Assignment w1 w2 A2H-N 129.8 8.26 D3H-N 119.1 8.34 S4H-N 116.5 8.24 T5H-N 116.4 8.3 I6H-N 122.9 8.0 T7H-N 118.9 8.15 I8H-N 123.9 8.11 R9H-N 125.2 8.33 R9HE-NE 84.9 7.68 G10H-N 110.0 8.28 Y11H-N 120.4 7.93 V12H-N 123.3 7.86 R13H-N 124.9 8.04 D14H-N 120.7 8.32 N15H-N 115.7 7.89 N15HD21-ND2 111.3 7.45 N15HD22-ND2 111.3 6.75 G16H-N 105.6 7.28 C17H-N 113.0 5.78 S18H-N 117.5 8.09 V19H-N 124.2 8.52 A20H-N 131.7 8.76 A21H-N 126.0 8.93 E22H-N 115.2 9.3 S23H-N 114.8 8.02 T24H-N 112.8 7.59 N25H-N 120.2 8.11 N25HD21-ND2 113.8 7.7 N25HD22-ND2 113.8 6.9 F26H-N 118.2 7.73 T27H-N 116.6 8.61 V28H-N 128.9 9.15 D29H-N 127.8 8.63 L30H-N 123.9 9.56 M31H-N 116.6 9.17 E32H-N 119.6 7.66 N33H-N 121.4 8.33 N33HD21-ND2 114.6 7.27 N33HD22-ND2 114.6 6.89 A34H-N 126.1 9.06 A35H-N 127.0 8.93 K36H-N 115.0 8.66 Q37H-N 116.4 7.34 Q37HE21-NE2 111.6 7.53 Q37HE22-NE2 111.6 7.12 F38H-N 118.0 7.39 N39H-N 119.4 8.32 N39HD21-ND2 112.9 7.53 N39HD22-ND2 112.9 6.8 N40H-N 113.6 7.35 N40HD21-ND2 113.3 7.3 N40HD22-ND2 113.3 6.9 I41H-N 122.8 8.73 G42H-N 116.3 8.8 A43H-N 123.4 7.85 T44H-N 108.9 8.18 T45H-N 110.1 7.74 V47H-N 114.3 7.9 V48H-N 123.1 9.11 F50H-N 114.9 8.27 R51H-N 118.1 8.55 I52H-N 119.9 8.84 L53H-N 129.8 8.81 L54H-N 126.4 8.89 S55H-N 116.6 8.13 C57H-N 115.1 8.56 G58H-N 108.4 8.68 N59H-N 117.2 8.8 N59HD21-ND2 112.1 7.57 N59HD22-ND2 112.1 6.86 A60H-N 121.0 8.44 V61H-N 116.7 6.71 S62H-N 116.0 9.05 A63H-N 122.8 7.91 V64H-N 119.0 9.36 K65H-N 129.1 9.15 V66H-N 126.6 8.4 G67H-N 113.5 8.16 F68H-N 117.8 8.28 T69H-N 117.3 9.44 G70H-N 108.3 8.56 V71H-N 124.5 8.81 A72H-N 131.0 8.46 D73H-N 123.8 8.45 S74H-N 118.3 8.14 H75H-N 120.9 8.79 N76H-N 119.0 8.64 N76HD21-ND2 111.7 6.76 N76HD22-ND2 111.7 7.43 A77H-N 125.3 8.52 N78H-N 111.8 7.89 N78HD21-ND2 115.4 7.67 N78HD22-ND2 115.4 7.02 L79H-N 117.4 8.04 L80H-N 122.8 9.03 A81H-N 128.0 8.68 L82H-N 119.3 8.25 E83H-N 121.5 8.62 N84H-N 124.4 8.82 N84HD21-ND2 111.6 7.54 N84HD22-ND2 111.6 6.81 T85H-N 114.2 7.22 V86H-N 120.2 8.36 S87H-N 115.4 8.29 A88H-N 124.6 7.57 A89H-N 123.7 7.96 S90H-N 110.8 7.78 G91H-N 109.5 8.82 L92H-N 116.3 7.0 G93H-N 105.5 8.48 