NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
569597 |
2mbg   |
17608 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
ASSI { 1955}
(( segid " " and resid 222 and name H ))
(( segid " " and resid 222 and name HG2 ))
4.100 2.100 1.900 peak 1955 spectrum 1 weight 0.10000E+01 volume 0.11108E-02 ppm1 7.251 ppm2 0.411 CV 1
ASSI { 1823}
(( segid " " and resid 422 and name H ))
(( segid " " and resid 422 and name HB3 ))
3.300 1.400 1.400 peak 1823 spectrum 1 weight 0.10000E+01 volume 0.26452E-02 ppm1 8.204 ppm2 2.664 CV 1
ASSI { 2967}
(( segid " " and resid 192 and name H ))
( segid " " and resid 192 and name HG2%)
3.200 1.300 1.300 peak 2967 spectrum 1 weight 0.10000E+01 volume 0.24276E-02 ppm1 6.705 ppm2 0.695 CV 1
ASSI { 1645}
(( segid " " and resid 217 and name H ))
(( segid " " and resid 217 and name HA ))
2.900 1.100 1.100 peak 1645 spectrum 1 weight 0.10000E+01 volume 0.14978E-02 ppm1 7.493 ppm2 2.991 CV 1
ASSI { 2996}
(( segid " " and resid 283 and name H ))
(( segid " " and resid 283 and name HG ))
3.500 1.500 1.500 peak 2996 spectrum 1 weight 0.10000E+01 volume 0.20850E-02 ppm1 7.318 ppm2 1.559 CV 1
ASSI { 90}
(( segid " " and resid 264 and name H ))
(( segid " " and resid 265 and name HA ))
4.800 2.900 1.200 peak 90 spectrum 1 weight 0.10000E+01 volume 0.57178E-03 ppm1 8.515 ppm2 4.105 CV 1
ASSI { 2493}
(( segid " " and resid 189 and name H ))
( segid " " and resid 190 and name HD% )
4.800 2.900 1.200 peak 2493 spectrum 1 weight 0.10000E+01 volume 0.34845E-03 ppm1 8.876 ppm2 7.862 CV 1
ASSI { 1275}
(( segid " " and resid 445 and name H ))
(( segid " " and resid 444 and name H ))
2.300 0.700 0.700 peak 1275 spectrum 1 weight 0.10000E+01 volume 0.34691E-02 ppm1 7.905 ppm2 7.741 CV 1
ASSI { 793}
(( segid " " and resid 440 and name H ))
(( segid " " and resid 440 and name HG2 ))
3.100 1.200 1.200 peak 793 spectrum 1 weight 0.10000E+01 volume 0.13765E-02 ppm1 8.442 ppm2 1.343 CV 1
OR { 793}
(( segid " " and resid 440 and name H ))
(( segid " " and resid 440 and name HG3 ))
ASSI { 132}
(( segid " " and resid 293 and name HE ))
(( segid " " and resid 293 and name HD3 ))
3.200 1.300 1.300 peak 132 spectrum 1 weight 0.10000E+01 volume 0.90290E-03 ppm1 7.797 ppm2 3.117 CV 1
OR { 132}
(( segid " " and resid 293 and name HE ))
(( segid " " and resid 293 and name HD2 ))
ASSI { 3099}
(( segid " " and resid 328 and name H ))
( segid " " and resid 225 and name HE% )
3.600 1.600 1.600 peak 3099 spectrum 1 weight 0.10000E+01 volume 0.10723E-02 ppm1 7.188 ppm2 1.929 CV 1
ASSI { 1583}
(( segid " " and resid 297 and name H ))
(( segid " " and resid 296 and name HB2 ))
3.700 1.700 1.700 peak 1583 spectrum 1 weight 0.10000E+01 volume 0.20503E-02 ppm1 8.071 ppm2 2.119 CV 1
ASSI { 3060}
(( segid " " and resid 259 and name H ))
( segid " " and resid 263 and name HG1%)
4.100 2.100 1.900 peak 3060 spectrum 1 weight 0.10000E+01 volume 0.82012E-03 ppm1 8.458 ppm2 0.077 CV 1
ASSI { 2706}
(( segid " " and resid 190 and name H ))
(( segid " " and resid 189 and name HG12))
5.700 4.000 0.300 peak 2706 spectrum 1 weight 0.10000E+01 volume 0.19636E-03 ppm1 10.632 ppm2 1.756 CV 1
ASSI { 1791}
(( segid " " and resid 331 and name H ))
(( segid " " and resid 328 and name HA ))
3.400 1.500 1.500 peak 1791 spectrum 1 weight 0.10000E+01 volume 0.64493E-03 ppm1 7.181 ppm2 3.454 CV 1
ASSI { 1109}
(( segid " " and resid 293 and name H ))
(( segid " " and resid 299 and name HE3 ))
4.300 2.400 1.700 peak 1109 spectrum 1 weight 0.10000E+01 volume 0.41200E-03 ppm1 6.999 ppm2 2.560 CV 1
ASSI { 2162}
(( segid " " and resid 320 and name HE1 ))
(( segid " " and resid 316 and name HA ))
4.100 2.100 1.900 peak 2162 spectrum 1 weight 0.10000E+01 volume 0.73924E-03 ppm1 10.126 ppm2 3.580 CV 1
ASSI { 1900}
(( segid " " and resid 270 and name H ))
(( segid " " and resid 269 and name HA ))
3.800 1.800 1.800 peak 1900 spectrum 1 weight 0.10000E+01 volume 0.56021E-03 ppm1 8.540 ppm2 3.806 CV 1
ASSI { 1842}
(( segid " " and resid 316 and name H ))
(( segid " " and resid 314 and name H ))
4.500 2.500 1.500 peak 1842 spectrum 1 weight 0.10000E+01 volume 0.40812E-03 ppm1 8.716 ppm2 7.338 CV 1
ASSI { 3184}
(( segid " " and resid 368 and name H ))
(( segid " " and resid 366 and name HB2 ))
2.800 2.800 3.200 peak 3184 spectrum 1 weight 0.10000E+01 volume 0.79509E-03 ppm1 8.214 ppm2 1.887 CV 1
OR { 3184}
(( segid " " and resid 368 and name H ))
(( segid " " and resid 366 and name HB3 ))
ASSI { 3165}
(( segid " " and resid 212 and name H ))
(( segid " " and resid 213 and name HB3 ))
6.000 4.400 0.000 peak 3165 spectrum 1 weight 0.10000E+01 volume 0.18096E-03 ppm1 9.085 ppm2 2.732 CV 1
ASSI { 2315}
(( segid " " and resid 273 and name H ))
( segid " " and resid 190 and name HD% )
4.800 2.800 1.200 peak 2315 spectrum 1 weight 0.10000E+01 volume 0.68728E-03 ppm1 7.703 ppm2 7.872 CV 1
ASSI { 1386}
(( segid " " and resid 257 and name H ))
(( segid " " and resid 255 and name HB3 ))
4.600 2.600 1.400 peak 1386 spectrum 1 weight 0.10000E+01 volume 0.49284E-03 ppm1 7.436 ppm2 1.089 CV 1
ASSI { 53}
(( segid " " and resid 253 and name H ))
(( segid " " and resid 254 and name HB3 ))
5.600 3.900 0.400 peak 53 spectrum 1 weight 0.10000E+01 volume 0.31958E-03 ppm1 8.255 ppm2 2.972 CV 1
ASSI { 2131}
(( segid " " and resid 320 and name HE1 ))
(( segid " " and resid 320 and name HD1 ))
2.400 0.700 0.700 peak 2131 spectrum 1 weight 0.10000E+01 volume 0.65896E-02 ppm1 10.126 ppm2 7.259 CV 1
ASSI { 3047}
(( segid " " and resid 370 and name HD21))
( segid " " and resid 371 and name HG2%)
4.000 2.000 2.000 peak 3047 spectrum 1 weight 0.10000E+01 volume 0.41968E-03 ppm1 6.834 ppm2 0.973 CV 1
ASSI { 3095}
(( segid " " and resid 271 and name H ))
(( segid " " and resid 271 and name HB2 ))
3.100 1.200 1.200 peak 3095 spectrum 1 weight 0.10000E+01 volume 0.71037E-03 ppm1 7.674 ppm2 1.264 CV 1
ASSI { 2684}
(( segid " " and resid 214 and name H ))
(( segid " " and resid 213 and name HB3 ))
2.600 0.900 0.900 peak 2684 spectrum 1 weight 0.10000E+01 volume 0.10261E-02 ppm1 7.188 ppm2 2.718 CV 1
ASSI { 250}
(( segid " " and resid 255 and name H ))
(( segid " " and resid 255 and name HB3 ))
4.000 2.000 2.000 peak 250 spectrum 1 weight 0.10000E+01 volume 0.93177E-03 ppm1 8.612 ppm2 1.063 CV 1
ASSI { 1996}
(( segid " " and resid 280 and name H ))
( segid " " and resid 279 and name HD2%)
4.700 2.800 1.300 peak 1996 spectrum 1 weight 0.10000E+01 volume 0.59103E-03 ppm1 7.651 ppm2 0.377 CV 1
ASSI { 1554}
(( segid " " and resid 218 and name H ))
(( segid " " and resid 217 and name HB ))
2.900 1.000 1.000 peak 1554 spectrum 1 weight 0.10000E+01 volume 0.15613E-02 ppm1 7.977 ppm2 1.649 CV 1
ASSI { 817}
(( segid " " and resid 422 and name H ))
(( segid " " and resid 426 and name HG2 ))
4.500 2.500 1.500 peak 817 spectrum 1 weight 0.10000E+01 volume 0.53902E-03 ppm1 8.209 ppm2 2.270 CV 1
ASSI { 1245}
(( segid " " and resid 409 and name H ))
(( segid " " and resid 409 and name HA ))
3.300 1.300 1.300 peak 1245 spectrum 1 weight 0.10000E+01 volume 0.97796E-03 ppm1 8.734 ppm2 3.689 CV 1
ASSI { 2091}
(( segid " " and resid 290 and name H ))
( segid " " and resid 290 and name HB% )
2.200 0.600 0.600 peak 2091 spectrum 1 weight 0.10000E+01 volume 0.66129E-02 ppm1 7.820 ppm2 1.540 CV 1
ASSI { 2704}
(( segid " " and resid 240 and name H ))
(( segid " " and resid 240 and name HB ))
2.700 0.900 0.900 peak 2704 spectrum 1 weight 0.10000E+01 volume 0.24103E-02 ppm1 8.016 ppm2 2.194 CV 1
ASSI { 949}
(( segid " " and resid 410 and name HD21))
(( segid " " and resid 409 and name HG ))
5.700 4.000 0.300 peak 949 spectrum 1 weight 0.10000E+01 volume 0.29262E-03 ppm1 6.917 ppm2 1.398 CV 1
ASSI { 875}
(( segid " " and resid 443 and name H ))
( segid " " and resid 398 and name HD1%)
3.500 1.500 1.500 peak 875 spectrum 1 weight 0.10000E+01 volume 0.12571E-02 ppm1 7.651 ppm2 0.571 CV 1
ASSI { 2285}
(( segid " " and resid 423 and name H ))
(( segid " " and resid 425 and name H ))
5.000 3.100 1.000 peak 2285 spectrum 1 weight 0.10000E+01 volume 0.24257E-03 ppm1 8.682 ppm2 7.744 CV 1
ASSI { 2439}
(( segid " " and resid 430 and name H ))
(( segid " " and resid 430 and name HA ))
3.000 1.100 1.100 peak 2439 spectrum 1 weight 0.10000E+01 volume 0.16171E-02 ppm1 7.759 ppm2 4.409 CV 1
ASSI { 2350}
(( segid " " and resid 344 and name H ))
(( segid " " and resid 341 and name HA ))
3.200 1.300 1.300 peak 2350 spectrum 1 weight 0.10000E+01 volume 0.11821E-02 ppm1 7.703 ppm2 4.415 CV 1
ASSI { 1166}
(( segid " " and resid 261 and name HD22))
(( segid " " and resid 261 and name HB2 ))
4.100 2.100 1.900 peak 1166 spectrum 1 weight 0.10000E+01 volume 0.12976E-02 ppm1 6.626 ppm2 2.269 CV 1
