Assignment w1 w2 A9H-N 123.194 8.861 T10H-N 104.605 7.674 C11H-N 123.244 8.145 I13H-N 119.606 8.482 V14H-N 129.215 7.276 G16H-N 108.436 8.765 Q17H-N 116.413 7.43 Q17HE21-NE2 112.067 6.854 Q17HE22-NE2 112.067 7.324 E18H-N 124.778 9.024 M19H-N 123.895 9.06 I20H-N 122.84 8.266 I21H-N 119.808 8.905 E22H-N 122.234 7.589 I23H-N 124.176 8.921 S24H-N 122.691 8.789 K25H-N 125.739 9.027 G26H-N 108.64 8.264 L32H-N 117.679 7.927 S33H-N 116.788 8.536 I34H-N 119.329 8.843 V35H-N 117.815 9.331 G36H-N 106.429 8.595 G37H-N 105.26 7.451 T40H-N 112.2 7.864 L42H-N 117.456 7.631 N43H-N 117.095 7.895 N43HD21-ND2 111.558 6.861 N43HD22-ND2 111.558 7.458 A44H-N 119.935 7.649 I45H-N 120.664 8.529 V46H-N 126.533 8.733 I47H-N 123.457 8.891 H48H-N 133.127 9.715 E49H-N 115.233 7.437 V50H-N 124.122 8.501 Y51H-N 126.689 8.063 E52H-N 123.383 9.088 E53H-N 115.137 8.546 G54H-N 107.041 7.597 A55H-N 119.008 8.497 A56H-N 120.064 8.681 A57H-N 126.997 9.24 R58H-N 117.955 7.76 D59H-N 118.706 7.989 G60H-N 102.864 7.514 R61H-N 118.712 7.871 R61HE-NE 85.684 8.891 L62H-N 119.331 9.244 W63H-N 120.788 8.864 W63HE1-NE1 126.443 9.802 A64H-N 121.933 8.338 G65H-N 112.966 9.342 D66H-N 124.114 8.034 Q67H-N 120.239 8.906 Q67HE21-NE2 110.071 6.733 Q67HE22-NE2 110.071 7.617 I68H-N 121.552 8.553 L69H-N 126.233 9.128 E70H-N 116.049 7.499 V71H-N 120.636 8.473 N72H-N 127.814 9.805 N72HD21-ND2 111.45 6.903 N72HD22-ND2 111.45 8.052 G73H-N 103.581 8.657 V74H-N 123.858 8.329 D75H-N 127.895 8.552 L76H-N 128.134 8.974 R77H-N 123.328 8.797 R77HE-NE 85.759 7.692 N78H-N 116.84 8.549 N78HD21-ND2 113.556 6.828 N78HD22-ND2 113.556 7.679 S79H-N 115.67 7.564 S80H-N 119.863 9.189 E82H-N 116.794 9.104 E83H-N 119.918 7.763 A84H-N 123.151 8.025 I85H-N 117.363 8.124 T86H-N 117.662 8.104 A87H-N 123.037 7.894 L88H-N 115.176 7.95 R89H-N 120.32 8.03 Q90H-N 118.992 7.765 Q90HE21-NE2 111.165 6.841 Q90HE22-NE2 111.165 7.433 T91H-N 110.549 7.44 Q93H-N 115.362 8.118 Q93HE21-NE2 112.041 7.051 Q93HE22-NE2 112.041 7.548 K94H-N 116.273 7.578 V95H-N 126.085 8.971 R96H-N 128.338 8.922 L97H-N 126.793 9.174 V98H-N 121.108 8.116 V99H-N 122.745 9.303 Y100H-N 120.767 8.667 R101H-N 133.129 9.074 R101HE-NE 83.323 9.175 D102H-N 126.824 8.551 E103H-N 122.261 8.604 A104H-N 123.864 8.541 H105H-N 117.385 8.12 Y106H-N 121.307 8.09 R107H-N 123.003 8.116 D108H-N 122.0 8.292 E109H-N 121.241 8.442 E110H-N 121.495 8.429 S111H-N 116.576 8.286 G112H-N 110.65 8.214 S114H-N 116.488 8.531 S115H-N 117.998 8.357 G116H-N 116.876 8.063