Assignment w1 w2 M2H-N 120.463 8.585 T3H-N 122.041 8.631 E4H-N 126.578 8.437 Y5H-N 122.048 8.646 K6H-N 123.74 9.158 L7H-N 125.841 9.244 V8H-N 121.981 8.125 V9H-N 129.579 8.88 V10H-N 120.015 9.097 G11H-N 108.038 7.829 A12H-N 120.271 9.072 G13H-N 105.337 8.36 G14H-N 110.123 8.043 V15H-N 112.327 7.361 G16H-N 107.725 8.421 K17H-N 122.854 9.014 S18H-N 120.732 9.213 A19H-N 125.852 9.795 L20H-N 120.345 8.933 T21H-N 117.53 7.737 I22H-N 121.445 9.347 Q23H-N 120.858 7.841 Q23HE21-NE2 107.623 6.693 Q23HE22-NE2 107.623 7.8 L24H-N 120.733 7.66 I25H-N 113.816 8.207 Q26H-N 116.165 8.942 Q26HE21-NE2 110.02 7.405 Q26HE22-NE2 110.02 6.956 N27H-N 117.129 7.982 N27HD21-ND2 111.831 6.681 N27HD22-ND2 111.831 7.485 H28H-N 110.866 6.657 F29H-N 123.2 8.661 V30H-N 128.703 7.571 D31H-N 124.941 7.962 E32H-N 120.532 7.817 Y33H-N 121.451 8.85 D34H-N 132.719 9.2 T36H-N 124.278 9.467 I37H-N 127.04 8.743 E38H-N 114.912 7.277 D39H-N 125.498 8.616 S40H-N 114.58 8.231 R42H-N 120.928 8.638 R42HE-NE 84.303 7.519 K43H-N 123.281 8.768 Q44H-N 129.084 8.892 Q44HE21-NE2 111.566 7.266 Q44HE22-NE2 111.566 6.806 V45H-N 122.082 9.073 V46H-N 122.715 8.143 I47H-N 126.439 8.416 D48H-N 129.839 9.525 G49H-N 103.444 8.296 E50H-N 122.865 7.747 T51H-N 125.298 9.007 C52H-N 125.404 9.365 L53H-N 123.215 8.927 L54H-N 124.2 9.14 D55H-N 126.337 8.851 I56H-N 124.172 9.237 L57H-N 130.44 8.898 D58H-N 128.461 9.265 T59H-N 111.603 6.647 A60H-N 119.574 7.527 G61H-N 113.928 9.841 R62H-N 120.251 7.704 R62HE-NE 85.342 8.387 E63H-N 126.347 9.328 E64H-N 119.541 9.882 Y65H-N 118.562 7.591 S66H-N 118.285 8.032 A67H-N 125.278 8.844 M68H-N 115.525 7.822 R69H-N 117.881 7.639 R69HE-NE 83.574 7.015 D70H-N 116.781 7.925 Q71H-N 114.752 7.698 Q71HE21-NE2 112.734 7.609 Q71HE22-NE2 112.734 6.935 Y72H-N 115.81 7.391 M73H-N 122.82 8.506 R74H-N 116.775 7.722 R74HE-NE 84.667 7.341 T75H-N 108.355 7.477 G76H-N 107.578 7.898 E77H-N 120.129 8.375 G78H-N 101.08 7.177 F79H-N 120.692 8.17 L80H-N 128.068 9.313 C81H-N 125.034 8.808 V82H-N 126.174 9.181 F83H-N 123.618 9.262 A84H-N 121.361 8.669 I85H-N 113.864 8.513 N86H-N 116.698 7.912 N86HD21-ND2 113.199 6.819 N86HD22-ND2 113.199 7.78 N87H-N 118.498 7.856 N87HD21-ND2 112.888 8.089 N87HD22-ND2 112.888 7.198 S88H-N 124.221 9.477 K89H-N 126.958 8.602 S90H-N 115.387 8.027 F91H-N 124.128 7.319 A92H-N 124.094 7.8 D93H-N 116.809 8.602 I94H-N 120.085 7.518 N95H-N 116.048 7.699 N95HD21-ND2 116.54 7.826 N95HD22-ND2 116.54 7.073 L96H-N 118.148 7.25 Y97H-N 118.729 7.61 R98H-N 117.941 8.453 R98HE-NE 85.052 7.091 E99H-N 116.033 7.982 Q100H-N 120.53 7.836 Q100HE21-NE2 109.334 7.194 Q100HE22-NE2 109.334 6.541 I101H-N 120.184 8.324 K102H-N 116.825 7.73 R103H-N 118.461 7.709 R103HE-NE 83.386 7.341 V104H-N 119.656 8.53 K105H-N 115.787 8.258 D106H-N 120.814 7.939 S107H-N 109.186 7.56 D108H-N 122.237 8.455 D109H-N 120.165 8.378 V110H-N 120.777 7.438 M112H-N 122.298 8.182 V113H-N 118.985 8.158 L114H-N 129.005 8.981 V115H-N 128.158 9.275 G116H-N 113.377 8.158 N117H-N 121.404 8.783 N117HD21-ND2 121.259 7.663 N117HD22-ND2 121.259 8.802 K118H-N 111.965 7.304 C119H-N 113.809 8.574 D120H-N 116.343 8.559 L121H-N 121.493 7.827 T123H-N 112.221 7.001 R124H-N 121.504 8.036 R124HE-NE 83.215 7.314 T125H-N 114.942 8.987 V126H-N 123.46 7.496 D127H-N 127.979 8.583 T128H-N 120.977 8.795 K129H-N 122.158 8.487 Q130H-N 118.349 7.574 Q130HE21-NE2 111.623 7.605 Q130HE22-NE2 111.623 6.895 A131H-N 122.465 7.275 H132H-N 116.695 8.33 E133H-N 118.757 8.271 L134H-N 122.856 7.726 A135H-N 121.191 8.037 K136H-N 118.232 8.368 S137H-N 117.591 8.02 Y138H-N 119.772 7.734 G139H-N 110.714 8.315 I140H-N 112.921 8.038 F142H-N 120.277 8.267 I143H-N 129.947 8.461 E144H-N 125.458 7.831 T145H-N 112.622 8.829 S146H-N 112.168 8.693 A147H-N 132.173 9.168 K148H-N 116.364 7.022 T149H-N 105.967 7.589 R150H-N 118.464 7.71 R150HE-NE 84.194 6.734 Q151H-N 124.207 7.838 Q151HE21-NE2 112.187 7.258 Q151HE22-NE2 112.187 6.87 G152H-N 115.332 8.94 V153H-N 120.297 7.063 E154H-N 116.867 8.197 D155H-N 116.409 8.174 A156H-N 123.831 8.583 F157H-N 112.596 7.261 Y158H-N 119.075 9.561 T159H-N 117.108 8.485 L160H-N 121.696 7.236 V161H-N 119.349 7.69 R162H-N 118.459 8.056 R162HE-NE 89.031 9.001 E163H-N 119.476 8.307 I164H-N 122.286 8.407 R165H-N 120.089 8.932 R165HE-NE 84.298 6.751 Q166H-N 116.092 7.903 Q166HE21-NE2 112.056 6.862 Q166HE22-NE2 112.056 7.449 Y167H-N 122.347 8.165 R168H-N 117.346 8.334 R168HE-NE 83.625 7.432 M169H-N 117.175 7.522 K170H-N 126.335 7.393