Assignment w1 w2 T3H-N 116.56 8.367 M4H-N 122.663 8.364 H5H-N 120.166 8.344 F6H-N 122.458 8.389 T7H-N 115.32 8.154 D8H-N 122.453 8.324 D9H-N 120.75 8.296 N10H-N 118.729 8.402 N10HD21-ND2 113.789 6.947 N10HD22-ND2 113.789 7.655 E11H-N 121.015 8.378 N12H-N 118.846 8.397 N12HD21-ND2 113.411 6.901 N12HD22-ND2 113.411 7.658 D13H-N 121.304 8.261 T14H-N 114.723 8.171 S15H-N 119.759 8.352 E16H-N 122.85 8.385 T17H-N 111.537 8.71 M18H-N 118.64 8.976 E19H-N 116.332 8.876 S20H-N 114.73 7.835 L21H-N 124.029 8.089 I22H-N 120.311 7.987 D23H-N 123.007 8.599 K24H-N 117.684 7.696 G25H-N 109.511 8.178 K26H-N 124.022 8.36 L27H-N 117.052 7.384 D28H-N 117.807 8.636 Q29H-N 119.366 7.493 Q29HE21-NE2 106.404 6.2 Q29HE22-NE2 106.404 6.99 V30H-N 108.58 8.394 V31H-N 120.659 6.807 Y32H-N 125.43 9.063 D33H-N 132.18 8.62 D34H-N 108.307 8.376 Q35H-N 117.416 7.807 Q35HE21-NE2 112.263 6.828 Q35HE22-NE2 112.263 7.537 L36H-N 122.24 8.277 Y37H-N 121.192 9.173 H38H-N 119.805 9.437 L39H-N 127.165 9.03 K40H-N 125.938 9.247 E41H-N 118.437 8.503 K42H-N 122.218 8.318 V43H-N 118.735 8.724 D44H-N 121.083 8.06 E45H-N 120.102 8.643 D46H-N 115.291 8.277 K47H-N 118.975 7.692 K48H-N 116.606 6.978 G49H-N 109.875 7.8 K50H-N 122.06 7.867 V51H-N 122.532 8.56 I52H-N 121.088 8.992 G53H-N 109.977 7.673 A54H-N 121.763 9.013 I55H-N 121.528 8.473 G56H-N 106.647 7.701 Q57H-N 116.187 7.937 Q57HE21-NE2 111.523 7.047 Q57HE22-NE2 111.523 7.308 T58H-N 119.112 8.346 F59H-N 125.434 8.82 F60H-N 117.699 9.617 V61H-N 114.768 9.14 D62H-N 120.954 8.378 G63H-N 106.547 9.059 D64H-N 119.209 8.462 G65H-N 108.724 8.126 K66H-N 122.757 8.432 R67H-N 125.874 8.989 R67HE-NE 111.365 8.818 W68H-N 129.312 9.356 W68HE1-NE1 129.259 10.434 S69H-N 122.127 9.254 E70H-N 120.891 9.127 E71H-N 117.648 8.644 E72H-N 120.187 7.906 L73H-N 118.027 8.109 K74H-N 117.599 7.414 E75H-N 120.023 7.409 Y77H-N 122.948 8.436 I78H-N 125.952 8.034 S79H-N 119.408 8.213 N80H-N 120.848 8.476 N80HD21-ND2 113.064 6.902 N80HD22-ND2 113.064 7.542 N81H-N 118.794 8.199 N81HD21-ND2 113.066 7.095 N81HD22-ND2 113.066 7.652 D83H-N 116.763 8.109 E84H-N 119.806 7.767 I85H-N 122.573 7.898 R86H-N 128.912 8.458 R86HE-NE 114.011 8.163 E87H-N 128.15 9.0 K88H-N 124.83 8.737 K89H-N 128.015 9.521 L91H-N 123.69 8.932 R92H-N 122.32 8.185 Y93H-N 127.147 9.064 G94H-N 115.96 9.275 K95H-N 128.643 8.947 V96H-N 117.59 7.767 Y97H-N 125.232 9.662 S98H-N 114.093 9.003 T99H-N 110.07 8.604 N100H-N 119.39 8.388 N100HD21-ND2 112.854 6.889 N100HD22-ND2 112.854 7.621 E101H-N 120.756 8.611 D102H-N 119.341 8.303 S103H-N 115.614 8.047 D104H-N 123.021 8.517 A105H-N 124.036 8.049 K106H-N 118.842 8.59 D107H-N 120.043 8.499 E108H-N 117.614 7.724 I109H-N 115.997 8.743 I110H-N 119.89 9.059 V111H-N 125.973 9.486 E112H-N 127.784 8.354 F113H-N 129.69 9.404 N114H-N 129.78 9.41 N114HD21-ND2 111.468 6.64 N114HD22-ND2 111.468 7.183 R115H-N 107.935 8.897 E116H-N 119.376 7.633 Y117H-N 118.855 8.735 Y118H-N 119.61 9.042 R119H-N 123.962 8.87 R119HE-NE 111.899 8.197 A120H-N 130.481 9.54 V121H-N 115.939 8.534 L122H-N 128.194 8.373 I123H-N 127.116 8.396 K124H-N 124.38 8.417 N125H-N 119.52 8.2 N125HD21-ND2 112.866 6.974 N125HD22-ND2 112.866 7.703 E126H-N 122.02 8.262 K127H-N 122.694 8.322 E128H-N 127.389 8.019