Assignment w1 w2 V3H-N 126.6 8.3 I4H-N 130.8 7.86 N5H-N 127.8 8.07 N5HD21-ND2 112.0 6.5 N5HD22-ND2 112.0 6.65 T6H-N 111.7 7.2 F7H-N 124.3 8.94 D8H-N 118.1 8.66 G9H-N 110.6 7.92 V10H-N 127.2 8.93 A11H-N 125.7 8.29 D12H-N 120.1 8.16 Y13H-N 128.5 8.08 L14H-N 124.0 9.13 Q15H-N 119.3 8.03 Q15HE21-NE2 115.6 7.41 Q15HE22-NE2 115.6 7.03 T16H-N 117.7 7.61 Y17H-N 120.7 8.45 H18H-N 118.8 8.08 K19H-N 114.9 7.45 L20H-N 121.7 8.34 D22H-N 122.2 8.51 N23H-N 116.2 8.44 N23HD21-ND2 118.9 7.1 N23HD22-ND2 118.9 6.45 Y24H-N 123.3 7.33 I25H-N 122.5 9.04 T26H-N 117.1 8.54 K27H-N 125.3 10.24 S28H-N 118.0 9.17 E29H-N 128.5 7.66 A30H-N 126.1 8.78 Q31H-N 124.3 9.29 Q31HE21-NE2 114.5 7.28 Q31HE22-NE2 114.5 6.89 A32H-N 127.6 7.94 L33H-N 120.7 7.38 G34H-N 107.9 7.78 W35H-N 127.2 8.31 W35HE1-NE1 132.4 9.82 V36H-N 137.2 8.75 A37H-N 134.4 7.96 K39H-N 123.4 7.78 G40H-N 111.6 7.62 N41H-N 118.1 7.48 N41HD21-ND2 112.8 8.07 N41HD22-ND2 112.8 6.69 L42H-N 126.3 7.96 A43H-N 120.9 8.14 D44H-N 118.5 7.26 V45H-N 114.2 7.24 A46H-N 129.5 8.44 G48H-N 115.9 8.6 K49H-N 123.6 7.86 S50H-N 117.6 8.09 I51H-N 127.9 8.49 G52H-N 117.8 9.16 G53H-N 111.2 9.76 D54H-N 125.9 8.78 I55H-N 122.5 8.28 F56H-N 135.4 9.13 N58H-N 121.0 6.18 N58HD21-ND2 115.5 7.65 N58HD22-ND2 115.5 7.03 E60H-N 119.2 8.12 G61H-N 111.0 7.58 K62H-N 121.5 7.88 L63H-N 122.3 7.48 G65H-N 118.7 8.69 K66H-N 124.8 8.22 R69H-N 125.7 8.06 R69HE-NE 88.6 8.47 T70H-N 126.7 8.18 W71H-N 128.7 9.15 W71HE1-NE1 129.8 8.85 R72H-N 125.7 8.61 R72HE-NE 92.4 7.11 E73H-N 118.2 8.17 A74H-N 123.7 9.05 D75H-N 127.7 9.66 I76H-N 130.8 7.75 N77H-N 119.5 8.76 N77HD21-ND2 120.3 8.63 N77HD22-ND2 120.3 6.32 Y78H-N 125.9 8.98 T79H-N 124.0 8.03 S80H-N 117.3 7.22 G81H-N 111.9 8.77 F82H-N 126.7 8.91 R83H-N 122.3 7.96 R83HE-NE 88.2 9.66 N84H-N 126.1 8.95 N84HD21-ND2 117.9 7.86 N84HD22-ND2 117.9 8.33 S85H-N 117.3 8.3 D86H-N 126.6 7.68 R87H-N 128.0 9.44 R87HE-NE 92.2 7.37 I88H-N 127.4 9.47 L89H-N 134.4 9.4 Y90H-N 122.6 9.29 S91H-N 125.3 8.86 S92H-N 117.9 8.03 D93H-N 119.3 8.0 W94H-N 119.7 7.17 W94HE1-NE1 132.3 9.59 L95H-N 123.7 8.13 I96H-N 122.7 8.78 Y97H-N 133.3 10.33 K98H-N 120.7 9.55 T99H-N 119.9 8.8 T100H-N 121.1 9.02 D101H-N 127.2 8.41 H102H-N 122.5 8.8 Y103H-N 111.0 7.46 Q104H-N 124.0 7.35 Q104HE21-NE2 116.4 7.55 Q104HE22-NE2 116.4 6.88 T105H-N 118.6 9.88 F106H-N 121.8 8.63 T107H-N 120.2 9.09 K108H-N 134.3 8.96 I109H-N 126.2 8.97 R110H-N 131.2 8.21 R110HE-NE 88.0 7.13