Assignment w1 w2 S3H-N 116.659 8.542 M4H-N 122.115 8.356 G5H-N 110.724 8.157 V6H-N 117.765 7.471 Q7H-N 126.962 8.514 Q7HE21-NE2 111.658 7.428 Q7HE22-NE2 111.658 6.793 V8H-N 125.396 8.823 E9H-N 128.706 9.024 T10H-N 124.408 9.173 I11H-N 129.476 9.329 S12H-N 114.774 8.3 G14H-N 107.91 8.464 D15H-N 118.911 8.049 G16H-N 108.262 8.719 R17H-N 117.671 8.539 T18H-N 125.323 10.197 F19H-N 124.865 8.086 X21H-N 121.273 8.485 R22H-N 120.621 8.489 G23H-N 112.901 8.682 Q24H-N 118.698 8.103 Q24HE21-NE2 110.602 7.583 Q24HE22-NE2 110.602 6.457 T25H-N 119.715 8.729 C26H-N 126.008 8.826 V27H-N 123.456 8.063 V28H-N 118.126 9.62 H29H-N 118.824 8.579 Y30H-N 118.524 9.937 T31H-N 117.098 8.716 G32H-N 115.59 9.316 M33H-N 125.723 9.192 L34H-N 119.15 8.433 E35H-N 120.636 9.11 D36H-N 115.429 7.826 G37H-N 108.489 8.222 X38H-N 121.723 7.861 X39H-N 127.611 8.574 F40H-N 121.28 8.495 D41H-N 118.871 6.765 S42H-N 118.532 8.196 S43H-N 124.92 7.872 R44H-N 124.309 7.617 D45H-N 118.394 7.079 R46H-N 115.037 6.859 N47H-N 115.52 7.804 N47HD21-ND2 112.317 6.825 N47HD22-ND2 112.317 7.567 X48H-N 115.449 7.394 F50H-N 124.351 9.177 X51H-N 124.234 7.406 F52H-N 115.409 7.968 M53H-N 123.105 9.261 L54H-N 131.689 8.633 G55H-N 118.586 10.027 X56H-N 119.376 7.575 Q57H-N 116.921 9.055 Q57HE21-NE2 111.926 7.519 Q57HE22-NE2 111.926 6.631 E58H-N 117.417 9.389 V59H-N 108.426 6.82 I60H-N 111.618 7.404 R61H-N 124.436 8.631 G62H-N 107.151 9.688 W63H-N 119.956 7.534 W63HE1-NE1 117.754 5.908 E64H-N 118.374 7.275 E65H-N 113.896 8.39 G66H-N 106.899 7.932 V67H-N 120.73 8.688 A68H-N 117.132 7.16 Q69H-N 112.231 7.143 Q69HE21-NE2 111.207 7.171 Q69HE22-NE2 111.207 7.059 M70H-N 122.412 7.965 S71H-N 107.611 8.182 V72H-N 119.266 7.65 G73H-N 116.9 8.855 Q74H-N 123.21 8.607 Q74HE21-NE2 108.578 7.587 Q74HE22-NE2 108.578 6.49 R75H-N 124.586 8.802 R75HE-NE 113.932 8.962 A76H-N 130.97 9.93 X77H-N 120.725 9.224 L78H-N 130.224 9.981 T79H-N 121.856 8.884 I80H-N 129.859 9.864 S81H-N 123.243 8.612 D83H-N 115.934 8.799 Y84H-N 120.969 8.116 A85H-N 125.669 7.801 Y86H-N 122.08 9.321 G87H-N 108.394 8.535 T89H-N 109.341 7.927 G90H-N 106.961 7.341 H91H-N 121.87 8.799 G93H-N 113.445 8.571 I94H-N 118.128 8.103 I95H-N 119.444 8.241 H98H-N 115.851 7.934 A99H-N 122.072 7.706 T100H-N 122.875 8.448 L101H-N 124.809 8.725 V102H-N 121.081 8.692 F103H-N 123.638 9.724 D104H-N 124.358 8.775 V105H-N 126.428 9.513 E106H-N 128.393 9.285 L107H-N 128.29 8.613 L108H-N 128.594 9.019 X109H-N 112.442 7.634 L110H-N 120.833 8.204 E111H-N 126.991 8.981