Assignment w1 w2 G4H-N 110.68 8.427 S5H-N 115.825 8.295 S6H-N 118.223 8.582 G7H-N 110.958 8.482 M8H-N 119.876 8.201 S9H-N 117.315 8.435 S10H-N 117.74 8.32 H11H-N 121.029 8.389 V12H-N 125.049 8.156 A14H-N 122.139 8.404 D15H-N 113.66 8.25 M16H-N 116.127 7.561 I17H-N 120.583 8.864 N18H-N 125.295 7.679 N18HD21-ND2 112.873 7.413 N18HD22-ND2 112.873 6.722 L19H-N 127.697 9.512 R20H-N 125.887 8.908 R20HE-NE 83.991 7.59 L21H-N 126.093 8.861 I22H-N 120.171 7.893 L23H-N 127.017 8.571 V24H-N 122.573 9.45 G26H-N 110.94 8.238 K27H-N 120.909 6.862 T28H-N 112.557 8.414 F31H-N 120.597 9.056 L32H-N 121.137 7.923 F33H-N 121.369 9.163 S34H-N 116.842 9.309 N36H-N 113.009 8.088 N36HD21-ND2 113.935 7.657 N36HD22-ND2 113.935 7.02 D37H-N 121.399 7.731 S38H-N 117.681 9.194 A39H-N 122.552 8.444 S40H-N 115.624 9.209 D41H-N 124.763 7.946 I42H-N 123.208 8.539 A43H-N 120.974 7.869 K44H-N 115.693 7.772 H45H-N 117.794 8.427 V46H-N 118.869 8.862 Q58H-N 116.81 8.019 S61H-N 113.506 7.005 N63H-N 114.185 7.816 N63HD21-ND2 113.036 6.935 N63HD22-ND2 113.036 7.54 I64H-N 113.365 6.919 L65H-N 120.087 7.113 R66H-N 120.378 9.217 R66HE-NE 83.765 6.996 L67H-N 122.752 9.199 I68H-N 120.091 9.061 Y69H-N 128.409 8.941 Q70H-N 126.38 9.143 Q70HE21-NE2 111.235 7.098 Q70HE22-NE2 111.235 6.758 G71H-N 102.771 8.353 R72H-N 119.777 7.693 R72HE-NE 85.288 7.226 F73H-N 121.153 8.622 L74H-N 123.718 8.828 H75H-N 124.598 8.584 G76H-N 108.279 8.449 N77H-N 113.652 8.565 N77HD21-ND2 112.15 6.916 N77HD22-ND2 112.15 7.696 V78H-N 123.914 7.82 T79H-N 114.458 7.462 L80H-N 117.247 7.872 G81H-N 106.65 9.595 A82H-N 126.288 7.91 L83H-N 116.09 7.308 K84H-N 113.975 7.83 L85H-N 118.163 7.195 F87H-N 122.575 8.322 G88H-N 108.73 9.307 K89H-N 116.254 7.068 T90H-N 121.531 8.805 T91H-N 126.38 9.042 V92H-N 128.725 8.755 M93H-N 123.541 8.968 H94H-N 118.551 8.401 L95H-N 125.19 8.296 V96H-N 121.066 9.227 A97H-N 125.172 8.655 R98H-N 122.967 8.809 R98HE-NE 84.346 7.214 E99H-N 124.516 8.852 T100H-N 113.993 8.062 L101H-N 125.823 8.408 E103H-N 122.553 8.442 N105H-N 118.29 8.58 N105HD21-ND2 112.958 7.643 N105HD22-ND2 112.958 6.954 S106H-N 116.14 8.284 Q107H-N 121.688 8.43 Q107HE21-NE2 112.452 6.869 Q107HE22-NE2 112.452 7.536 G108H-N 109.459 8.374 Q109H-N 119.888 8.231 S111H-N 117.247 8.392 G112H-N 110.726 8.276 S114H-N 116.369 8.53 S115H-N 117.857 8.34 G116H-N 116.936 8.062