Assignment w1 w2 S5H-N 115.849 8.297 S6H-N 117.877 8.451 G7H-N 110.719 8.436 M8H-N 119.918 8.158 A9H-N 125.406 8.39 E10H-N 119.927 8.467 A11H-N 123.615 8.038 A12H-N 121.663 7.98 A13H-N 124.098 7.957 W15H-N 106.534 5.875 W15HE1-NE1 133.138 10.86 Y16H-N 123.71 7.698 H17H-N 128.42 9.333 G18H-N 105.769 5.637 L20H-N 126.678 7.778 S21H-N 123.692 9.427 R22H-N 121.868 8.907 T23H-N 112.712 8.125 D24H-N 122.651 7.907 A25H-N 123.211 8.603 E26H-N 116.232 8.546 N27H-N 116.085 8.409 N27HD21-ND2 112.704 7.812 N27HD22-ND2 112.704 6.896 S28H-N 113.665 7.902 L29H-N 118.503 7.626 L30H-N 121.573 7.807 R31H-N 114.707 8.216 M32H-N 118.634 7.678 E34H-N 125.661 8.834 G35H-N 113.477 9.682 T36H-N 122.155 8.151 F37H-N 122.249 8.195 L38H-N 114.936 9.304 V39H-N 120.262 9.523 R40H-N 124.606 9.71 R40HE-NE 83.74 7.137 D41H-N 122.814 8.647 S42H-N 114.649 8.012 S45H-N 117.812 7.619 G47H-N 115.106 8.781 D48H-N 117.309 7.708 Y49H-N 117.153 8.984 V50H-N 122.183 9.862 L51H-N 130.637 9.488 S52H-N 125.802 9.425 C53H-N 121.287 9.013 S54H-N 117.863 8.657 E55H-N 129.358 8.717 N56H-N 124.297 10.147 N56HD21-ND2 110.361 6.809 N56HD22-ND2 110.361 6.571 G57H-N 105.223 8.928 K58H-N 120.655 8.079 V59H-N 120.313 8.155 T60H-N 121.688 9.274 H61H-N 116.151 7.714 Y62H-N 124.153 9.904 K63H-N 124.297 8.856 L64H-N 126.848 8.623 S65H-N 118.111 8.785 A66H-N 128.946 8.929 E67H-N 125.411 8.486 E68H-N 125.075 9.297 G69H-N 106.062 8.572 K70H-N 120.739 7.874 I71H-N 121.119 8.863 R72H-N 129.837 9.777 R72HE-NE 84.564 8.181 I73H-N 124.16 8.39 D74H-N 127.946 9.336 T75H-N 112.07 7.666 H76H-N 122.021 8.485 L77H-N 122.897 7.859 F78H-N 123.371 9.587 D79H-N 119.562 9.285 N80H-N 106.508 7.322 N80HD21-ND2 114.768 7.674 N80HD22-ND2 114.768 6.9 L81H-N 119.87 8.846 D82H-N 118.228 8.433 A83H-N 120.971 8.315 A84H-N 122.142 7.133 I85H-N 117.124 7.668 T86H-N 114.527 8.148 F87H-N 122.091 7.588 Y88H-N 118.739 7.741 M89H-N 117.835 7.617 E90H-N 115.665 7.136 H91H-N 117.703 7.355 E92H-N 117.931 8.391 L93H-N 123.635 7.299 E94H-N 121.391 8.246 Y95H-N 113.766 9.124 S96H-N 113.598 8.963 S97H-N 118.921 8.327 L98H-N 119.193 8.838 K99H-N 120.489 9.1 Q100H-N 115.772 7.608 Q100HE21-NE2 111.404 7.47 Q100HE22-NE2 111.404 6.767 L102H-N 125.368 8.485 Q103H-N 128.144 8.551 Q103HE21-NE2 112.92 7.745 Q103HE22-NE2 112.92 6.855 R104H-N 129.682 8.297