ASSI { 1624}
(( segid " " and resid 245 and name H ))
(( segid " " and resid 244 and name HG2 ))
4.000 2.000 2.000 peak 1624 spectrum 1 weight 0.10000E+01 volume 0.85093E-03 ppm1 7.532 ppm2 0.418 CV 1
ASSI { 2745}
(( segid " " and resid 300 and name H ))
( segid " " and resid 359 and name HG2%)
4.900 3.000 1.100 peak 2745 spectrum 1 weight 0.10000E+01 volume 0.33498E-03 ppm1 7.917 ppm2 -0.459 CV 1
ASSI { 610}
(( segid " " and resid 427 and name H ))
( segid " " and resid 423 and name HD1%)
4.000 2.000 2.000 peak 610 spectrum 1 weight 0.10000E+01 volume 0.11532E-02 ppm1 8.060 ppm2 0.864 CV 1
OR { 610}
(( segid " " and resid 427 and name H ))
( segid " " and resid 423 and name HD2%)
ASSI { 1404}
(( segid " " and resid 313 and name H ))
(( segid " " and resid 312 and name HG2 ))
4.100 2.100 1.900 peak 1404 spectrum 1 weight 0.10000E+01 volume 0.87787E-03 ppm1 8.626 ppm2 2.356 CV 1
ASSI { 2779}
(( segid " " and resid 375 and name H ))
(( segid " " and resid 320 and name HH2 ))
3.200 3.200 2.800 peak 2779 spectrum 1 weight 0.10000E+01 volume 0.33305E-03 ppm1 8.481 ppm2 7.145 CV 1
ASSI { 2321}
(( segid " " and resid 313 and name H ))
(( segid " " and resid 313 and name HA ))
2.800 0.900 0.900 peak 2321 spectrum 1 weight 0.10000E+01 volume 0.26490E-02 ppm1 8.626 ppm2 4.405 CV 1
ASSI { 2924}
(( segid " " and resid 200 and name H ))
(( segid " " and resid 200 and name HD2 ))
5.200 3.400 0.800 peak 2924 spectrum 1 weight 0.10000E+01 volume 0.42931E-03 ppm1 7.602 ppm2 3.256 CV 1
OR { 2924}
(( segid " " and resid 200 and name H ))
(( segid " " and resid 200 and name HD3 ))
ASSI { 1258}
(( segid " " and resid 248 and name H ))
(( segid " " and resid 248 and name HA ))
3.400 1.400 1.400 peak 1258 spectrum 1 weight 0.10000E+01 volume 0.10280E-02 ppm1 8.880 ppm2 4.866 CV 1
ASSI { 2933}
(( segid " " and resid 327 and name H ))
(( segid " " and resid 326 and name HB3 ))
2.800 1.000 1.000 peak 2933 spectrum 1 weight 0.10000E+01 volume 0.12436E-02 ppm1 7.614 ppm2 2.687 CV 1
ASSI { 3036}
(( segid " " and resid 396 and name H ))
(( segid " " and resid 394 and name HB ))
3.700 1.700 1.700 peak 3036 spectrum 1 weight 0.10000E+01 volume 0.15536E-02 ppm1 8.690 ppm2 4.581 CV 1
OR { 3036}
(( segid " " and resid 396 and name H ))
(( segid " " and resid 394 and name HA ))
ASSI { 2166}
(( segid " " and resid 381 and name H ))
(( segid " " and resid 380 and name HB3 ))
3.300 1.400 1.400 peak 2166 spectrum 1 weight 0.10000E+01 volume 0.16114E-02 ppm1 8.201 ppm2 1.452 CV 1
ASSI { 1429}
(( segid " " and resid 368 and name H ))
(( segid " " and resid 367 and name HB2 ))
3.000 1.100 1.100 peak 1429 spectrum 1 weight 0.10000E+01 volume 0.15536E-02 ppm1 8.215 ppm2 1.007 CV 1
ASSI { 2438}
(( segid " " and resid 242 and name H ))
(( segid " " and resid 241 and name HB2 ))
3.400 1.400 1.400 peak 2438 spectrum 1 weight 0.10000E+01 volume 0.19117E-02 ppm1 7.548 ppm2 2.463 CV 1
ASSI { 2378}
(( segid " " and resid 287 and name H ))
( segid " " and resid 287 and name HE% )
5.300 3.500 0.700 peak 2378 spectrum 1 weight 0.10000E+01 volume 0.52556E-03 ppm1 8.019 ppm2 6.963 CV 1
ASSI { 3129}
(( segid " " and resid 254 and name HD21))
(( segid " " and resid 254 and name H ))
4.200 2.200 1.800 peak 3129 spectrum 1 weight 0.10000E+01 volume 0.85093E-03 ppm1 7.496 ppm2 8.702 CV 1
ASSI { 862}
(( segid " " and resid 252 and name H ))
(( segid " " and resid 251 and name HB2 ))
3.600 1.600 1.600 peak 862 spectrum 1 weight 0.10000E+01 volume 0.20175E-02 ppm1 8.427 ppm2 1.764 CV 1
ASSI { 1115}
(( segid " " and resid 353 and name H ))
(( segid " " and resid 352 and name H ))
4.300 2.300 1.700 peak 1115 spectrum 1 weight 0.10000E+01 volume 0.70074E-03 ppm1 8.954 ppm2 7.063 CV 1
ASSI { 2556}
(( segid " " and resid 340 and name HE22))
(( segid " " and resid 340 and name HB2 ))
5.700 4.000 0.300 peak 2556 spectrum 1 weight 0.10000E+01 volume 0.87402E-03 ppm1 7.418 ppm2 1.939 CV 1
ASSI { 2818}
(( segid " " and resid 282 and name H ))
(( segid " " and resid 282 and name HB3 ))
3.300 1.400 1.400 peak 2818 spectrum 1 weight 0.10000E+01 volume 0.36634E-02 ppm1 8.701 ppm2 2.064 CV 1
ASSI { 606}
(( segid " " and resid 375 and name HE22))
(( segid " " and resid 378 and name HB3 ))
4.700 2.700 1.300 peak 606 spectrum 1 weight 0.10000E+01 volume 0.36194E-03 ppm1 7.507 ppm2 1.610 CV 1
OR { 606}
(( segid " " and resid 375 and name HE22))
(( segid " " and resid 378 and name HB2 ))
OR { 606}
(( segid " " and resid 375 and name HE22))
(( segid " " and resid 378 and name HD2 ))
OR { 606}
(( segid " " and resid 375 and name HE22))
(( segid " " and resid 378 and name HD3 ))
ASSI { 2076}
(( segid " " and resid 189 and name H ))
(( segid " " and resid 189 and name HA ))
3.900 1.900 1.900 peak 2076 spectrum 1 weight 0.10000E+01 volume 0.23487E-03 ppm1 8.862 ppm2 4.383 CV 1
ASSI { 1868}
(( segid " " and resid 231 and name H ))
(( segid " " and resid 231 and name HB3 ))
4.500 2.600 1.500 peak 1868 spectrum 1 weight 0.10000E+01 volume 0.30417E-03 ppm1 8.444 ppm2 2.818 CV 1
OR { 1868}
(( segid " " and resid 231 and name H ))
(( segid " " and resid 231 and name HB2 ))
ASSI { 1634}
(( segid " " and resid 313 and name H ))
(( segid " " and resid 312 and name HA ))
3.400 1.400 1.400 peak 1634 spectrum 1 weight 0.10000E+01 volume 0.15343E-02 ppm1 8.625 ppm2 4.054 CV 1
ASSI { 2516}
(( segid " " and resid 395 and name HE21))
(( segid " " and resid 395 and name H ))
5.200 3.300 0.800 peak 2516 spectrum 1 weight 0.10000E+01 volume 0.41006E-03 ppm1 7.771 ppm2 9.085 CV 1
ASSI { 1193}
(( segid " " and resid 185 and name H ))
(( segid " " and resid 184 and name HB3 ))
4.600 2.600 1.400 peak 1193 spectrum 1 weight 0.10000E+01 volume 0.77006E-03 ppm1 8.458 ppm2 1.827 CV 1
ASSI { 2171}
(( segid " " and resid 299 and name H ))
( segid " " and resid 300 and name HG1%)
4.400 2.400 1.600 peak 2171 spectrum 1 weight 0.10000E+01 volume 0.10396E-02 ppm1 7.503 ppm2 0.098 CV 1
ASSI { 1029}
(( segid " " and resid 336 and name H ))
(( segid " " and resid 336 and name HB3 ))
4.000 2.000 2.000 peak 1029 spectrum 1 weight 0.10000E+01 volume 0.12494E-02 ppm1 9.126 ppm2 1.994 CV 1
OR { 1029}
(( segid " " and resid 336 and name H ))
(( segid " " and resid 336 and name HB2 ))
ASSI { 2666}
(( segid " " and resid 304 and name HE22))
( segid " " and resid 300 and name HG2%)
3.500 1.500 1.500 peak 2666 spectrum 1 weight 0.10000E+01 volume 0.21292E-02 ppm1 7.014 ppm2 0.544 CV 1
ASSI { 2535}
(( segid " " and resid 239 and name H ))
(( segid " " and resid 239 and name HB2 ))
3.000 1.100 1.100 peak 2535 spectrum 1 weight 0.10000E+01 volume 0.10203E-02 ppm1 7.095 ppm2 1.879 CV 1
ASSI { 2010}
(( segid " " and resid 297 and name H ))
(( segid " " and resid 296 and name HB3 ))
2.600 0.800 0.800 peak 2010 spectrum 1 weight 0.10000E+01 volume 0.23314E-02 ppm1 8.073 ppm2 1.982 CV 1
ASSI { 2032}
(( segid " " and resid 310 and name H ))
( segid " " and resid 310 and name HD2%)
3.200 1.300 1.300 peak 2032 spectrum 1 weight 0.10000E+01 volume 0.42681E-02 ppm1 7.065 ppm2 1.090 CV 1
OR { 2032}
(( segid " " and resid 310 and name H ))
( segid " " and resid 310 and name HD1%)
ASSI { 387}
(( segid " " and resid 371 and name H ))
( segid " " and resid 368 and name HD% )
5.200 3.400 0.800 peak 387 spectrum 1 weight 0.10000E+01 volume 0.63147E-03 ppm1 7.541 ppm2 7.181 CV 1
ASSI { 2312}
(( segid " " and resid 378 and name H ))
(( segid " " and resid 379 and name HD3 ))
4.500 2.500 1.500 peak 2312 spectrum 1 weight 0.10000E+01 volume 0.69884E-03 ppm1 8.585 ppm2 3.862 CV 1
ASSI { 1813}
(( segid " " and resid 430 and name HE1 ))
(( segid " " and resid 430 and name HE3 ))
4.800 2.900 1.200 peak 1813 spectrum 1 weight 0.10000E+01 volume 0.38309E-03 ppm1 10.081 ppm2 7.581 CV 1
ASSI { 2277}
(( segid " " and resid 202 and name H ))
( segid " " and resid 201 and name HG2%)
4.500 2.600 1.500 peak 2277 spectrum 1 weight 0.10000E+01 volume 0.10627E-02 ppm1 8.207 ppm2 1.314 CV 1
ASSI { 1846}
(( segid " " and resid 429 and name H ))
(( segid " " and resid 429 and name HB2 ))
2.700 0.900 0.900 peak 1846 spectrum 1 weight 0.10000E+01 volume 0.16248E-02 ppm1 8.119 ppm2 1.423 CV 1
OR { 1846}
(( segid " " and resid 429 and name H ))
(( segid " " and resid 429 and name HG ))
ASSI { 1467}
(( segid " " and resid 370 and name HD22))
( segid " " and resid 371 and name HG2%)
4.700 2.700 1.300 peak 1467 spectrum 1 weight 0.10000E+01 volume 0.33305E-03 ppm1 7.521 ppm2 0.970 CV 1
ASSI { 2857}
(( segid " " and resid 277 and name HD21))
(( segid " " and resid 277 and name HB3 ))
2.500 0.800 0.800 peak 2857 spectrum 1 weight 0.10000E+01 volume 0.11166E-02 ppm1 7.675 ppm2 1.980 CV 1
