Assignment w1 w2 S12H-N 118.485 8.509 G13H-N 111.084 8.404 I14H-N 119.966 8.006 E15H-N 124.654 8.528 G16H-N 110.097 8.343 R17H-N 120.459 8.143 G18H-N 110.097 8.477 R19H-N 120.706 8.105 S20H-N 117.992 8.58 A21H-N 128.108 8.83 L22H-N 117.992 8.204 S23H-N 116.018 7.769 C24H-N 121.199 8.277 Q25H-N 118.239 8.064 Q25HE22-NE2 111.084 6.828 M26H-N 118.732 8.268 C27H-N 121.446 8.646 E28H-N 118.239 8.554 L29H-N 122.433 7.912 V30H-N 120.953 8.251 V31H-N 118.979 8.071 K32H-N 119.226 8.088 K33H-N 118.868 8.46 Y34H-N 121.94 8.966 E35H-N 118.239 8.98 G36H-N 103.73 7.696 S37H-N 115.525 6.977 A38H-N 131.315 8.918 D39H-N 114.785 7.712 K40H-N 119.226 8.386 D41H-N 119.226 7.523 A42H-N 130.822 9.017 N43H-N 114.785 8.433 V44H-N 123.173 7.51 I45H-N 120.213 8.084 K46H-N 118.239 8.393 K47H-N 119.719 7.469 D48H-N 122.433 8.697 F49H-N 120.502 9.328 D50H-N 120.706 8.603 A51H-N 117.499 7.51 E52H-N 118.979 7.604 C53H-N 120.292 9.106 K54H-N 117.499 7.888 K55H-N 120.213 7.3 L56H-N 119.719 8.074 F57H-N 113.798 8.054 H58H-N 116.758 7.523 T59H-N 108.123 7.674 I60H-N 124.16 7.5 G63H-N 110.837 8.584 T64H-N 114.538 8.538 R65H-N 121.94 7.534 E66H-N 120.459 8.427 C67H-N 121.446 8.467 D68H-N 120.459 8.002 H69H-N 118.732 8.564 Y70H-N 125.887 8.765 V71H-N 118.239 8.295 N72H-N 116.018 7.511 S73H-N 110.837 7.709 K74H-N 120.706 7.942 V75H-N 120.147 7.227 D76H-N 117.992 8.851 I78H-N 119.472 7.243 I79H-N 119.472 8.18 H80H-N 117.252 8.671 E81H-N 120.459 7.72 L82H-N 121.199 7.76 E83H-N 121.199 8.885 G84H-N 105.656 7.496 G85H-N 106.396 7.473 T86H-N 120.706 7.672 A87H-N 132.796 9.043 K89H-N 112.811 8.127 D90H-N 117.971 7.953 V91H-N 120.213 7.142 C92H-N 117.499 8.78 T93H-N 117.499 8.215 K94H-N 127.121 8.298 L95H-N 114.538 7.621 N96H-N 113.551 7.967 E97H-N 116.018 8.09 C98H-N 112.811 7.052