Assignment w1 w2 V4H-N 122.08 8.343 C5H-N 129.515 7.993 N6H-N 123.956 8.602 T7H-N 116.753 8.056 C8H-N 126.725 9.334 E10H-N 121.647 8.546 K11H-N 115.176 8.79 W12H-N 120.208 8.501 W12HE1-NE1 132.347 10.45 I13H-N 120.556 9.855 N14H-N 125.489 9.113 N14HD21-ND2 109.195 7.213 N14HD22-ND2 109.195 6.427 F15H-N 124.455 8.373 K18H-N 119.014 8.08 C19H-N 119.168 8.973 Y20H-N 120.271 9.775 Y21H-N 123.483 8.461 F22H-N 127.597 7.622 G23H-N 112.535 7.788 K24H-N 121.035 7.646 G25H-N 114.109 8.069 Q28H-N 122.887 7.401 W29H-N 122.935 7.513 W29HE1-NE1 128.919 10.438 V30H-N 115.009 9.256 H31H-N 118.195 6.373 A32H-N 126.369 7.96 R33H-N 119.913 7.751 Y34H-N 118.427 7.853 A35H-N 122.792 7.832 C36H-N 113.704 7.822 D37H-N 123.956 7.989 D38H-N 120.56 8.536 M39H-N 116.775 7.429 E40H-N 113.136 8.077 G41H-N 105.974 8.066 Q42H-N 116.357 9.021 Q42HE21-NE2 112.155 7.888 Q42HE22-NE2 112.155 6.653 L43H-N 125.38 8.617 V44H-N 121.032 8.448 S45H-N 120.794 8.052 I46H-N 117.841 3.484 H47H-N 120.874 8.778 S48H-N 111.859 7.179 E50H-N 119.191 8.902 E51H-N 121.65 7.835 Q52H-N 118.177 7.74 Q52HE21-NE2 115.369 7.091 Q52HE22-NE2 115.369 6.487 D53H-N 119.67 8.55 F54H-N 120.346 7.349 L55H-N 119.502 7.96 T56H-N 116.334 8.994 K57H-N 118.545 7.243 H58H-N 114.59 6.896 A59H-N 122.981 7.34 S60H-N 114.346 8.652 G63H-N 109.265 7.057 S64H-N 114.064 8.52 W65H-N 124.455 8.373 W65HE1-NE1 129.583 10.306 I66H-N 110.38 8.175 G67H-N 109.991 9.563 L68H-N 125.541 7.373 R69H-N 120.258 7.602 N70H-N 122.048 8.791 L71H-N 127.074 7.835 K74H-N 117.176 7.833 G75H-N 108.634 8.553 E76H-N 119.156 7.535 F77H-N 123.518 8.696 I78H-N 123.393 8.503 W79H-N 129.861 8.684 W79HE1-NE1 129.138 10.134 V80H-N 117.877 9.05 D81H-N 118.47 7.791 G82H-N 109.793 8.786 S83H-N 117.909 8.556 H84H-N 118.501 8.46 V85H-N 121.567 9.2 D86H-N 128.891 9.105 Y87H-N 125.701 10.032 S88H-N 118.994 7.188 N89H-N 115.21 2.641 N89HD21-ND2 112.245 7.096 N89HD22-ND2 112.245 6.097 W90H-N 120.562 7.455 W90HE1-NE1 127.911 10.217 A91H-N 126.259 9.411 E94H-N 118.74 7.93 C104H-N 118.621 8.487 V105H-N 119.853 7.471 M106H-N 120.854 8.824 M107H-N 119.785 9.448 R108H-N 125.702 9.102 G111H-N 112.319 8.313 R112H-N 116.201 7.273 W113H-N 120.202 8.41 W113HE1-NE1 130.147 10.944 N114H-N 116.492 9.221 D115H-N 122.889 9.245 A116H-N 126.592 9.475 F117H-N 119.556 8.478 C118H-N 120.557 9.043 D119H-N 117.314 8.687 R120H-N 122.686 7.934 K121H-N 122.042 8.472 L122H-N 124.033 8.012 A124H-N 119.044 7.455 W125H-N 116.224 7.661 W125HE1-NE1 130.16 9.823 V126H-N 118.317 7.298 C127H-N 123.113 9.216 D128H-N 120.402 10.29 R129H-N 110.734 8.016 L130H-N 121.381 8.594 A131H-N 124.888 8.268 T132H-N 114.567 8.705 C133H-N 125.421 9.231 A137H-N 129.7 7.852 E139H-N 129.144 7.775 G140H-N 118.953 8.258 S141H-N 120.531 7.864 E143H-N 123.984 8.142