Assignment w1 w2 S2H-N 119.66 8.831 I3H-N 125.5 8.496 T4H-N 109.81 7.226 D5H-N 119.44 7.677 V6H-N 116.33 7.349 L7H-N 118.93 7.649 S8H-N 113.59 8.377 A9H-N 131.06 9.122 D10H-N 117.68 8.112 D11H-N 123.31 7.139 I12H-N 120.26 7.96 A13H-N 120.42 7.9 A14H-N 120.88 7.577 A15H-N 123.23 8.0 L16H-N 118.66 8.363 Q17H-N 120.96 8.1 Q17HE21-NE2 111.65 6.669 Q17HE22-NE2 111.65 7.332 E18H-N 115.9 7.31 C19H-N 112.32 7.229 R20H-N 123.85 6.901 D21H-N 118.45 8.172 D23H-N 114.49 7.107 T24H-N 104.2 7.093 F25H-N 124.26 8.874 E26H-N 130.06 7.724 Q28H-N 113.58 8.264 Q28HE21-NE2 112.75 6.719 Q28HE22-NE2 112.75 7.568 K29H-N 118.66 6.768 F30H-N 119.18 7.576 F31H-N 119.83 8.756 Q32H-N 119.26 7.717 Q32HE21-NE2 111.89 6.631 Q32HE22-NE2 111.89 7.411 T33H-N 119.98 9.155 S34H-N 110.33 7.809 G35H-N 106.38 6.877 L36H-N 124.53 7.887 S37H-N 109.24 7.892 K38H-N 118.42 7.009 M39H-N 119.22 7.181 S40H-N 117.69 8.762 A41H-N 123.86 8.791 N42H-N 115.17 8.432 N42HD21-ND2 113.26 6.856 N42HD22-ND2 113.26 7.525 Q43H-N 120.05 7.371 Q43HE21-NE2 113.04 6.83 Q43HE22-NE2 113.04 7.631 V44H-N 119.88 8.305 K45H-N 120.0 7.776 D46H-N 119.92 7.403 V47H-N 120.16 7.611 F48H-N 120.7 8.431 R49H-N 115.53 7.653 F50H-N 116.23 7.303 I51H-N 116.98 7.195 D52H-N 118.78 7.101 N53H-N 125.8 7.537 N53HD21-ND2 115.14 6.712 N53HD22-ND2 115.14 7.808 D54H-N 113.83 7.826 Q55H-N 113.98 7.938 Q55HE21-NE2 114.44 6.532 Q55HE22-NE2 114.44 7.298 S56H-N 115.16 8.26 G57H-N 115.42 10.661 Y58H-N 113.47 7.474 L59H-N 124.51 9.94 D60H-N 123.19 8.14 E61H-N 117.78 8.733 E62H-N 119.98 8.013 E63H-N 117.19 7.965 L64H-N 117.16 7.867 K65H-N 120.99 7.041 F66H-N 115.68 6.764 F67H-N 119.64 7.44 L68H-N 112.11 8.449 Q69H-N 116.23 7.159 Q69HE21-NE2 107.86 6.929 Q69HE22-NE2 107.86 7.068 K70H-N 115.72 7.161 F71H-N 116.98 7.465 E72H-N 119.67 7.489 S73H-N 121.78 8.502 G74H-N 110.42 8.607 A75H-N 122.42 7.566 R76H-N 116.69 8.071 R76HH11-NH1 73.792 6.058 R76HH12-NH1 73.792 10.727 R76HH21-NH2 73.894 6.187 R76HH22-NH2 73.894 9.18 R76HE-NE 84.38 6.391 E77H-N 116.93 8.132 L78H-N 122.04 8.24 T79H-N 114.05 9.675 E80H-N 121.81 8.911 S81H-N 114.0 8.296 E82H-N 125.04 7.699 T83H-N 114.82 8.709 K84H-N 122.07 8.021 S85H-N 116.04 7.842 L86H-N 123.08 7.739 M87H-N 117.3 7.832 A88H-N 118.88 8.067 A89H-N 117.81 7.407 A90H-N 116.8 7.455 D91H-N 116.24 8.237 N92H-N 126.76 8.393 N92HD21-ND2 113.27 6.667 N92HD22-ND2 113.27 7.58 D93H-N 115.57 8.125 G94H-N 108.59 7.428 D95H-N 120.21 8.194 G96H-N 113.11 10.052 K97H-N 116.67 7.683 I98H-N 122.89 8.959 G99H-N 116.9 9.607 A100H-N 123.08 8.191 E101H-N 117.31 8.461 E102H-N 120.62 7.401 F103H-N 121.18 8.484 Q104H-N 117.3 7.859 Q104HE21-NE2 110.37 6.719 Q104HE22-NE2 110.37 7.273 E105H-N 116.97 7.932 M106H-N 118.6 7.507 V107H-N 116.11 7.356 H108H-N 115.78 7.127 S109H-N 122.21 7.402