Assignment w1 w2 A2H-N 123.423 7.983 M3H-N 119.39 8.57 G4H-N 110.13 8.37 M5H-N 121.57 8.21 K7H-N 123.443 9.675 V8H-N 125.859 8.851 L9H-N 127.114 7.881 V10H-N 128.024 8.952 L11H-N 128.979 8.433 E12H-N 128.158 8.532 D13H-N 123.077 8.803 E14H-N 126.685 10.077 L16H-N 118.358 8.851 I17H-N 117.68 6.886 A18H-N 122.321 7.988 M19H-N 115.807 8.204 N20H-N 117.843 7.839 N20HD21-ND2 110.903 7.531 N20HD22-ND2 110.903 6.837 L21H-N 121.749 8.601 Q22H-N 120.991 8.749 Q22HE21-NE2 109.522 6.44 Q22HE22-NE2 109.522 7.752 Y23H-N 117.446 8.45 A24H-N 121.627 7.765 F25H-N 115.589 8.348 E26H-N 121.198 8.822 D27H-N 121.846 8.424 E28H-N 115.759 7.17 G29H-N 106.899 7.889 A30H-N 121.007 7.743 E31H-N 120.065 8.595 V32H-N 123.414 8.872 V33H-N 128.158 9.042 V34H-N 126.239 8.522 A35H-N 129.955 9.388 A36H-N 121.011 8.539 T37H-N 102.88 7.019 C38H-N 120.553 9.398 E39H-N 118.521 8.96 Q40H-N 118.602 7.855 Q40HE21-NE2 112.014 7.472 Q40HE22-NE2 112.014 7.031 A41H-N 122.395 8.009 L42H-N 116.832 8.497 K43H-N 121.087 7.593 S44H-N 115.15 8.1 L45H-N 120.05 8.05 A46H-N 119.94 7.36 D47H-N 115.277 7.583 N48H-N 116.977 7.727 N48HD21-ND2 115.697 7.24 N48HD22-ND2 115.697 7.995 I50H-N 122.28 7.42 D51H-N 123.77 9.31 V52H-N 114.454 7.58 A53H-N 124.62 7.78 V54H-N 118.95 8.73 L55H-N 124.82 9.24 D56H-N 124.22 8.36 V57H-N 119.581 7.022 N58H-N 114.49 8.6 N58HD21-ND2 113.806 7.924 N58HD22-ND2 113.806 7.007 L59H-N 130.67 8.26 G60H-N 109.03 7.86 K62H-N 115.984 8.625 S63H-N 113.432 7.389 H64H-N 122.58 7.762 C65H-N 111.478 7.946 G66H-N 120.34 11.29 V68H-N 116.564 7.471 A69H-N 122.825 7.88 D70H-N 116.269 8.316 A71H-N 122.771 7.156 L72H-N 119.021 8.25 K73H-N 120.087 8.383 Q74H-N 118.982 8.015 Q74HE21-NE2 111.89 7.439 Q74HE22-NE2 111.89 6.795 R75H-N 116.77 7.24 A76H-N 122.02 8.065 I77H-N 122.3 8.08 F79H-N 109.8 7.463 I80H-N 114.746 8.024 L81H-N 124.45 8.935 H82H-N 126.167 8.828 T83H-N 114.001 7.252 G84H-N 115.666 8.483 D85H-N 123.49 8.51 L86H-N 122.01 8.21 D87H-N 117.26 8.29 R88H-N 120.75 8.04 H89H-N 115.58 7.9 G90H-N 108.32 7.79 E91H-N 120.49 8.58 L92H-N 121.74 7.69 L93H-N 117.31 8.16 R94H-N 117.94 7.77 K95H-N 118.38 7.64 I96H-N 120.16 7.98 D97H-N 120.51 8.16 A98H-N 123.8 7.68 V100H-N 120.49 8.27 M101H-N 127.42 9.24 A102H-N 128.59 8.76 K103H-N 120.2 7.3 A105H-N 125.082 8.668 D106H-N 122.306 8.867 T107H-N 119.54 8.658 S108H-N 117.095 8.48 D109H-N 122.52 7.35 V110H-N 120.21 7.44 A111H-N 118.79 7.61 K112H-N 115.54 7.84 R113H-N 118.59 7.86 A114H-N 120.52 8.19 L115H-N 115.82 8.32 E116H-N 119.789 7.904 M117H-N 116.426 7.712 C118H-N 113.993 7.428 G119H-N 109.823 8.056 G120H-N 108.821 8.301 D121H-N 120.383 8.438 K122H-N 121.45 8.258 E123H-N 123.56 8.42 A125H-N 130.31 8.0