ASSI { 1098}
(( segid " " and resid 362 and name H ))
( segid " " and resid 359 and name HG2%)
5.500 3.700 0.500 peak 1098 spectrum 1 weight 0.10000E+01 volume 0.22909E-03 ppm1 7.792 ppm2 -0.458 CV 1
ASSI { 2782}
(( segid " " and resid 333 and name H ))
(( segid " " and resid 332 and name HA ))
3.200 1.300 1.300 peak 2782 spectrum 1 weight 0.10000E+01 volume 0.11917E-02 ppm1 8.643 ppm2 4.188 CV 1
ASSI { 1581}
(( segid " " and resid 187 and name H ))
(( segid " " and resid 187 and name HE3 ))
5.100 3.300 0.900 peak 1581 spectrum 1 weight 0.10000E+01 volume 0.49090E-03 ppm1 8.520 ppm2 2.919 CV 1
OR { 1581}
(( segid " " and resid 187 and name H ))
(( segid " " and resid 187 and name HE2 ))
ASSI { 1200}
(( segid " " and resid 437 and name H ))
(( segid " " and resid 436 and name HB3 ))
2.800 1.000 1.000 peak 1200 spectrum 1 weight 0.10000E+01 volume 0.12629E-02 ppm1 8.215 ppm2 2.006 CV 1
ASSI { 1978}
(( segid " " and resid 397 and name H ))
(( segid " " and resid 394 and name HB ))
3.700 1.700 1.700 peak 1978 spectrum 1 weight 0.10000E+01 volume 0.65456E-03 ppm1 8.082 ppm2 4.565 CV 1
ASSI { 1025}
(( segid " " and resid 338 and name H ))
(( segid " " and resid 338 and name HB3 ))
3.600 1.600 1.600 peak 1025 spectrum 1 weight 0.10000E+01 volume 0.44856E-03 ppm1 7.705 ppm2 3.082 CV 1
ASSI { 2560}
(( segid " " and resid 321 and name H ))
(( segid " " and resid 321 and name HB3 ))
2.900 1.100 1.100 peak 2560 spectrum 1 weight 0.10000E+01 volume 0.10376E-02 ppm1 8.586 ppm2 1.601 CV 1
ASSI { 733}
(( segid " " and resid 435 and name H ))
(( segid " " and resid 436 and name HB2 ))
5.000 3.100 1.000 peak 733 spectrum 1 weight 0.10000E+01 volume 0.44087E-03 ppm1 8.195 ppm2 1.448 CV 1
ASSI { 2111}
(( segid " " and resid 214 and name H ))
(( segid " " and resid 214 and name HB3 ))
4.300 2.300 1.700 peak 2111 spectrum 1 weight 0.10000E+01 volume 0.46975E-03 ppm1 7.180 ppm2 2.013 CV 1
ASSI { 1652}
(( segid " " and resid 280 and name H ))
(( segid " " and resid 276 and name HG2 ))
4.500 2.600 1.500 peak 1652 spectrum 1 weight 0.10000E+01 volume 0.38887E-03 ppm1 7.652 ppm2 2.338 CV 1
ASSI { 1934}
(( segid " " and resid 252 and name H ))
(( segid " " and resid 252 and name HA ))
3.200 1.300 1.300 peak 1934 spectrum 1 weight 0.10000E+01 volume 0.15613E-02 ppm1 8.423 ppm2 4.349 CV 1
ASSI { 2369}
(( segid " " and resid 421 and name H ))
(( segid " " and resid 422 and name H ))
3.500 1.500 1.500 peak 2369 spectrum 1 weight 0.10000E+01 volume 0.16787E-02 ppm1 8.386 ppm2 8.203 CV 1
ASSI { 538}
(( segid " " and resid 256 and name H ))
(( segid " " and resid 256 and name HB2 ))
2.600 0.900 0.900 peak 538 spectrum 1 weight 0.10000E+01 volume 0.22505E-02 ppm1 8.257 ppm2 2.004 CV 1
ASSI { 1138}
(( segid " " and resid 354 and name HD21))
(( segid " " and resid 344 and name HB ))
5.700 4.100 0.300 peak 1138 spectrum 1 weight 0.10000E+01 volume 0.30995E-03 ppm1 7.464 ppm2 1.918 CV 1
ASSI { 3199}
(( segid " " and resid 219 and name H ))
(( segid " " and resid 218 and name HB3 ))
2.900 1.000 1.000 peak 3199 spectrum 1 weight 0.10000E+01 volume 0.12513E-02 ppm1 7.701 ppm2 2.546 CV 1
ASSI { 1983}
(( segid " " and resid 237 and name H ))
(( segid " " and resid 237 and name HA ))
3.400 1.400 1.400 peak 1983 spectrum 1 weight 0.10000E+01 volume 0.81434E-03 ppm1 8.773 ppm2 3.772 CV 1
ASSI { 1977}
(( segid " " and resid 325 and name H ))
( segid " " and resid 361 and name HE% )
4.800 2.900 1.200 peak 1977 spectrum 1 weight 0.10000E+01 volume 0.73156E-03 ppm1 8.507 ppm2 7.078 CV 1
ASSI { 2047}
(( segid " " and resid 223 and name H ))
(( segid " " and resid 223 and name HB3 ))
4.100 2.100 1.900 peak 2047 spectrum 1 weight 0.10000E+01 volume 0.91831E-03 ppm1 8.421 ppm2 2.934 CV 1
ASSI { 1751}
(( segid " " and resid 312 and name H ))
(( segid " " and resid 312 and name HG2 ))
4.400 2.400 1.600 peak 1751 spectrum 1 weight 0.10000E+01 volume 0.10300E-02 ppm1 8.785 ppm2 2.360 CV 1
ASSI { 2181}
(( segid " " and resid 364 and name H ))
(( segid " " and resid 363 and name HA ))
3.100 1.200 1.200 peak 2181 spectrum 1 weight 0.10000E+01 volume 0.17345E-02 ppm1 7.562 ppm2 5.126 CV 1
ASSI { 1497}
(( segid " " and resid 196 and name H ))
(( segid " " and resid 196 and name HA ))
2.900 1.000 1.000 peak 1497 spectrum 1 weight 0.10000E+01 volume 0.24411E-02 ppm1 7.179 ppm2 4.394 CV 1
ASSI { 2342}
(( segid " " and resid 316 and name H ))
(( segid " " and resid 315 and name HB3 ))
2.800 1.000 1.000 peak 2342 spectrum 1 weight 0.10000E+01 volume 0.86824E-03 ppm1 8.714 ppm2 3.039 CV 1
ASSI { 1733}
(( segid " " and resid 268 and name H ))
(( segid " " and resid 268 and name HB2 ))
2.800 1.000 1.000 peak 1733 spectrum 1 weight 0.10000E+01 volume 0.26259E-02 ppm1 7.870 ppm2 1.865 CV 1
OR { 1733}
(( segid " " and resid 268 and name H ))
(( segid " " and resid 268 and name HB3 ))
ASSI { 2331}
(( segid " " and resid 301 and name HE22))
(( segid " " and resid 301 and name H ))
5.300 3.500 0.700 peak 2331 spectrum 1 weight 0.10000E+01 volume 0.82974E-03 ppm1 7.361 ppm2 8.074 CV 1
ASSI { 1368}
(( segid " " and resid 231 and name H ))
(( segid " " and resid 230 and name HG13))
2.700 0.900 0.900 peak 1368 spectrum 1 weight 0.10000E+01 volume 0.11994E-02 ppm1 8.444 ppm2 0.954 CV 1
OR { 1368}
(( segid " " and resid 231 and name H ))
( segid " " and resid 230 and name HG2%)
ASSI { 1446}
(( segid " " and resid 375 and name HE21))
(( segid " " and resid 375 and name HG3 ))
2.300 0.700 0.700 peak 1446 spectrum 1 weight 0.10000E+01 volume 0.61412E-02 ppm1 6.678 ppm2 2.290 CV 1
OR { 1446}
(( segid " " and resid 375 and name HE21))
(( segid " " and resid 375 and name HG2 ))
ASSI { 2650}
(( segid " " and resid 315 and name H ))
(( segid " " and resid 315 and name HB3 ))
3.000 1.100 1.100 peak 2650 spectrum 1 weight 0.10000E+01 volume 0.12302E-02 ppm1 8.315 ppm2 3.015 CV 1
ASSI { 2569}
(( segid " " and resid 323 and name H ))
(( segid " " and resid 322 and name HB ))
2.300 0.700 0.700 peak 2569 spectrum 1 weight 0.10000E+01 volume 0.11455E-02 ppm1 7.783 ppm2 1.353 CV 1
ASSI { 2942}
(( segid " " and resid 243 and name H ))
(( segid " " and resid 241 and name H ))
4.500 2.500 1.500 peak 2942 spectrum 1 weight 0.10000E+01 volume 0.41775E-03 ppm1 7.869 ppm2 8.377 CV 1
ASSI { 2614}
(( segid " " and resid 327 and name H ))
(( segid " " and resid 325 and name H ))
4.000 2.000 2.000 peak 2614 spectrum 1 weight 0.10000E+01 volume 0.70268E-03 ppm1 7.615 ppm2 8.495 CV 1
ASSI { 1782}
(( segid " " and resid 217 and name H ))
(( segid " " and resid 216 and name HB3 ))
3.200 1.300 1.300 peak 1782 spectrum 1 weight 0.10000E+01 volume 0.14150E-02 ppm1 7.489 ppm2 2.760 CV 1
ASSI { 962}
(( segid " " and resid 395 and name HE21))
(( segid " " and resid 443 and name HA ))
3.700 1.700 1.700 peak 962 spectrum 1 weight 0.10000E+01 volume 0.15363E-02 ppm1 7.772 ppm2 4.146 CV 1
ASSI { 1309}
(( segid " " and resid 313 and name H ))
(( segid " " and resid 208 and name HB2 ))
4.300 2.300 1.700 peak 1309 spectrum 1 weight 0.10000E+01 volume 0.98184E-03 ppm1 8.625 ppm2 1.346 CV 1
ASSI { 2157}
(( segid " " and resid 341 and name HD21))
(( segid " " and resid 341 and name HB2 ))
2.600 0.800 0.800 peak 2157 spectrum 1 weight 0.10000E+01 volume 0.23102E-02 ppm1 6.991 ppm2 2.816 CV 1
OR { 2157}
(( segid " " and resid 341 and name HD21))
(( segid " " and resid 341 and name HB3 ))
ASSI { 2483}
(( segid " " and resid 341 and name HD21))
(( segid " " and resid 337 and name HG3 ))
5.200 3.300 0.800 peak 2483 spectrum 1 weight 0.10000E+01 volume 0.32343E-03 ppm1 6.996 ppm2 1.984 CV 1
ASSI { 2725}
(( segid " " and resid 410 and name HD21))
(( segid " " and resid 407 and name HB2 ))
6.000 5.100 0.000 peak 2725 spectrum 1 weight 0.10000E+01 volume 0.25604E-03 ppm1 6.909 ppm2 3.243 CV 1
ASSI { 1896}
(( segid " " and resid 292 and name H ))
(( segid " " and resid 292 and name HA2 ))
2.900 1.000 1.000 peak 1896 spectrum 1 weight 0.10000E+01 volume 0.50959E-02 ppm1 7.809 ppm2 3.719 CV 1
ASSI { 1682}
(( segid " " and resid 329 and name H ))
(( segid " " and resid 328 and name HB ))
2.800 1.000 1.000 peak 1682 spectrum 1 weight 0.10000E+01 volume 0.10550E-02 ppm1 7.957 ppm2 2.402 CV 1
ASSI { 1767}
(( segid " " and resid 421 and name H ))
(( segid " " and resid 420 and name HG12))
4.700 2.800 1.300 peak 1767 spectrum 1 weight 0.10000E+01 volume 0.96065E-03 ppm1 8.385 ppm2 1.119 CV 1
ASSI { 2888}
(( segid " " and resid 265 and name H ))
( segid " " and resid 263 and name HG1%)
3.200 3.200 2.800 peak 2888 spectrum 1 weight 0.10000E+01 volume 0.34460E-03 ppm1 7.751 ppm2 0.074 CV 1
ASSI { 3062}
(( segid " " and resid 227 and name H ))
(( segid " " and resid 230 and name HB ))