I94H-N 120.0 8.92 Q95H-N 129.9 9.31 Q95HE21-NE2 113.1 7.88 Q95HE22-NE2 113.1 7.07 L96H-N 127.5 8.88 L97H-N 119.8 9.19 N98H-N 117.1 8.63 N98HD21-ND2 112.1 7.3 N98HD22-ND2 112.1 7.84 E99H-N 118.0 8.19 Q100H-N 116.9 7.33 Q100HE21-NE2 112.9 7.47 Q100HE22-NE2 112.9 6.95 Q101H-N 111.8 8.59 Q101HE21-NE2 108.9 6.36 Q101HE22-NE2 108.9 6.31 N102H-N 115.8 7.9 N102HD21-ND2 113.0 7.47 N102HD22-ND2 113.0 6.95 Q103H-N 122.5 8.69 Q103HE21-NE2 113.0 7.88 Q103HE22-NE2 113.0 7.07 I104H-N 130.0 8.97 L106H-N 127.1 7.91 N107H-N 117.7 8.97 N107HD21-ND2 114.4 7.58 N107HD22-ND2 114.4 7.71 A108H-N 122.3 7.47 S110H-N 116.5 8.62 S111H-N 113.9 8.09 A112H-N 124.0 7.82 L113H-N 119.5 7.17 S114H-N 116.4 8.59 W115H-N 122.4 8.48 W115HE1-NE1 128.9 10.09 T116H-N 123.2 9.76 T117H-N 124.2 8.81 L118H-N 124.2 7.85 T119H-N 119.4 9.35 G121H-N 106.4 7.44 K122H-N 119.3 6.98 N124H-N 121.2 9.44 N124HD21-ND2 112.7 7.61 N124HD22-ND2 112.7 6.87 T125H-N 119.4 8.83 L126H-N 128.5 9.05 N127H-N 121.1 8.1 N127HD21-ND2 113.7 7.3 N127HD22-ND2 113.7 6.51 F128H-N 117.2 7.93 Y129H-N 114.8 8.57 A130H-N 121.6 9.31 R131H-N 112.6 8.66 L132H-N 118.7 7.71 M133H-N 119.0 8.58 A134H-N 127.6 8.86 T135H-N 118.1 9.3 Q136H-N 122.1 7.75 Q136HE21-NE2 111.8 7.3 Q136HE22-NE2 111.8 6.67 V137H-N 112.3 7.71 V139H-N 121.4 8.45 T140H-N 117.5 8.11 A141H-N 123.6 8.18 G142H-N 105.4 8.45 H143H-N 117.7 8.56 I144H-N 121.9 8.23 N145H-N 126.6 8.4 N145HD21-ND2 112.7 7.61 N145HD22-ND2 112.7 6.66 A146H-N 124.8 8.48 T147H-N 115.1 8.45 A148H-N 127.2 9.19 T149H-N 115.9 8.82 F150H-N 120.9 8.39 T151H-N 114.2 8.85 L152H-N 121.8 8.41 E153H-N 123.7 8.06 Y154H-N 124.6 9.03 Q155H-N 122.2 8.35 Q165H-N 123.8 8.6 Q165HE21-NE2 112.7 7.77 Q165HE22-NE2 112.7 6.86 A166H-N 126.8 8.43 D167H-N 120.3 8.35 S168H-N 114.4 7.47 T169H-N 116.5 8.33 I170H-N 122.2 8.99 T171H-N 123.6 8.45 I172H-N 128.4 9.24 R173H-N 124.2 8.45 R173HE-NE 85.2 7.26 G174H-N 105.4 7.96 Y175H-N 121.9 8.81 V176H-N 128.3 8.43 R177H-N 124.9 8.72 R177HH21-NH2 85.1 6.74 R177HH22-NH2 85.1 6.74 R177HE-NE 95.8 7.97 D178H-N 123.4 8.81 N179H-N 124.2 7.97 N179HD21-ND2 112.1 7.44 N179HD22-ND2 112.1 6.72