Assignment w1 w2 T3H-N 106.583 7.774 D4H-N 118.498 7.57 I5H-N 119.244 7.448 L6H-N 117.174 8.041 S7H-N 115.268 8.702 S9H-N 113.019 8.212 D10H-N 125.331 7.34 I11H-N 120.463 8.064 A12H-N 119.742 8.075 A13H-N 120.669 7.738 A14H-N 124.507 8.079 L15H-N 118.859 8.352 R16H-N 120.716 8.237 R16HH11-NH1 114.2 7.341 R16HH12-NH1 114.2 7.341 R16HH21-NH2 114.2 7.202 R16HH22-NH2 114.2 7.202 D17H-N 116.941 7.497 C18H-N 110.205 7.312 Q19H-N 122.548 7.128 Q19HE21-NE2 111.5 7.599 Q19HE22-NE2 111.5 6.867 A20H-N 120.944 8.319 D22H-N 116.024 7.292 S23H-N 111.906 7.73 F24H-N 124.502 9.072 S25H-N 123.4 8.012 K27H-N 112.664 7.784 K28H-N 118.648 6.902 F29H-N 120.075 7.735 F30H-N 119.851 8.994 Q31H-N 119.213 7.89 Q31HE21-NE2 111.8 7.493 Q31HE22-NE2 111.8 6.769 I32H-N 121.257 8.746 S33H-N 108.765 7.97 G34H-N 107.198 7.13 M35H-N 120.909 8.111 S36H-N 108.736 7.871 K37H-N 118.271 7.017 K38H-N 118.269 7.351 S39H-N 115.752 8.85 S40H-N 115.67 9.05 S41H-N 116.3 8.449 Q42H-N 122.888 7.659 Q42HE21-NE2 113.8 7.121 Q42HE22-NE2 113.8 7.889 L43H-N 118.186 8.738 K44H-N 120.532 8.093 E45H-N 119.125 7.392 I46H-N 118.798 7.632 F47H-N 121.864 8.86 R48H-N 115.304 7.849 R48HH11-NH1 114.5 7.474 R48HH12-NH1 114.5 7.474 R48HH21-NH2 114.5 7.352 R48HH22-NH2 114.5 7.352 I49H-N 117.893 7.168 L50H-N 118.435 7.419 D51H-N 117.955 7.687 N52H-N 123.586 7.369 N52HD21-ND2 113.9 6.87 N52HD22-ND2 113.9 7.94 D53H-N 114.414 8.289 Q54H-N 114.845 7.923 Q54HE21-NE2 114.7 6.685 Q54HE22-NE2 114.7 7.499 S55H-N 116.375 8.917 G56H-N 114.988 10.491 F57H-N 113.993 7.889 I58H-N 125.97 9.916 E59H-N 126.612 7.846 E60H-N 123.368 9.491 D61H-N 114.87 8.704 E62H-N 115.38 7.134 L63H-N 121.278 7.907 K64H-N 115.522 7.228 Y65H-N 116.431 6.822 F66H-N 118.88 7.682 L67H-N 112.674 8.519 Q68H-N 116.208 7.328 Q68HE21-NE2 108.7 7.433 Q68HE22-NE2 108.7 6.653 R69H-N 117.971 7.463 R69HH11-NH1 114.7 7.398 R69HH12-NH1 114.7 7.398 R69HH21-NH2 114.7 7.269 R69HH22-NH2 114.7 7.269 F70H-N 115.783 7.496 E71H-N 120.313 7.625 S72H-N 122.457 8.774 G73H-N 109.225 8.687 A74H-N 122.808 7.771 R75H-N 117.062 8.241 R75HH11-NH1 114.8 6.55 R75HH12-NH1 114.8 6.55 R75HH21-NH2 114.8 6.68 R75HH22-NH2 114.8 6.68 V76H-N 114.586 7.93 L77H-N 123.954 8.258 T78H-N 112.962 9.881 A79H-N 124.851 9.029 S80H-N 112.817 8.441 E81H-N 123.054 8.047 T82H-N 114.612 8.812 K83H-N 121.725 8.109 T84H-N 116.251 8.203 F85H-N 125.025 8.042 L86H-N 119.476 8.516 A87H-N 117.838 8.207 A88H-N 117.605 7.588 A89H-N 117.837 7.777 D90H-N 116.121 8.351 H91H-N 126.351 8.507 D92H-N 116.226 8.59 G93H-N 108.464 7.639 D94H-N 120.318 8.341 G95H-N 112.269 10.117 K96H-N 116.222 7.92 I97H-N 122.534 8.848 G98H-N 116.976 9.857 A99H-N 123.478 8.545 E100H-N 117.812 8.634 E101H-N 120.408 7.674 F102H-N 120.204 8.71 Q103H-N 117.609 7.969 Q103HE21-NE2 111.3 6.95 Q103HE22-NE2 111.3 7.346 E104H-N 116.692 8.087 M105H-N 118.344 7.832 V106H-N 118.321 7.625 Q107H-N 114.806 7.59 Q107HE21-NE2 110.2 7.216 Q107HE22-NE2 110.2 6.659 S108H-N 120.561 7.468