3.600 1.700 1.700 peak 3062 spectrum 1 weight 0.10000E+01 volume 0.10454E-02 ppm1 7.130 ppm2 1.824 CV 1
ASSI { 2349}
(( segid " " and resid 253 and name H ))
(( segid " " and resid 252 and name H ))
4.400 2.400 1.600 peak 2349 spectrum 1 weight 0.10000E+01 volume 0.12687E-02 ppm1 8.254 ppm2 8.427 CV 1
ASSI { 2233}
(( segid " " and resid 259 and name H ))
(( segid " " and resid 259 and name HG3 ))
2.900 1.000 1.000 peak 2233 spectrum 1 weight 0.10000E+01 volume 0.29898E-02 ppm1 8.461 ppm2 2.406 CV 1
OR { 2233}
(( segid " " and resid 259 and name H ))
(( segid " " and resid 259 and name HG2 ))
ASSI { 2829}
(( segid " " and resid 249 and name H ))
(( segid " " and resid 248 and name HB2 ))
4.400 2.400 1.600 peak 2829 spectrum 1 weight 0.10000E+01 volume 0.84705E-03 ppm1 7.299 ppm2 2.519 CV 1
ASSI { 3042}
(( segid " " and resid 338 and name HD22))
(( segid " " and resid 338 and name HB3 ))
4.500 2.500 1.500 peak 3042 spectrum 1 weight 0.10000E+01 volume 0.82590E-03 ppm1 7.443 ppm2 3.103 CV 1
ASSI { 2413}
(( segid " " and resid 365 and name HE22))
(( segid " " and resid 365 and name HB3 ))
4.200 2.200 1.800 peak 2413 spectrum 1 weight 0.10000E+01 volume 0.15247E-02 ppm1 7.586 ppm2 2.014 CV 1
OR { 2413}
(( segid " " and resid 365 and name HE22))
(( segid " " and resid 365 and name HB2 ))
ASSI { 1127}
(( segid " " and resid 380 and name H ))
( segid " " and resid 380 and name HD1%)
4.600 2.600 1.400 peak 1127 spectrum 1 weight 0.10000E+01 volume 0.58524E-03 ppm1 9.051 ppm2 0.798 CV 1
OR { 1127}
(( segid " " and resid 380 and name H ))
( segid " " and resid 380 and name HD2%)
ASSI { 1308}
(( segid " " and resid 223 and name H ))
(( segid " " and resid 222 and name HA ))
3.700 1.700 1.700 peak 1308 spectrum 1 weight 0.10000E+01 volume 0.79509E-03 ppm1 8.422 ppm2 3.790 CV 1
ASSI { 2302}
(( segid " " and resid 332 and name H ))
(( segid " " and resid 335 and name HG1 ))
5.100 3.300 0.900 peak 2302 spectrum 1 weight 0.10000E+01 volume 0.38118E-03 ppm1 7.441 ppm2 3.571 CV 1
ASSI { 2041}
(( segid " " and resid 227 and name H ))
(( segid " " and resid 225 and name H ))
4.100 2.100 1.900 peak 2041 spectrum 1 weight 0.10000E+01 volume 0.78740E-03 ppm1 7.127 ppm2 7.793 CV 1
ASSI { 2946}
(( segid " " and resid 278 and name H ))
(( segid " " and resid 277 and name HB3 ))
2.900 1.100 1.100 peak 2946 spectrum 1 weight 0.10000E+01 volume 0.35230E-03 ppm1 10.071 ppm2 1.936 CV 1
ASSI { 1575}
(( segid " " and resid 378 and name H ))
(( segid " " and resid 377 and name H ))
4.700 2.800 1.300 peak 1575 spectrum 1 weight 0.10000E+01 volume 0.65646E-03 ppm1 8.584 ppm2 8.251 CV 1
ASSI { 1521}
(( segid " " and resid 326 and name H ))
(( segid " " and resid 325 and name HG2 ))
4.600 2.700 1.400 peak 1521 spectrum 1 weight 0.10000E+01 volume 0.88943E-03 ppm1 8.927 ppm2 2.413 CV 1
ASSI { 1933}
(( segid " " and resid 419 and name H ))
(( segid " " and resid 417 and name HB3 ))
3.700 1.700 1.700 peak 1933 spectrum 1 weight 0.10000E+01 volume 0.43893E-03 ppm1 7.959 ppm2 2.065 CV 1
ASSI { 1748}
(( segid " " and resid 270 and name H ))
(( segid " " and resid 270 and name HA ))
3.100 1.200 1.200 peak 1748 spectrum 1 weight 0.10000E+01 volume 0.10742E-02 ppm1 8.540 ppm2 3.664 CV 1
ASSI { 2327}
(( segid " " and resid 291 and name H ))
( segid " " and resid 290 and name HB% )
2.700 0.900 0.900 peak 2327 spectrum 1 weight 0.10000E+01 volume 0.32015E-02 ppm1 7.364 ppm2 1.536 CV 1
ASSI { 2546}
(( segid " " and resid 242 and name H ))
(( segid " " and resid 242 and name HA ))
2.700 0.900 0.900 peak 2546 spectrum 1 weight 0.10000E+01 volume 0.37540E-02 ppm1 7.547 ppm2 4.011 CV 1
ASSI { 1738}
(( segid " " and resid 382 and name HE1 ))
( segid " " and resid 386 and name HB% )
3.600 1.600 1.600 peak 1738 spectrum 1 weight 0.10000E+01 volume 0.14670E-02 ppm1 9.605 ppm2 1.473 CV 1
ASSI { 1513}
(( segid " " and resid 216 and name H ))
( segid " " and resid 212 and name HG2%)
4.400 2.400 1.600 peak 1513 spectrum 1 weight 0.10000E+01 volume 0.51978E-03 ppm1 7.637 ppm2 -0.159 CV 1
ASSI { 1234}
(( segid " " and resid 280 and name H ))
(( segid " " and resid 280 and name HA ))
2.300 0.600 0.600 peak 1234 spectrum 1 weight 0.10000E+01 volume 0.25450E-02 ppm1 7.655 ppm2 4.029 CV 1
ASSI { 1566}
(( segid " " and resid 185 and name H ))
(( segid " " and resid 184 and name HB2 ))
3.900 1.900 1.900 peak 1566 spectrum 1 weight 0.10000E+01 volume 0.69884E-03 ppm1 8.463 ppm2 2.220 CV 1
ASSI { 695}
(( segid " " and resid 243 and name H ))
(( segid " " and resid 243 and name HG ))
2.600 0.900 0.900 peak 695 spectrum 1 weight 0.10000E+01 volume 0.24257E-02 ppm1 7.864 ppm2 1.167 CV 1
OR { 695}
(( segid " " and resid 243 and name H ))
(( segid " " and resid 243 and name HB3 ))
ASSI { 2784}
(( segid " " and resid 422 and name H ))
(( segid " " and resid 422 and name HA ))
2.700 0.900 0.900 peak 2784 spectrum 1 weight 0.10000E+01 volume 0.29358E-02 ppm1 8.204 ppm2 4.594 CV 1
ASSI { 1182}
(( segid " " and resid 415 and name H ))
(( segid " " and resid 415 and name HB2 ))
2.800 0.900 0.900 peak 1182 spectrum 1 weight 0.10000E+01 volume 0.21985E-02 ppm1 7.996 ppm2 2.770 CV 1
ASSI { 1192}
(( segid " " and resid 371 and name H ))
( segid " " and resid 323 and name HG1%)
3.500 1.600 1.600 peak 1192 spectrum 1 weight 0.10000E+01 volume 0.27626E-02 ppm1 7.539 ppm2 0.779 CV 1
ASSI { 1906}
(( segid " " and resid 410 and name H ))
(( segid " " and resid 410 and name HB2 ))
3.700 1.700 1.700 peak 1906 spectrum 1 weight 0.10000E+01 volume 0.23564E-02 ppm1 7.899 ppm2 2.801 CV 1
ASSI { 2354}
(( segid " " and resid 264 and name H ))
(( segid " " and resid 263 and name HB ))
3.500 1.600 1.600 peak 2354 spectrum 1 weight 0.10000E+01 volume 0.14978E-02 ppm1 8.513 ppm2 1.562 CV 1
ASSI { 2753}
(( segid " " and resid 390 and name H ))
(( segid " " and resid 389 and name HB2 ))
3.200 1.300 1.300 peak 2753 spectrum 1 weight 0.10000E+01 volume 0.40294E-02 ppm1 8.064 ppm2 1.596 CV 1
ASSI { 1555}
(( segid " " and resid 382 and name HE1 ))
(( segid " " and resid 385 and name HG3 ))
5.100 3.300 0.900 peak 1555 spectrum 1 weight 0.10000E+01 volume 0.43509E-03 ppm1 9.598 ppm2 2.545 CV 1
ASSI { 466}
(( segid " " and resid 355 and name H ))
(( segid " " and resid 355 and name HD3 ))
4.600 2.600 1.400 peak 466 spectrum 1 weight 0.10000E+01 volume 0.64299E-03 ppm1 8.076 ppm2 3.144 CV 1
OR { 466}
(( segid " " and resid 355 and name H ))
(( segid " " and resid 355 and name HD2 ))
ASSI { 3185}
(( segid " " and resid 248 and name H ))
(( segid " " and resid 249 and name HB2 ))
5.500 3.800 0.500 peak 3185 spectrum 1 weight 0.10000E+01 volume 0.27530E-03 ppm1 8.886 ppm2 1.904 CV 1
ASSI { 1552}
(( segid " " and resid 194 and name H ))
(( segid " " and resid 193 and name HB3 ))
3.200 1.300 1.300 peak 1552 spectrum 1 weight 0.10000E+01 volume 0.14169E-02 ppm1 9.118 ppm2 1.660 CV 1
ASSI { 1753}
(( segid " " and resid 254 and name H ))
(( segid " " and resid 254 and name HB2 ))
3.200 1.300 1.300 peak 1753 spectrum 1 weight 0.10000E+01 volume 0.23814E-02 ppm1 8.709 ppm2 2.623 CV 1
ASSI { 2792}
(( segid " " and resid 223 and name H ))
( segid " " and resid 223 and name HD% )
3.200 1.300 1.300 peak 2792 spectrum 1 weight 0.10000E+01 volume 0.15305E-02 ppm1 8.424 ppm2 6.437 CV 1
ASSI { 313}
(( segid " " and resid 394 and name H ))
( segid " " and resid 398 and name HD1%)
3.400 1.500 1.500 peak 313 spectrum 1 weight 0.10000E+01 volume 0.14111E-02 ppm1 7.544 ppm2 0.579 CV 1
OR { 313}
(( segid " " and resid 394 and name H ))
(( segid " " and resid 398 and name HG12))
ASSI { 3163}
(( segid " " and resid 354 and name HD22))
(( segid " " and resid 354 and name HA ))
3.900 1.900 1.900 peak 3163 spectrum 1 weight 0.10000E+01 volume 0.10877E-02 ppm1 6.454 ppm2 4.176 CV 1
ASSI { 2808}
(( segid " " and resid 249 and name H ))
(( segid " " and resid 249 and name HD2 ))
4.600 2.700 1.400 peak 2808 spectrum 1 weight 0.10000E+01 volume 0.70268E-03 ppm1 7.299 ppm2 3.153 CV 1
ASSI { 2305}
(( segid " " and resid 238 and name H ))
(( segid " " and resid 236 and name HA ))
4.600 2.600 1.400 peak 2305 spectrum 1 weight 0.10000E+01 volume 0.58331E-03 ppm1 8.665 ppm2 3.987 CV 1
ASSI { 2044}
(( segid " " and resid 227 and name H ))
(( segid " " and resid 226 and name HB3 ))
3.700 1.700 1.700 peak 2044 spectrum 1 weight 0.10000E+01 volume 0.23005E-02 ppm1 7.130 ppm2 1.976 CV 1
ASSI { 2441}
(( segid " " and resid 254 and name HD21))
(( segid " " and resid 254 and name HB3 ))
2.500 2.500 3.500 peak 2441 spectrum 1 weight 0.10000E+01 volume 0.47147E-02 ppm1 7.496 ppm2 2.954 CV 1
ASSI { 128}
(( segid " " and resid 395 and name HE22))
(( segid " " and resid 443 and name HA ))
