Assignment w1 w2 D3H-N 126.367 8.486 F5H-N 117.699 8.205 T6H-N 113.021 7.604 M7H-N 120.717 8.032 L8H-N 123.651 7.843 R9H-N 113.296 7.044 R11H-N 116.662 8.469 L12H-N 124.511 8.732 C13H-N 129.358 9.421 T14H-N 122.729 8.924 M15H-N 121.742 8.879 K16H-N 122.097 8.522 K17H-N 123.168 8.488 G18H-N 111.195 7.179 S20H-N 111.161 8.401 G21H-N 108.388 7.725 G23H-N 102.617 8.539 F24H-N 110.98 6.795 N25H-N 117.806 8.115 N25HD21-ND2 114.187 7.061 N25HD22-ND2 114.187 7.305 L26H-N 124.397 9.246 H27H-N 120.489 9.39 D29H-N 123.268 9.114 S31H-N 114.719 8.804 K32H-N 122.235 7.809 G34H-N 108.489 8.298 Q35H-N 119.258 8.672 Q35HE21-NE2 112.495 6.811 Q35HE22-NE2 112.495 7.363 F36H-N 120.723 8.769 I37H-N 120.474 9.176 R38H-N 132.094 9.447 S39H-N 108.454 7.514 V40H-N 119.783 8.568 D41H-N 129.471 9.336 D43H-N 118.522 9.236 S44H-N 111.544 7.343 A46H-N 118.274 8.407 E47H-N 122.327 8.216 A48H-N 122.34 8.319 S49H-N 111.945 7.927 G50H-N 107.785 7.599 L51H-N 123.942 7.253 R52H-N 123.702 8.773 A53H-N 122.181 8.66 Q54H-N 115.495 9.434 Q54HE21-NE2 111.64 6.807 Q54HE22-NE2 111.64 7.528 D55H-N 120.847 7.836 R56H-N 121.216 8.877 R56HE-NE 116.836 8.241 I57H-N 124.388 8.081 V58H-N 127.256 9.206 E59H-N 115.034 7.734 V60H-N 118.509 8.052 N61H-N 128.254 9.949 N61HD21-ND2 116.506 7.836 N61HD22-ND2 116.506 8.168 G62H-N 103.209 9.132 V63H-N 122.062 7.801 C64H-N 127.857 8.974 M65H-N 126.844 9.198 E66H-N 125.721 8.253 G67H-N 114.236 9.063 K68H-N 118.91 7.612 Q69H-N 118.521 9.047 Q69HE21-NE2 113.411 6.916 Q69HE22-NE2 113.411 7.644 H70H-N 121.793 8.882 G71H-N 103.733 9.051 D72H-N 120.271 7.368 V73H-N 122.311 7.585 V74H-N 118.42 8.053 S75H-N 115.226 8.145 A76H-N 124.873 7.843 I77H-N 118.847 8.293 R78H-N 123.847 8.627 A79H-N 120.762 8.217 G80H-N 102.118 7.249 G81H-N 107.279 7.836 D82H-N 127.984 9.065 E83H-N 118.162 7.477 T84H-N 116.153 8.738 K85H-N 125.309 7.845 L86H-N 124.354 8.911 L87H-N 127.17 8.552 V88H-N 120.457 9.348 V89H-N 107.201 8.074 D90H-N 121.765 7.67 R91H-N 120.823 9.046 E92H-N 119.241 8.755 T93H-N 120.017 8.493 D94H-N 123.206 8.904 E95H-N 116.047 8.339 F96H-N 121.485 8.005 F97H-N 120.123 8.811 K98H-N 119.315 8.406 K99H-N 121.228 7.948 C100H-N 116.087 7.352 R101H-N 115.628 7.877 V102H-N 118.193 7.485 I103H-N 129.396 8.55 S105H-N 120.278 10.748 Q106H-N 119.511 8.908 Q106HE21-NE2 112.67 6.661 Q106HE22-NE2 112.67 8.135 E107H-N 120.013 8.566 H108H-N 115.563 7.545 L109H-N 120.405 7.557 G111H-N 107.996 7.896 L113H-N 123.465 8.346 V115H-N 114.589 7.695 F117H-N 121.426 8.001 T118H-N 116.425 8.1 N119H-N 125.457 7.908 N119HD21-ND2 112.399 6.85 N119HD22-ND2 112.399 7.529 G120H-N 113.663 8.298 E121H-N 120.557 8.227 I122H-N 121.973 8.185 Q123H-N 124.768 8.452 Q123HE21-NE2 112.822 6.917 Q123HE22-NE2 112.822 7.608 K124H-N 123.352 8.37 E125H-N 121.908 8.534 N126H-N 119.699 8.508 N126HD21-ND2 112.569 6.952 N126HD22-ND2 112.569 7.628 S127H-N 116.36 8.243 R128H-N 127.541 7.969