ND2 112.487 6.891 M55H-N 119.621 8.162 T56H-N 113.114 7.031 Y57H-N 123.401 9.691 E58H-N 120.999 8.838 K59H-N 118.962 7.506 M60H-N 120.087 8.051 S61H-N 114.537 8.853 R62H-N 122.214 7.471 A63H-N 121.091 7.376 L64H-N 117.568 7.853 R65H-N 116.111 7.521 H66H-N 118.081 7.241 Y67H-N 116.301 7.532 Y68H-N 121.389 8.061 K69H-N 121.098 7.799 L70H-N 116.117 7.257 N71H-N 115.181 8.061 N71HD21-ND2 111.601 7.362 N71HD22-ND2 111.601 6.711 I72H-N 114.031 8.104 I73H-N 116.973 7.099 R74H-N 123.639 8.983 K75H-N 125.665 8.263 E76H-N 128.072 8.024 G78H-N 109.716 8.531 Q79H-N 116.964 7.559 Q79HE21-NE2 112.646 7.487 Q79HE22-NE2 112.646 6.802 R80H-N 120.457 8.251 R80HE-NE 83.914 7.985 L81H-N 119.348 8.435 L82H-N 119.07 6.751 F83H-N 122.184 8.661 R84H-N 119.461 9.098 R84HE-NE 85.242 7.607 F85H-N 124.274 8.928 M86H-N 121.081 8.676 K87H-N 117.772 7.624 T88H-N 112.426 8.787 D90H-N 114.221 7.958 E91H-N 119.443 7.628 I92H-N 120.617 7.896 M93H-N 117.857 8.161 S94H-N 114.591 7.744 G95H-N 109.59 7.97 R96H-N 119.792 8.144 T97H-N 114.77 8.427 D98H-N 122.017 8.659 R99H-N 120.083 8.011 L100H-N 119.784 7.667 E101H-N 119.434 8.339 H102H-N 118.026 7.995 L103H-N 120.785 8.077 E104H-N 119.107 8.443 S105H-N 114.129 8.041 Q106H-N 120.201 7.823 Q106HE21-NE2 111.502 7.339 Q106HE22-NE2 111.502 6.749 V107H-N 117.503 7.711 D109H-N 118.5 7.872 E110H-N 120.701 7.929 Q111H-N 120.829 8.434 Q111HE21-NE2 112.5 7.493 Q111HE22-NE2 112.5 6.806 T112H-N 114.861 8.038 Y113H-N 122.709 8.171 Q114H-N 122.768 8.202 Q114HE21-NE2 112.3 7.432 Q114HE22-NE2 112.3 6.703 E115H-N 122.37 8.371 D116H-N 121.09 8.336 E117H-N 121.977 8.194 T119H-N 114.788 8.235 I120H-N 123.074 8.043 A121H-N 128.011 8.277 S122H-N 116.575 8.161 V124H-N 119.733 8.058 G125H-N 111.901 8.255 W126H-N 122.405 7.906 W126HE1-NE1 129.148 10.096 R128H-N 126.601 7.901