2.700 0.900 0.900 peak 128 spectrum 1 weight 0.10000E+01 volume 0.22351E-02 ppm1 6.979 ppm2 4.145 CV 1
ASSI { 1692}
(( segid " " and resid 297 and name H ))
(( segid " " and resid 297 and name HB ))
2.300 0.600 0.600 peak 1692 spectrum 1 weight 0.10000E+01 volume 0.48438E-02 ppm1 8.072 ppm2 3.950 CV 1
ASSI { 1485}
(( segid " " and resid 353 and name H ))
( segid " " and resid 352 and name HG2%)
2.400 0.700 0.700 peak 1485 spectrum 1 weight 0.10000E+01 volume 0.20330E-02 ppm1 8.951 ppm2 0.917 CV 1
ASSI { 2066}
(( segid " " and resid 413 and name H ))
(( segid " " and resid 413 and name HD2 ))
5.100 3.300 0.900 peak 2066 spectrum 1 weight 0.10000E+01 volume 0.52171E-03 ppm1 8.485 ppm2 6.859 CV 1
ASSI { 1728}
(( segid " " and resid 430 and name HE1 ))
(( segid " " and resid 430 and name H ))
4.600 2.700 1.400 peak 1728 spectrum 1 weight 0.10000E+01 volume 0.39465E-03 ppm1 10.082 ppm2 7.763 CV 1
ASSI { 2643}
(( segid " " and resid 201 and name H ))
( segid " " and resid 201 and name HG2%)
3.200 1.300 1.300 peak 2643 spectrum 1 weight 0.10000E+01 volume 0.15093E-02 ppm1 7.499 ppm2 1.306 CV 1
ASSI { 3140}
(( segid " " and resid 387 and name H ))
(( segid " " and resid 382 and name HD1 ))
5.600 3.900 0.400 peak 3140 spectrum 1 weight 0.10000E+01 volume 0.39465E-03 ppm1 7.972 ppm2 6.942 CV 1
ASSI { 1290}
(( segid " " and resid 321 and name H ))
(( segid " " and resid 322 and name HG12))
3.800 1.800 1.800 peak 1290 spectrum 1 weight 0.10000E+01 volume 0.11512E-02 ppm1 8.583 ppm2 1.397 CV 1
ASSI { 2150}
(( segid " " and resid 364 and name H ))
(( segid " " and resid 364 and name HB ))
2.200 0.600 0.600 peak 2150 spectrum 1 weight 0.10000E+01 volume 0.28319E-02 ppm1 7.561 ppm2 2.107 CV 1
ASSI { 1891}
(( segid " " and resid 370 and name H ))
(( segid " " and resid 369 and name HA3 ))
2.800 1.000 1.000 peak 1891 spectrum 1 weight 0.10000E+01 volume 0.20195E-02 ppm1 8.416 ppm2 3.995 CV 1
ASSI { 2383}
(( segid " " and resid 250 and name H ))
(( segid " " and resid 247 and name HA ))
3.600 1.600 1.600 peak 2383 spectrum 1 weight 0.10000E+01 volume 0.67381E-03 ppm1 8.056 ppm2 4.110 CV 1
ASSI { 1673}
(( segid " " and resid 273 and name H ))
(( segid " " and resid 273 and name HA ))
2.700 0.900 0.900 peak 1673 spectrum 1 weight 0.10000E+01 volume 0.38157E-02 ppm1 7.705 ppm2 4.442 CV 1
ASSI { 3179}
(( segid " " and resid 212 and name H ))
( segid " " and resid 211 and name HB% )
3.200 1.300 1.300 peak 3179 spectrum 1 weight 0.10000E+01 volume 0.11647E-02 ppm1 9.089 ppm2 1.697 CV 1
ASSI { 1958}
(( segid " " and resid 276 and name H ))
(( segid " " and resid 276 and name HA ))
2.500 0.800 0.800 peak 1958 spectrum 1 weight 0.10000E+01 volume 0.55348E-02 ppm1 6.947 ppm2 4.433 CV 1
ASSI { 1475}
(( segid " " and resid 244 and name H ))
(( segid " " and resid 243 and name HB2 ))
2.900 1.100 1.100 peak 1475 spectrum 1 weight 0.10000E+01 volume 0.58331E-03 ppm1 8.560 ppm2 1.789 CV 1
ASSI { 2190}
(( segid " " and resid 247 and name H ))
(( segid " " and resid 247 and name HB2 ))
3.000 1.100 1.100 peak 2190 spectrum 1 weight 0.10000E+01 volume 0.13052E-02 ppm1 8.433 ppm2 3.025 CV 1
OR { 2190}
(( segid " " and resid 247 and name H ))
(( segid " " and resid 247 and name HB3 ))
ASSI { 2319}
(( segid " " and resid 244 and name H ))
(( segid " " and resid 244 and name HA ))
3.000 1.100 1.100 peak 2319 spectrum 1 weight 0.10000E+01 volume 0.10973E-02 ppm1 8.561 ppm2 3.284 CV 1
ASSI { 3070}
(( segid " " and resid 204 and name H ))
(( segid " " and resid 203 and name HA ))
3.800 1.800 1.800 peak 3070 spectrum 1 weight 0.10000E+01 volume 0.72193E-03 ppm1 8.137 ppm2 4.503 CV 1
ASSI { 3020}
(( segid " " and resid 259 and name H ))
(( segid " " and resid 260 and name HD2 ))
4.400 2.400 1.600 peak 3020 spectrum 1 weight 0.10000E+01 volume 0.13110E-02 ppm1 8.459 ppm2 3.980 CV 1
ASSI { 2893}
(( segid " " and resid 420 and name H ))
( segid " " and resid 420 and name HG2%)
3.600 1.600 1.600 peak 2893 spectrum 1 weight 0.10000E+01 volume 0.63030E-02 ppm1 7.494 ppm2 0.807 CV 1
OR { 2893}
(( segid " " and resid 420 and name H ))
( segid " " and resid 420 and name HD1%)
ASSI { 1399}
(( segid " " and resid 254 and name H ))
(( segid " " and resid 253 and name HA ))
2.300 0.700 0.700 peak 1399 spectrum 1 weight 0.10000E+01 volume 0.51727E-02 ppm1 8.707 ppm2 4.165 CV 1
ASSI { 3016}
(( segid " " and resid 259 and name H ))
(( segid " " and resid 258 and name H ))
4.600 2.600 1.400 peak 3016 spectrum 1 weight 0.10000E+01 volume 0.84131E-03 ppm1 8.463 ppm2 8.145 CV 1
ASSI { 2912}
(( segid " " and resid 397 and name H ))
(( segid " " and resid 396 and name HA ))
3.800 1.800 1.800 peak 2912 spectrum 1 weight 0.10000E+01 volume 0.96449E-03 ppm1 8.079 ppm2 4.005 CV 1
ASSI { 2588}
(( segid " " and resid 192 and name H ))
(( segid " " and resid 192 and name HB ))
4.100 2.100 1.900 peak 2588 spectrum 1 weight 0.10000E+01 volume 0.66224E-03 ppm1 6.708 ppm2 2.205 CV 1
ASSI { 3190}
(( segid " " and resid 218 and name H ))
(( segid " " and resid 218 and name HB2 ))
3.000 1.100 1.100 peak 3190 spectrum 1 weight 0.10000E+01 volume 0.20291E-02 ppm1 7.976 ppm2 2.735 CV 1
ASSI { 1369}
(( segid " " and resid 360 and name H ))
( segid " " and resid 360 and name HD% )
3.700 1.700 1.700 peak 1369 spectrum 1 weight 0.10000E+01 volume 0.23660E-02 ppm1 7.279 ppm2 7.097 CV 1
ASSI { 112}
(( segid " " and resid 438 and name H ))
(( segid " " and resid 442 and name HG3 ))
4.200 2.200 1.800 peak 112 spectrum 1 weight 0.10000E+01 volume 0.57756E-03 ppm1 7.569 ppm2 1.437 CV 1
ASSI { 1725}
(( segid " " and resid 354 and name HD22))
(( segid " " and resid 344 and name HB ))
5.300 3.500 0.700 peak 1725 spectrum 1 weight 0.10000E+01 volume 0.34268E-03 ppm1 6.455 ppm2 1.921 CV 1
ASSI { 1117}
(( segid " " and resid 403 and name H ))
(( segid " " and resid 403 and name HA ))
2.500 0.800 0.800 peak 1117 spectrum 1 weight 0.10000E+01 volume 0.54118E-02 ppm1 7.553 ppm2 4.082 CV 1
ASSI { 2860}
(( segid " " and resid 229 and name H ))
( segid " " and resid 230 and name HG2%)
4.400 2.400 1.600 peak 2860 spectrum 1 weight 0.10000E+01 volume 0.77584E-03 ppm1 9.620 ppm2 0.954 CV 1
ASSI { 3096}
(( segid " " and resid 223 and name H ))
( segid " " and resid 223 and name HE% )
4.800 2.800 1.200 peak 3096 spectrum 1 weight 0.10000E+01 volume 0.66996E-03 ppm1 8.424 ppm2 6.652 CV 1
ASSI { 2108}
(( segid " " and resid 222 and name H ))
( segid " " and resid 223 and name HE% )
6.000 4.800 0.000 peak 2108 spectrum 1 weight 0.10000E+01 volume 0.40428E-03 ppm1 7.248 ppm2 6.655 CV 1
ASSI { 2813}
(( segid " " and resid 424 and name H ))
( segid " " and resid 423 and name HD1%)
4.200 2.200 1.800 peak 2813 spectrum 1 weight 0.10000E+01 volume 0.15132E-02 ppm1 8.280 ppm2 0.852 CV 1
OR { 2813}
(( segid " " and resid 424 and name H ))
( segid " " and resid 423 and name HD2%)
ASSI { 1810}
(( segid " " and resid 369 and name H ))
( segid " " and resid 323 and name HG1%)
4.200 2.200 1.800 peak 1810 spectrum 1 weight 0.10000E+01 volume 0.73540E-03 ppm1 7.756 ppm2 0.780 CV 1
ASSI { 2998}
(( segid " " and resid 272 and name H ))
(( segid " " and resid 272 and name HA ))
2.800 1.000 1.000 peak 2998 spectrum 1 weight 0.10000E+01 volume 0.28492E-02 ppm1 8.505 ppm2 4.273 CV 1
ASSI { 2372}
(( segid " " and resid 375 and name HE22))
(( segid " " and resid 375 and name H ))
2.900 2.900 3.100 peak 2372 spectrum 1 weight 0.10000E+01 volume 0.55637E-03 ppm1 7.505 ppm2 8.485 CV 1
ASSI { 2897}
(( segid " " and resid 325 and name H ))
(( segid " " and resid 325 and name HG3 ))
4.300 2.400 1.700 peak 2897 spectrum 1 weight 0.10000E+01 volume 0.11821E-02 ppm1 8.510 ppm2 2.708 CV 1
ASSI { 2832}
(( segid " " and resid 320 and name H ))
(( segid " " and resid 316 and name HA ))
4.400 2.400 1.600 peak 2832 spectrum 1 weight 0.10000E+01 volume 0.36772E-03 ppm1 8.417 ppm2 3.588 CV 1
ASSI { 1176}
(( segid " " and resid 248 and name H ))
( segid " " and resid 189 and name HG2%)
3.100 3.100 2.900 peak 1176 spectrum 1 weight 0.10000E+01 volume 0.42931E-03 ppm1 8.880 ppm2 0.940 CV 1
ASSI { 532}
(( segid " " and resid 359 and name H ))
(( segid " " and resid 358 and name HB3 ))
2.300 0.700 0.700 peak 532 spectrum 1 weight 0.10000E+01 volume 0.15536E-02 ppm1 7.198 ppm2 2.949 CV 1
ASSI { 2462}
(( segid " " and resid 307 and name H ))
( segid " " and resid 306 and name HD2%)
4.600 2.700 1.400 peak 2462 spectrum 1 weight 0.10000E+01 volume 0.58331E-03 ppm1 8.735 ppm2 -0.340 CV 1
ASSI { 669}
(( segid " " and resid 292 and name H ))
( segid " " and resid 303 and name HE% )
5.300 3.500 0.700 peak 669 spectrum 1 weight 0.10000E+01 volume 0.32343E-03 ppm1 7.810 ppm2 6.816 CV 1
ASSI { 70}
