Assignment w1 w2 D1H-N 120.678 8.202 V2H-N 120.104 7.987 T3H-N 121.716 8.18 R5H-N 125.576 9.358 R6H-N 130.759 8.436 D7H-N 124.455 9.553 A8H-N 117.742 8.173 E9H-N 114.042 8.431 Y10H-N 123.421 7.953 L15H-N 122.979 7.32 L16H-N 118.011 7.494 E17H-N 116.974 8.089 A18H-N 121.17 7.272 L19H-N 114.096 7.898 K20H-N 121.428 7.458 L22H-N 116.863 6.799 H23H-N 119.53 8.683 D24H-N 119.314 8.102 I25H-N 118.893 7.632 C26H-N 117.73 8.593 A27H-N 129.784 10.063 K28H-N 119.174 7.234 K29H-N 115.95 7.755 T30H-N 103.8 7.567 G31H-N 110.181 8.049 V32H-N 119.377 6.904 T33H-N 117.669 8.157 D34H-N 122.071 8.754 E35H-N 118.091 8.892 A36H-N 121.863 7.763 I37H-N 119.283 7.113 I38H-N 119.668 8.145 E39H-N 119.247 8.07 F40H-N 117.025 7.627 S41H-N 109.951 8.75 D42H-N 112.747 8.41 G43H-N 114.15 8.176 K44H-N 127.583 8.885 I45H-N 118.053 7.852 H46H-N 123.923 7.327 H46HE2-ND1 170.726 10.341 E47H-N 117.573 8.454 D48H-N 122.181 7.067 E49H-N 126.22 8.928 K50H-N 119.281 8.07 L51H-N 121.394 8.053 K52H-N 116.012 7.668 C53H-N 113.116 7.405 Y54H-N 130.82 9.354 M55H-N 118.323 8.426 N56H-N 116.307 7.427 N56HD21-ND2 114.294 6.329 N56HD22-ND2 114.294 7.668 C57H-N 120.495 8.321 L58H-N 120.497 8.033 F59H-N 112.713 6.874 H60H-N 117.667 7.948 E61H-N 120.174 9.387 A62H-N 119.076 8.031 K63H-N 111.141 7.732 V64H-N 108.571 7.557 V65H-N 108.473 6.887 D66H-N 122.552 8.934 D67H-N 116.821 8.365 N68H-N 115.813 8.247 N68HD21-ND2 115.483 6.844 N68HD22-ND2 115.483 8.121 G69H-N 108.657 7.985 D70H-N 119.46 7.836 V71H-N 120.271 8.309 H72H-N 131.496 8.838 L73H-N 126.062 8.678 K75H-N 120.358 7.95 L76H-N 120.535 8.386 D78H-N 121.488 8.36 S79H-N 114.372 7.712 L80H-N 121.108 7.21 N82H-N 121.119 8.034 N82HD21-ND2 112.41 6.924 N82HD22-ND2 112.41 7.624 S83H-N 114.449 8.397 M84H-N 118.921 7.991 H85H-N 120.937 7.778 D86H-N 119.73 8.6 I87H-N 122.091 7.901 A88H-N 121.311 8.644 M89H-N 119.511 8.232 H90H-N 123.359 8.509 M91H-N 122.645 8.244 G92H-N 108.851 8.361 K93H-N 120.704 7.995 R94H-N 123.774 8.2 C95H-N 120.899 7.508 L96H-N 118.906 7.637 Y97H-N 114.601 7.316 G100H-N 108.154 8.201 E101H-N 118.948 9.015 N102H-N 110.68 7.365 N102HD21-ND2 117.599 7.366 N102HD22-ND2 117.599 7.847 L103H-N 117.968 8.607 C104H-N 117.134 8.183 E105H-N 120.085 8.322 K106H-N 118.481 8.047 A107H-N 120.777 7.84 F108H-N 117.989 8.144 W109H-N 120.115 8.754 W109HE1-NE1 130.791 10.403 L110H-N 118.514 7.661 H111H-N 116.403 7.416 K112H-N 117.258 8.613 C113H-N 119.692 7.526 W114H-N 123.389 8.885 W114HE1-NE1 129.848 10.145 K115H-N 119.815 8.268 Q116H-N 113.106 7.848 Q116HE21-NE2 110.5 6.707 Q116HE22-NE2 110.5 6.988 A117H-N 122.051 8.108 D118H-N 111.892 7.897 K120H-N 115.508 7.476 H121H-N 112.469 7.19 Y122H-N 124.444 8.305 L124H-N 120.726 7.928 V125H-N 124.772 7.534