Assignment w1 w2 A2H-N 125.2 8.73 S3H-N 111.876 8.246 M4H-N 118.609 8.835 V6H-N 118.972 8.175 V7H-N 118.082 8.011 K8H-N 120.115 7.348 E9H-N 118.525 8.424 L10H-N 121.165 8.542 E11H-N 118.478 8.105 D12H-N 118.478 8.097 L13H-N 121.381 7.663 Q14H-N 114.554 8.351 Q14HE21-NE2 111.048 7.767 Q14HE22-NE2 111.048 6.845 K15H-N 117.534 7.718 K16H-N 117.931 7.161 Y20H-N 108.91 5.947 L21H-N 123.178 7.369 R22H-N 120.573 9.107 N23H-N 116.352 9.001 N23HD21-ND2 110.516 7.344 N23HD22-ND2 110.516 6.839 L24H-N 119.619 7.975 S25H-N 122.243 9.163 S26H-N 115.593 8.397 D27H-N 124.439 8.706 D28H-N 125.173 8.718 A29H-N 120.876 8.583 N30H-N 116.583 7.765 V31H-N 120.548 8.277 L32H-N 114.488 7.656 V33H-N 120.018 7.654 W34H-N 125.372 9.663 H35H-N 118.149 9.076 A36H-N 118.864 8.241 L37H-N 119.331 8.718 L38H-N 125.138 9.512 L39H-N 130.234 9.405 D41H-N 120.417 9.023 Q42H-N 120.276 7.683 Y45H-N 123.01 7.812 H46H-N 114.221 8.278 L47H-N 119.228 7.306 K48H-N 115.857 7.61 A49H-N 121.16 9.106 F50H-N 114.451 8.544 N51H-N 122.966 9.529 L52H-N 121.904 9.28 R53H-N 122.756 9.008 I54H-N 129.706 9.08 S55H-N 119.778 8.852 F56H-N 124.903 8.924 E59H-N 112.148 8.478 Y60H-N 123.77 8.231 F62H-N 125.952 9.349 K63H-N 117.679 7.055 M66H-N 117.327 8.325 I67H-N 123.247 8.316 K68H-N 123.834 8.439 F69H-N 122.83 9.576 T70H-N 114.574 8.932 T71H-N 121.982 7.494 K72H-N 126.631 8.853 I73H-N 119.643 7.975 Y74H-N 132.209 8.634 H75H-N 129.199 8.947 N77H-N 118.947 11.483 V78H-N 119.348 7.498 D79H-N 125.634 8.917 E80H-N 117.232 9.251 N81H-N 116.375 8.395 N81HD21-ND2 114.65 7.825 N81HD22-ND2 114.65 6.988 G82H-N 108.824 8.141 Q83H-N 119.859 8.413 Q83HE21-NE2 113.983 7.599 Q83HE22-NE2 113.983 6.898 I84H-N 116.337 8.433 C85H-N 125.657 8.612 L86H-N 126.78 7.801 I88H-N 115.417 8.053 I89H-N 108.236 7.34 S90H-N 118.491 7.884 S91H-N 118.314 10.075 E92H-N 122.653 7.402 N93H-N 114.709 7.482 W94H-N 122.243 8.129 K95H-N 125.848 6.439 S97H-N 107.45 6.931 T98H-N 123.543 7.574 K99H-N 124.918 8.326 T100H-N 122.853 9.91 V103H-N 122.593 7.72 L104H-N 118.134 8.562 E105H-N 120.177 7.758 A106H-N 121.151 7.6 L107H-N 121.104 8.383 N108H-N 117.77 8.047 V109H-N 117.48 7.752 L110H-N 119.986 7.453 V111H-N 115.819 8.126 N112H-N 112.843 7.265 N112HD21-ND2 112.455 7.178 N112HD22-ND2 112.455 6.778 R113H-N 121.241 8.329 N115H-N 120.208 8.843 N115HD21-ND2 111.962 7.65 N115HD22-ND2 111.962 7.111 I116H-N 118.323 8.369 R117H-N 119.3 7.925 E118H-N 116.577 6.933 L120H-N 117.768 8.311 R121H-N 118.603 7.852 M122H-N 125.881 9.138 D123H-N 116.699 9.207 L124H-N 122.696 7.283 A125H-N 121.231 7.633 D126H-N 118.45 8.36 L127H-N 121.051 7.704 L128H-N 118.217 8.032 T129H-N 109.693 7.539 Q130H-N 118.774 8.453 Q130HE21-NE2 111.844 7.598 Q130HE22-NE2 111.844 6.791 N131H-N 116.552 9.098 N131HD21-ND2 112.448 7.857 N131HD22-ND2 112.448 6.89 E133H-N 118.261 8.77 L134H-N 123.115 7.425 F135H-N 118.3 8.304 R136H-N 117.896 8.464 K137H-N 120.498 7.85 N138H-N 119.456 8.36 N138HD21-ND2 108.417 7.785 N138HD22-ND2 108.417 7.274 A139H-N 123.033 8.882 E140H-N 124.475 8.959 E141H-N 118.991 7.944 F142H-N 120.353 8.269 T143H-N 120.563 8.624 L144H-N 119.884 8.227 R145H-N 118.067 7.825 F146H-N 112.361 7.661 G147H-N 107.341 8.382 V148H-N 120.324 8.31 D149H-N 123.869 8.351 R150H-N 122.597 8.48 S152H-N 121.332 8.109