(( segid " " and resid 390 and name H ))
(( segid " " and resid 389 and name HB3 ))
3.400 1.500 1.500 peak 70 spectrum 1 weight 0.10000E+01 volume 0.41235E-02 ppm1 8.060 ppm2 2.054 CV 1
ASSI { 666}
(( segid " " and resid 267 and name H ))
(( segid " " and resid 263 and name HA ))
4.100 2.100 1.900 peak 666 spectrum 1 weight 0.10000E+01 volume 0.51593E-03 ppm1 8.064 ppm2 3.168 CV 1
ASSI { 3081}
(( segid " " and resid 344 and name H ))
(( segid " " and resid 343 and name HG ))
4.300 2.300 1.700 peak 3081 spectrum 1 weight 0.10000E+01 volume 0.58524E-03 ppm1 7.707 ppm2 4.815 CV 1
ASSI { 1801}
(( segid " " and resid 241 and name H ))
(( segid " " and resid 240 and name HB ))
2.300 0.700 0.700 peak 1801 spectrum 1 weight 0.10000E+01 volume 0.48766E-02 ppm1 8.374 ppm2 2.166 CV 1
ASSI { 1740}
(( segid " " and resid 196 and name H ))
(( segid " " and resid 193 and name HA ))
5.300 3.600 0.700 peak 1740 spectrum 1 weight 0.10000E+01 volume 0.36000E-03 ppm1 7.177 ppm2 4.113 CV 1
ASSI { 1126}
(( segid " " and resid 301 and name HE22))
( segid " " and resid 300 and name HG2%)
4.400 2.400 1.600 peak 1126 spectrum 1 weight 0.10000E+01 volume 0.67959E-03 ppm1 7.360 ppm2 0.543 CV 1
ASSI { 3192}
(( segid " " and resid 433 and name HE22))
(( segid " " and resid 430 and name HA ))
4.200 2.300 1.800 peak 3192 spectrum 1 weight 0.10000E+01 volume 0.32728E-03 ppm1 6.709 ppm2 4.405 CV 1
ASSI { 992}
(( segid " " and resid 370 and name HD22))
(( segid " " and resid 370 and name HA ))
3.800 1.800 1.800 peak 992 spectrum 1 weight 0.10000E+01 volume 0.57869E-02 ppm1 7.522 ppm2 4.706 CV 1
ASSI { 3130}
(( segid " " and resid 330 and name H ))
(( segid " " and resid 329 and name HA ))
3.500 1.600 1.600 peak 3130 spectrum 1 weight 0.10000E+01 volume 0.75465E-03 ppm1 8.630 ppm2 3.872 CV 1
ASSI { 2887}
(( segid " " and resid 265 and name H ))
(( segid " " and resid 263 and name H ))
4.100 2.100 1.900 peak 2887 spectrum 1 weight 0.10000E+01 volume 0.45434E-03 ppm1 7.749 ppm2 7.121 CV 1
ASSI { 1972}
(( segid " " and resid 220 and name H ))
( segid " " and resid 220 and name HG1%)
2.600 0.800 0.800 peak 1972 spectrum 1 weight 0.10000E+01 volume 0.24238E-02 ppm1 8.676 ppm2 1.122 CV 1
OR { 1972}
(( segid " " and resid 220 and name H ))
( segid " " and resid 220 and name HG2%)
ASSI { 2802}
(( segid " " and resid 221 and name H ))
(( segid " " and resid 221 and name HB2 ))
3.000 1.100 1.100 peak 2802 spectrum 1 weight 0.10000E+01 volume 0.16575E-02 ppm1 8.750 ppm2 2.086 CV 1
OR { 2802}
(( segid " " and resid 221 and name H ))
(( segid " " and resid 221 and name HG2 ))
ASSI { 3198}
(( segid " " and resid 187 and name H ))
(( segid " " and resid 188 and name HD3 ))
3.100 1.200 1.200 peak 3198 spectrum 1 weight 0.10000E+01 volume 0.24738E-02 ppm1 8.523 ppm2 3.492 CV 1
OR { 3198}
(( segid " " and resid 187 and name H ))
(( segid " " and resid 188 and name HD2 ))
ASSI { 3087}
(( segid " " and resid 354 and name HD21))
(( segid " " and resid 344 and name HG13))
4.400 2.400 1.600 peak 3087 spectrum 1 weight 0.10000E+01 volume 0.49090E-03 ppm1 7.473 ppm2 1.227 CV 1
ASSI { 1995}
(( segid " " and resid 253 and name H ))
(( segid " " and resid 254 and name HA ))
4.500 2.500 1.500 peak 1995 spectrum 1 weight 0.10000E+01 volume 0.28300E-03 ppm1 8.261 ppm2 4.882 CV 1
ASSI { 1450}
(( segid " " and resid 236 and name H ))
( segid " " and resid 236 and name HG2%)
4.200 2.200 1.800 peak 1450 spectrum 1 weight 0.10000E+01 volume 0.16133E-02 ppm1 7.805 ppm2 0.997 CV 1
ASSI { 1071}
(( segid " " and resid 342 and name H ))
(( segid " " and resid 341 and name HB3 ))
2.900 1.000 1.000 peak 1071 spectrum 1 weight 0.10000E+01 volume 0.98374E-03 ppm1 8.649 ppm2 2.811 CV 1
OR { 1071}
(( segid " " and resid 342 and name H ))
(( segid " " and resid 341 and name HB2 ))
ASSI { 3018}
(( segid " " and resid 283 and name H ))
(( segid " " and resid 282 and name HB3 ))
4.100 2.100 1.900 peak 3018 spectrum 1 weight 0.10000E+01 volume 0.11301E-02 ppm1 7.315 ppm2 2.068 CV 1
ASSI { 487}
(( segid " " and resid 258 and name H ))
( segid " " and resid 258 and name HE% )
4.400 2.500 1.600 peak 487 spectrum 1 weight 0.10000E+01 volume 0.13746E-02 ppm1 8.135 ppm2 6.651 CV 1
ASSI { 27}
(( segid " " and resid 195 and name H ))
(( segid " " and resid 193 and name HB3 ))
3.300 1.300 1.300 peak 27 spectrum 1 weight 0.10000E+01 volume 0.20233E-02 ppm1 8.992 ppm2 1.652 CV 1
ASSI { 594}
(( segid " " and resid 263 and name H ))
( segid " " and resid 219 and name HE% )
4.800 2.900 1.200 peak 594 spectrum 1 weight 0.10000E+01 volume 0.46203E-03 ppm1 7.119 ppm2 6.405 CV 1
ASSI { 3142}
(( segid " " and resid 372 and name H ))
( segid " " and resid 371 and name HG2%)
3.600 1.600 1.600 peak 3142 spectrum 1 weight 0.10000E+01 volume 0.24218E-02 ppm1 7.921 ppm2 0.968 CV 1
ASSI { 463}
(( segid " " and resid 232 and name H ))
( segid " " and resid 231 and name HD% )
5.400 3.700 0.600 peak 463 spectrum 1 weight 0.10000E+01 volume 0.29647E-03 ppm1 8.797 ppm2 6.773 CV 1
OR { 463}
(( segid " " and resid 232 and name H ))
( segid " " and resid 231 and name HE% )
ASSI { 2355}
(( segid " " and resid 185 and name HD21))
(( segid " " and resid 185 and name HB3 ))
2.500 2.500 3.500 peak 2355 spectrum 1 weight 0.10000E+01 volume 0.35249E-02 ppm1 6.795 ppm2 2.680 CV 1
ASSI { 1650}
(( segid " " and resid 386 and name H ))
(( segid " " and resid 382 and name HE1 ))
4.500 2.600 1.500 peak 1650 spectrum 1 weight 0.10000E+01 volume 0.42547E-03 ppm1 7.968 ppm2 9.609 CV 1
ASSI { 1538}
(( segid " " and resid 423 and name H ))
(( segid " " and resid 423 and name HB3 ))
2.800 1.000 1.000 peak 1538 spectrum 1 weight 0.10000E+01 volume 0.47609E-02 ppm1 8.688 ppm2 1.627 CV 1
OR { 1538}
(( segid " " and resid 423 and name H ))
(( segid " " and resid 423 and name HG ))
ASSI { 1792}
(( segid " " and resid 393 and name H ))
(( segid " " and resid 393 and name HG2 ))
2.900 1.100 1.100 peak 1792 spectrum 1 weight 0.10000E+01 volume 0.21658E-02 ppm1 8.268 ppm2 2.124 CV 1
OR { 1792}
(( segid " " and resid 393 and name H ))
(( segid " " and resid 393 and name HB2 ))
ASSI { 3076}
(( segid " " and resid 232 and name H ))
(( segid " " and resid 232 and name HA ))
3.200 1.300 1.300 peak 3076 spectrum 1 weight 0.10000E+01 volume 0.12128E-02 ppm1 8.792 ppm2 4.450 CV 1
ASSI { 2607}
(( segid " " and resid 186 and name H ))
(( segid " " and resid 186 and name HA ))
2.400 0.700 0.700 peak 2607 spectrum 1 weight 0.10000E+01 volume 0.61394E-02 ppm1 8.055 ppm2 4.265 CV 1
ASSI { 3012}
(( segid " " and resid 189 and name H ))
(( segid " " and resid 248 and name HB2 ))
4.300 2.300 1.700 peak 3012 spectrum 1 weight 0.10000E+01 volume 0.50053E-03 ppm1 8.874 ppm2 2.541 CV 1
ASSI { 790}
(( segid " " and resid 297 and name H ))
(( segid " " and resid 300 and name H ))
4.500 2.500 1.500 peak 790 spectrum 1 weight 0.10000E+01 volume 0.34075E-03 ppm1 8.071 ppm2 7.906 CV 1
ASSI { 1744}
(( segid " " and resid 420 and name H ))
(( segid " " and resid 419 and name H ))
2.500 0.800 0.800 peak 1744 spectrum 1 weight 0.10000E+01 volume 0.48822E-02 ppm1 7.494 ppm2 7.959 CV 1
ASSI { 1213}
(( segid " " and resid 341 and name HD22))
(( segid " " and resid 337 and name HB3 ))
4.600 2.600 1.400 peak 1213 spectrum 1 weight 0.10000E+01 volume 0.50440E-03 ppm1 7.342 ppm2 1.509 CV 1
ASSI { 1023}
(( segid " " and resid 304 and name H ))
(( segid " " and resid 303 and name HB3 ))
3.600 1.600 1.600 peak 1023 spectrum 1 weight 0.10000E+01 volume 0.59871E-03 ppm1 8.674 ppm2 2.569 CV 1
ASSI { 408}
(( segid " " and resid 242 and name H ))
(( segid " " and resid 240 and name H ))
3.900 1.900 1.900 peak 408 spectrum 1 weight 0.10000E+01 volume 0.64684E-03 ppm1 7.551 ppm2 8.012 CV 1
ASSI { 2303}
(( segid " " and resid 339 and name H ))
(( segid " " and resid 338 and name HB2 ))
3.800 1.800 1.800 peak 2303 spectrum 1 weight 0.10000E+01 volume 0.11724E-02 ppm1 8.362 ppm2 2.825 CV 1
ASSI { 1335}
(( segid " " and resid 417 and name H ))
(( segid " " and resid 417 and name HB2 ))
2.200 0.600 0.600 peak 1335 spectrum 1 weight 0.10000E+01 volume 0.97433E-02 ppm1 7.758 ppm2 2.066 CV 1
OR { 1335}
(( segid " " and resid 417 and name H ))
(( segid " " and resid 417 and name HB3 ))
ASSI { 1676}
(( segid " " and resid 252 and name H ))
(( segid " " and resid 251 and name HG3 ))
4.000 2.000 2.000 peak 1676 spectrum 1 weight 0.10000E+01 volume 0.15748E-02 ppm1 8.421 ppm2 2.146 CV 1
ASSI { 1168}
(( segid " " and resid 413 and name H ))
(( segid " " and resid 413 and name HB2 ))
2.700 0.900 0.900 peak 1168 spectrum 1 weight 0.10000E+01 volume 0.23448E-02 ppm1 8.484 ppm2 3.057 CV 1
OR { 1168}
(( segid " " and resid 413 and name H ))
