Assignment w1 w2 E3H-N 121.874 8.696 I4H-N 120.672 8.86 G5H-N 119.31 8.469 I6H-N 126.915 9.056 F7H-N 127.354 8.96 V8H-N 127.27 8.581 G9H-N 115.0 9.393 G13H-N 109.87 8.5 V18H-N 117.231 7.645 A19H-N 121.82 8.01 E20H-N 118.96 8.7 E21H-N 121.371 8.632 A22H-N 121.329 8.182 E23H-N 119.035 8.387 A24H-N 122.207 7.535 I25H-N 121.059 7.8 L26H-N 119.307 8.509 T27H-N 117.83 8.796 A28H-N 126.313 7.832 Q29H-N 115.527 7.353 Q29HE21-NE2 106.7 6.925 Q29HE22-NE2 106.7 6.97 G30H-N 105.961 7.923 H31H-N 119.471 7.558 K32H-N 121.854 8.665 A33H-N 130.188 8.837 T34H-N 117.164 7.826 V35H-N 126.65 8.496 F36H-N 127.63 9.164 E37H-N 123.516 8.455 D38H-N 120.395 9.602 E40H-N 119.026 9.178 L41H-N 123.708 9.16 S42H-N 110.5 8.415 D43H-N 119.77 7.69 W44H-N 118.5 7.464 L45H-N 114.1 7.55 Y47H-N 113.79 8.291 Q48H-N 116.524 7.3 Q48HE21-NE2 111.08 7.118 Q48HE22-NE2 111.08 7.5 D49H-N 114.657 7.854 K50H-N 123.514 7.833 Y51H-N 118.375 7.745 V52H-N 112.527 8.673 L53H-N 124.294 9.137 V54H-N 127.85 8.619 V55H-N 127.181 8.578 T56H-N 117.42 8.71 G62H-N 108.42 8.073 D63H-N 118.4 7.248 D66H-N 121.2 8.605 I68H-N 120.55 7.87 V69H-N 125.74 7.428 L71H-N 119.467 7.918 F72H-N 119.361 7.903 Q73H-N 116.1 9.042 Q73HE21-NE2 112.88 6.75 Q73HE22-NE2 112.88 7.693 G74H-N 107.11 8.045 I75H-N 123.629 8.174 K76H-N 119.363 7.6 D77H-N 115.19 8.482 S78H-N 112.576 8.273 L79H-N 120.833 7.025 G80H-N 108.861 7.499 F81H-N 121.441 8.018 Q82H-N 126.48 9.588 N84H-N 116.9 8.578 N84HD21-ND2 114.1 6.918 N84HD22-ND2 114.1 7.612 L85H-N 124.38 7.24 R86H-N 128.715 7.732 R86HE-NE 83.85 6.67 Y87H-N 117.42 8.783 G88H-N 107.765 8.905 V89H-N 118.18 7.499 I90H-N 125.0 8.81 A91H-N 129.036 9.253 G93H-N 110.663 8.687 D94H-N 119.304 8.129 S95H-N 123.897 8.878 S96H-N 119.248 9.124 Y97H-N 120.889 7.664 V98H-N 116.952 7.97 N99H-N 118.156 8.296 N99HD21-ND2 113.09 6.87 N99HD22-ND2 113.09 7.48 F100H-N 118.649 7.855 G104H-N 106.15 7.108 K105H-N 120.732 7.708 Q106H-N 119.087 8.738 Q106HE21-NE2 110.36 6.876 Q106HE22-NE2 110.36 6.74 F107H-N 123.088 7.922 D108H-N 117.118 8.305 A109H-N 118.59 8.332 L110H-N 120.402 7.868 L111H-N 116.945 7.704 Q112H-N 118.484 8.441 Q112HE21-NE2 116.78 7.56 Q112HE22-NE2 116.78 8.034 E113H-N 122.905 8.305 Q114H-N 117.332 7.52 Q114HE21-NE2 108.825 6.22 Q114HE22-NE2 108.825 7.382 S115H-N 109.1 7.95 A116H-N 121.059 7.813 Q117H-N 118.0 8.591 Q117HE21-NE2 112.82 6.873 Q117HE22-NE2 112.82 7.67 R118H-N 127.947 8.659 V119H-N 131.939 9.52 G120H-N 116.074 8.755 E121H-N 118.754 8.594 M122H-N 122.642 8.892 L123H-N 129.535 7.868 L124H-N 127.12 8.346 I125H-N 124.337 8.974 D126H-N 127.113 9.397 A127H-N 131.178 9.696 S128H-N 112.064 8.373 E129H-N 119.468 7.267 N130H-N 115.968 8.072 N130HD21-ND2 112.17 6.44 N130HD22-ND2 112.17 8.28 E132H-N 119.0 7.69 E134H-N 122.846 10.707 T135H-N 113.016 8.168 E136H-N 118.978 7.68 S137H-N 116.501 8.824 N138H-N 123.517 8.564 N138HD21-ND2 105.65 6.95 N138HD22-ND2 105.65 7.202 W140H-N 119.7 7.057 V141H-N 122.879 9.629 E142H-N 119.965 8.551 H143H-N 115.364 7.38 W144H-N 126.68 9.215 G145H-N 100.13 8.834 T146H-N 110.831 7.594 L147H-N 120.678 7.458 L148H-N 117.062 6.482 S149H-N 120.89 7.503