(( segid " " and resid 413 and name HB3 ))
ASSI { 156}
(( segid " " and resid 375 and name H ))
( segid " " and resid 376 and name HG2%)
4.900 3.000 1.100 peak 156 spectrum 1 weight 0.10000E+01 volume 0.70462E-03 ppm1 8.481 ppm2 0.903 CV 1
OR { 156}
(( segid " " and resid 375 and name H ))
( segid " " and resid 376 and name HG1%)
ASSI { 1488}
(( segid " " and resid 338 and name HD22))
(( segid " " and resid 338 and name HD21))
2.100 0.500 0.500 peak 1488 spectrum 1 weight 0.10000E+01 volume 0.40639E-02 ppm1 7.448 ppm2 6.624 CV 1
ASSI { 2795}
(( segid " " and resid 303 and name H ))
(( segid " " and resid 302 and name HG2 ))
4.000 2.000 2.000 peak 2795 spectrum 1 weight 0.10000E+01 volume 0.13649E-02 ppm1 8.741 ppm2 2.263 CV 1
ASSI { 1020}
(( segid " " and resid 375 and name HE21))
(( segid " " and resid 375 and name HE22))
1.300 0.200 0.900 peak 1020 spectrum 1 weight 0.10000E+01 volume 0.78758E-01 ppm1 6.676 ppm2 7.505 CV 1
ASSI { 168}
(( segid " " and resid 438 and name H ))
(( segid " " and resid 441 and name HD2 ))
5.400 3.600 0.600 peak 168 spectrum 1 weight 0.10000E+01 volume 0.25604E-03 ppm1 7.568 ppm2 3.139 CV 1
OR { 168}
(( segid " " and resid 438 and name H ))
(( segid " " and resid 441 and name HD3 ))
ASSI { 1302}
(( segid " " and resid 375 and name H ))
(( segid " " and resid 374 and name HA ))
2.100 0.600 0.600 peak 1302 spectrum 1 weight 0.10000E+01 volume 0.58581E-02 ppm1 8.483 ppm2 4.055 CV 1
ASSI { 2955}
(( segid " " and resid 397 and name H ))
(( segid " " and resid 397 and name HA2 ))
2.700 0.900 0.900 peak 2955 spectrum 1 weight 0.10000E+01 volume 0.28261E-02 ppm1 8.081 ppm2 3.788 CV 1
OR { 2955}
(( segid " " and resid 397 and name H ))
(( segid " " and resid 397 and name HA3 ))
ASSI { 1341}
(( segid " " and resid 261 and name H ))
(( segid " " and resid 261 and name HA ))
2.800 1.000 1.000 peak 1341 spectrum 1 weight 0.10000E+01 volume 0.25643E-02 ppm1 8.907 ppm2 4.513 CV 1
ASSI { 424}
(( segid " " and resid 371 and name H ))
(( segid " " and resid 370 and name HD21))
3.500 1.500 1.500 peak 424 spectrum 1 weight 0.10000E+01 volume 0.25797E-03 ppm1 7.530 ppm2 6.849 CV 1
ASSI { 468}
(( segid " " and resid 195 and name H ))
(( segid " " and resid 196 and name HB2 ))
5.400 3.700 0.600 peak 468 spectrum 1 weight 0.10000E+01 volume 0.35809E-03 ppm1 8.994 ppm2 2.627 CV 1
ASSI { 942}
(( segid " " and resid 251 and name H ))
(( segid " " and resid 249 and name H ))
4.000 2.000 2.000 peak 942 spectrum 1 weight 0.10000E+01 volume 0.94524E-03 ppm1 7.890 ppm2 7.309 CV 1
ASSI { 2021}
(( segid " " and resid 261 and name HD22))
(( segid " " and resid 261 and name HA ))
5.800 4.200 0.200 peak 2021 spectrum 1 weight 0.10000E+01 volume 0.45818E-03 ppm1 6.629 ppm2 4.512 CV 1
ASSI { 2820}
(( segid " " and resid 436 and name H ))
(( segid " " and resid 436 and name HG ))
4.600 2.600 1.400 peak 2820 spectrum 1 weight 0.10000E+01 volume 0.87593E-03 ppm1 8.927 ppm2 1.610 CV 1
ASSI { 1923}
(( segid " " and resid 378 and name H ))
( segid " " and resid 376 and name HG2%)
2.700 2.700 3.300 peak 1923 spectrum 1 weight 0.10000E+01 volume 0.83165E-03 ppm1 8.583 ppm2 0.902 CV 1
ASSI { 1817}
(( segid " " and resid 325 and name H ))
(( segid " " and resid 324 and name HB2 ))
4.000 2.000 2.000 peak 1817 spectrum 1 weight 0.10000E+01 volume 0.84705E-03 ppm1 8.508 ppm2 2.886 CV 1
ASSI { 2636}
(( segid " " and resid 302 and name H ))
( segid " " and resid 300 and name HG1%)
5.900 4.300 0.100 peak 2636 spectrum 1 weight 0.10000E+01 volume 0.36194E-03 ppm1 7.998 ppm2 0.090 CV 1
ASSI { 1382}
(( segid " " and resid 365 and name HE21))
( segid " " and resid 364 and name HG1%)
2.100 0.500 0.500 peak 1382 spectrum 1 weight 0.10000E+01 volume 0.90674E-03 ppm1 6.881 ppm2 1.075 CV 1
ASSI { 1162}
(( segid " " and resid 396 and name H ))
(( segid " " and resid 394 and name H ))
5.800 4.200 0.200 peak 1162 spectrum 1 weight 0.10000E+01 volume 0.20214E-03 ppm1 8.691 ppm2 7.566 CV 1
ASSI { 3176}
(( segid " " and resid 304 and name H ))
(( segid " " and resid 300 and name HA ))
4.400 2.400 1.600 peak 3176 spectrum 1 weight 0.10000E+01 volume 0.45818E-03 ppm1 8.670 ppm2 2.912 CV 1
ASSI { 938}
(( segid " " and resid 418 and name H ))
(( segid " " and resid 417 and name HA ))
3.000 1.100 1.100 peak 938 spectrum 1 weight 0.10000E+01 volume 0.23121E-02 ppm1 8.185 ppm2 4.135 CV 1
ASSI { 935}
(( segid " " and resid 284 and name H ))
(( segid " " and resid 285 and name HG3 ))
4.500 2.500 1.500 peak 935 spectrum 1 weight 0.10000E+01 volume 0.14092E-02 ppm1 8.115 ppm2 1.978 CV 1
OR { 935}
(( segid " " and resid 284 and name H ))
(( segid " " and resid 285 and name HG2 ))
ASSI { 395}
(( segid " " and resid 361 and name H ))
(( segid " " and resid 359 and name HB ))
4.600 2.600 1.400 peak 395 spectrum 1 weight 0.10000E+01 volume 0.59487E-03 ppm1 8.407 ppm2 1.574 CV 1
ASSI { 1283}
(( segid " " and resid 370 and name HD22))
(( segid " " and resid 370 and name HB3 ))
3.000 1.100 1.100 peak 1283 spectrum 1 weight 0.10000E+01 volume 0.83204E-02 ppm1 7.520 ppm2 2.772 CV 1
OR { 1283}
(( segid " " and resid 370 and name HD22))
(( segid " " and resid 370 and name HB2 ))
ASSI { 2444}
(( segid " " and resid 369 and name H ))
(( segid " " and resid 365 and name HG2 ))
2.700 2.700 3.300 peak 2444 spectrum 1 weight 0.10000E+01 volume 0.89327E-03 ppm1 7.755 ppm2 2.340 CV 1
OR { 2444}
(( segid " " and resid 369 and name H ))
(( segid " " and resid 365 and name HG3 ))
ASSI { 2053}
(( segid " " and resid 350 and name H ))
(( segid " " and resid 349 and name HB ))
3.100 1.200 1.200 peak 2053 spectrum 1 weight 0.10000E+01 volume 0.79893E-03 ppm1 7.626 ppm2 4.437 CV 1
ASSI { 1141}
(( segid " " and resid 223 and name H ))
(( segid " " and resid 224 and name HA3 ))
5.400 3.600 0.600 peak 1141 spectrum 1 weight 0.10000E+01 volume 0.39271E-03 ppm1 8.418 ppm2 3.629 CV 1
ASSI { 1961}
(( segid " " and resid 342 and name H ))
(( segid " " and resid 339 and name HA ))
3.400 1.500 1.500 peak 1961 spectrum 1 weight 0.10000E+01 volume 0.67381E-03 ppm1 8.653 ppm2 2.986 CV 1
ASSI { 1685}
(( segid " " and resid 310 and name H ))
(( segid " " and resid 310 and name HG ))
2.100 0.600 0.600 peak 1685 spectrum 1 weight 0.10000E+01 volume 0.51727E-02 ppm1 7.065 ppm2 2.148 CV 1
ASSI { 1718}
(( segid " " and resid 255 and name H ))
( segid " " and resid 255 and name HD1%)
3.400 1.400 1.400 peak 1718 spectrum 1 weight 0.10000E+01 volume 0.16710E-02 ppm1 8.613 ppm2 0.613 CV 1
ASSI { 2945}
(( segid " " and resid 377 and name H ))
(( segid " " and resid 376 and name H ))
5.000 3.100 1.000 peak 2945 spectrum 1 weight 0.10000E+01 volume 0.37734E-03 ppm1 8.237 ppm2 9.504 CV 1
ASSI { 3082}
(( segid " " and resid 387 and name H ))
(( segid " " and resid 387 and name HA ))
2.900 1.000 1.000 peak 3082 spectrum 1 weight 0.10000E+01 volume 0.27260E-02 ppm1 7.974 ppm2 4.303 CV 1
ASSI { 1145}
(( segid " " and resid 207 and name H ))
(( segid " " and resid 205 and name HB2 ))
4.200 2.200 1.800 peak 1145 spectrum 1 weight 0.10000E+01 volume 0.51978E-03 ppm1 6.898 ppm2 2.733 CV 1
ASSI { 2278}
(( segid " " and resid 408 and name H ))
( segid " " and resid 407 and name HD% )
4.400 2.400 1.600 peak 2278 spectrum 1 weight 0.10000E+01 volume 0.12051E-02 ppm1 7.478 ppm2 7.313 CV 1
ASSI { 1090}
(( segid " " and resid 202 and name H ))
(( segid " " and resid 202 and name HG3 ))
3.600 1.700 1.700 peak 1090 spectrum 1 weight 0.10000E+01 volume 0.20638E-02 ppm1 8.210 ppm2 2.776 CV 1
ASSI { 1487}
(( segid " " and resid 185 and name H ))
(( segid " " and resid 185 and name HB2 ))
3.500 1.500 1.500 peak 1487 spectrum 1 weight 0.10000E+01 volume 0.13418E-02 ppm1 8.460 ppm2 2.715 CV 1
OR { 1487}
(( segid " " and resid 185 and name H ))
(( segid " " and resid 185 and name HB3 ))
ASSI { 378}
(( segid " " and resid 261 and name H ))
( segid " " and resid 219 and name HE% )
5.300 3.500 0.700 peak 378 spectrum 1 weight 0.10000E+01 volume 0.25989E-03 ppm1 8.902 ppm2 6.408 CV 1
ASSI { 1625}
(( segid " " and resid 425 and name H ))
(( segid " " and resid 425 and name HG3 ))
4.100 2.100 1.900 peak 1625 spectrum 1 weight 0.10000E+01 volume 0.10973E-02 ppm1 7.758 ppm2 1.247 CV 1
ASSI { 3114}
(( segid " " and resid 420 and name H ))
(( segid " " and resid 420 and name HB ))
2.000 0.500 0.500 peak 3114 spectrum 1 weight 0.10000E+01 volume 0.11335E-01 ppm1 7.494 ppm2 1.776 CV 1
ASSI { 2325}
(( segid " " and resid 309 and name H ))
(( segid " " and resid 306 and name HA ))
3.100 1.200 1.200 peak 2325 spectrum 1 weight 0.10000E+01 volume 0.11397E-02 ppm1 7.492 ppm2 3.655 CV 1
ASSI { 2604}
(( segid " " and resid 291 and name H ))
(( segid " " and resid 292 and name HA2 ))
4.900 3.000 1.100 peak 2604 spectrum 1 weight 0.10000E+01 volume 0.10011E-02 ppm1 7.364 ppm2 3.714 CV 1
ASSI { 3052}
(( segid " " and resid 261 and name H ))
(( segid " " and resid 263 and name H ))
4.400 2.400 1.600 peak 3052 spectrum 1 weight 0.10000E+01 volume 0.51787E-03 ppm1 8.906 ppm2 7.115 CV 1
ASSI { 1964}
(( segid " " and resid 235 and name H ))
(( segid " " and resid 235 and name HA3 ))
3.300 1.300 1.300 peak 1964 spectrum 1 weight 0.10000E+01 volume 0.10550E-02 ppm1 7.896 ppm2 3.066 CV 1
ASSI { 971}
(( segid " " and resid 244 and name H ))
( segid " " and resid 266 and name HD2%)
3.500 1.500 1.500 peak 971 spectrum 1 weight 0.10000E+01 volume 0.10184E-02 ppm1 8.558 ppm2 0.839 CV 1
OR { 971}
(( segid " " and resid 244 and name H ))
( segid " " and resid 266 and name HD1%)
ASSI { 2484}
(( segid " " and resid 418 and name H ))
(( segid " " and resid 417 and name HG3 ))
2.900 2.900 3.100 peak 2484 spectrum 1 weight 0.10000E+01 volume 0.60643E-03 ppm1 8.189 ppm2 2.386 CV 1
OR { 2484}
(( segid " " and resid 418 and name H ))
(( segid " " and resid 417 and name HG2 ))
ASSI { 1070}
(( segid " " and resid 430 and name H ))
(( segid " " and resid 429 and name HB2 ))
3.600 1.600 1.600 peak 1070 spectrum 1 weight 0.10000E+01 volume 0.10165E-02 ppm1 7.761 ppm2 1.433 CV 1
OR { 1070}
(( segid " " and resid 430 and name H ))
(( segid " " and resid 429 and name HG ))
ASSI { 3068}
(( segid " " and resid 313 and name H ))
(( segid " " and resid 312 and name HB3 ))
2.700 0.900 0.900 peak 3068 spectrum 1 weight 0.10000E+01 volume 0.26991E-02 ppm1 8.626 ppm2 1.936 CV 1
ASSI { 1695}
(( segid " " and resid 340 and name H ))
(( segid " " and resid 340 and name HB2 ))
2.300 0.600 0.600 peak 1695 spectrum 1 weight 0.10000E+01 volume 0.42448E-02 ppm1 8.164 ppm2 1.986 CV 1
ASSI { 3151}
(( segid " " and resid 361 and name H ))
(( segid " " and resid 357 and name HA ))
4.700 2.700 1.300 peak 3151 spectrum 1 weight 0.10000E+01 volume 0.40043E-03 ppm1 8.403 ppm2 3.856 CV 1
ASSI { 2289}
(( segid " " and resid 314 and name H ))
( segid " " and resid 194 and name HD1%)
4.100 2.100 1.900 peak 2289 spectrum 1 weight 0.10000E+01 volume 0.10434E-02 ppm1 7.342 ppm2 0.741 CV 1
ASSI { 2744}
(( segid " " and resid 318 and name H ))
(( segid " " and resid 318 and name HA ))
2.800 1.000 1.000 peak 2744 spectrum 1 weight 0.10000E+01 volume 0.13033E-02 ppm1 8.047 ppm2 3.373 CV 1
ASSI { 1882}
(( segid " " and resid 382 and name HE1 ))
(( segid " " and resid 382 and name HB3 ))
4.600 2.600 1.400 peak 1882 spectrum 1 weight 0.10000E+01 volume 0.68149E-03 ppm1 9.605 ppm2 2.797 CV 1
ASSI { 2765}
(( segid " " and resid 325 and name H ))
(( segid " " and resid 324 and name HB3 ))
2.700 0.900 0.900 peak 2765 spectrum 1 weight 0.10000E+01 volume 0.84131E-03 ppm1 8.510 ppm2 3.286 CV 1
ASSI { 163}
(( segid " " and resid 293 and name HE ))
(( segid " " and resid 290 and name HA ))
5.000 3.200 1.000 peak 163 spectrum 1 weight 0.10000E+01 volume 0.38887E-03 ppm1 7.798 ppm2 4.058 CV 1
ASSI { 1135}
(( segid " " and resid 261 and name H ))
(( segid " " and resid 260 and name HD3 ))
4.400 2.500 1.600 peak 1135 spectrum 1 weight 0.10000E+01 volume 0.62568E-03 ppm1 8.902 ppm2 3.846 CV 1
ASSI { 3174}
(( segid " " and resid 375 and name HE22))
(( segid " " and resid 375 and name HB2 ))
4.100 2.100 1.900 peak 3174 spectrum 1 weight 0.10000E+01 volume 0.14651E-02 ppm1 7.506 ppm2 1.886 CV 1
OR { 3174}
(( segid " " and resid 375 and name HE22))
(( segid " " and resid 375 and name HB3 ))
ASSI { 2989}
(( segid " " and resid 245 and name H ))
(( segid " " and resid 243 and name H ))
3.700 1.700 1.700 peak 2989 spectrum 1 weight 0.10000E+01 volume 0.71231E-03 ppm1 7.532 ppm2 7.868 CV 1
ASSI { 1950}
(( segid " " and resid 339 and name H ))
(( segid " " and resid 339 and name HG13))
2.100 0.500 0.500 peak 1950 spectrum 1 weight 0.10000E+01 volume 0.25932E-02 ppm1 8.365 ppm2 1.563 CV 1
OR { 1950}
(( segid " " and resid 339 and name H ))
(( segid " " and resid 339 and name HB ))
ASSI { 710}
(( segid " " and resid 244 and name H ))
(( segid " " and resid 244 and name HE2 ))
5.000 3.200 1.000 peak 710 spectrum 1 weight 0.10000E+01 volume 0.44278E-03 ppm1 8.557 ppm2 2.581 CV 1
OR { 710}
(( segid " " and resid 244 and name H ))
(( segid " " and resid 244 and name HE3 ))
ASSI { 2714}
(( segid " " and resid 320 and name HE1 ))
(( segid " " and resid 374 and name H ))
5.100 3.200 0.900 peak 2714 spectrum 1 weight 0.10000E+01 volume 0.26952E-03 ppm1 10.122 ppm2 6.322 CV 1
ASSI { 1083}
(( segid " " and resid 274 and name H ))
(( segid " " and resid 275 and name HD3 ))
4.800 2.900 1.200 peak 1083 spectrum 1 weight 0.10000E+01 volume 0.69500E-03 ppm1 7.024 ppm2 3.090 CV 1
ASSI { 74}
(( segid " " and resid 430 and name HE1 ))
(( segid " " and resid 431 and name H ))
4.600 2.600 1.400 peak 74 spectrum 1 weight 0.10000E+01 volume 0.56984E-03 ppm1 10.079 ppm2 7.981 CV 1
ASSI { 2051}
(( segid " " and resid 243 and name H ))
(( segid " " and resid 242 and name HB2 ))
2.600 0.900 0.900 peak 2051 spectrum 1 weight 0.10000E+01 volume 0.29474E-02 ppm1 7.864 ppm2 2.226 CV 1
OR { 2051}
(( segid " " and resid 243 and name H ))
(( segid " " and resid 242 and name HB3 ))
ASSI { 1927}
(( segid " " and resid 261 and name HD22))
(( segid " " and resid 261 and name HD21))
2.000 0.500 0.500 peak 1927 spectrum 1 weight 0.10000E+01 volume 0.46897E-02 ppm1 6.628 ppm2 7.526 CV 1
ASSI { 1877}
(( segid " " and resid 414 and name H ))
(( segid " " and resid 414 and name HB2 ))
2.400 0.700 0.700 peak 1877 spectrum 1 weight 0.10000E+01 volume 0.37406E-02 ppm1 7.673 ppm2 1.883 CV 1
ASSI { 1975}
(( segid " " and resid 277 and name H ))
(( segid " " and resid 277 and name HB3 ))
4.400 2.500 1.600 peak 1975 spectrum 1 weight 0.10000E+01 volume 0.41775E-03 ppm1 8.700 ppm2 1.929 CV 1
ASSI { 1582}
(( segid " " and resid 338 and name HD22))
(( segid " " and resid 338 and name HA ))
4.900 3.000 1.100 peak 1582 spectrum 1 weight 0.10000E+01 volume 0.48900E-03 ppm1 7.442 ppm2 4.641 CV 1
ASSI { 1498}
(( segid " " and resid 264 and name H ))
(( segid " " and resid 264 and name HA ))
2.900 1.100 1.100 peak 1498 spectrum 1 weight 0.10000E+01 volume 0.18039E-02 ppm1 8.510 ppm2 3.914 CV 1
ASSI { 1188}
(( segid " " and resid 197 and name H ))
(( segid " " and resid 196 and name HA ))
3.600 1.600 1.600 peak 1188 spectrum 1 weight 0.10000E+01 volume 0.10839E-02 ppm1 8.052 ppm2 4.393 CV 1
ASSI { 1952}
(( segid " " and resid 428 and name H ))
(( segid " " and resid 427 and name HG3 ))
4.600 2.600 1.400 peak 1952 spectrum 1 weight 0.10000E+01 volume 0.67765E-03 ppm1 7.735 ppm2 2.372 CV 1
ASSI { 814}
(( segid " " and resid 264 and name H ))
( segid " " and resid 231 and name HE% )
5.300 3.500 0.700 peak 814 spectrum 1 weight 0.10000E+01 volume 0.65071E-03 ppm1 8.513 ppm2 6.797 CV 1
OR { 814}
(( segid " " and resid 264 and name H ))
( segid " " and resid 231 and name HD% )
ASSI { 3064}
(( segid " " and resid 235 and name H ))
(( segid " " and resid 234 and name HA ))
2.800 1.000 1.000 peak 3064 spectrum 1 weight 0.10000E+01 volume 0.28800E-02 ppm1 7.894 ppm2 4.166 CV 1
ASSI { 2031}
(( segid " " and resid 326 and name H ))
( segid " " and resid 323 and name HG2%)
4.700 2.700 1.300 peak 2031 spectrum 1 weight 0.10000E+01 volume 0.81818E-03 ppm1 8.925 ppm2 0.430 CV 1
ASSI { 1936}
(( segid " " and resid 347 and name H ))
(( segid " " and resid 347 and name HA ))
2.900 1.100 1.100 peak 1936 spectrum 1 weight 0.10000E+01 volume 0.12417E-02 ppm1 9.034 ppm2 4.639 CV 1
ASSI { 2755}
(( segid " " and resid 223 and name H ))
(( segid " " and resid 222 and name HB2 ))
2.600 0.800 0.800 peak 2755 spectrum 1 weight 0.10000E+01 volume 0.10088E-02 ppm1 8.424 ppm2 1.230 CV 1
ASSI { 3132}
(( segid " " and resid 365 and name H ))
(( segid " " and resid 363 and name HA ))
3.500 1.500 1.500 peak 3132 spectrum 1 weight 0.10000E+01 volume 0.10069E-02 ppm1 8.369 ppm2 5.126 CV 1
ASSI { 321}
(( segid " " and resid 368 and name H ))
( segid " " and resid 368 and name HE% )
4.700 2.800 1.300 peak 321 spectrum 1 weight 0.10000E+01 volume 0.46012E-03 ppm1 8.216 ppm2 6.764 CV 1
ASSI { 1706}
(( segid " " and resid 258 and name H ))
( segid " " and resid 263 and name HG1%)
4.400 2.400 1.600 peak 1706 spectrum 1 weight 0.10000E+01 volume 0.84705E-03 ppm1 8.137 ppm2 0.073 CV 1
ASSI { 1558}
(( segid " " and resid 319 and name H ))
( segid " " and resid 368 and name HE% )
5.000 3.100 1.000 peak 1558 spectrum 1 weight 0.10000E+01 volume 0.32920E-03 ppm1 7.854 ppm2 6.756 CV 1
ASSI { 2563}
(( segid " " and resid 278 and name H ))
(( segid " " and resid 278 and name HB2 ))
2.700 0.900 0.900 peak 2563 spectrum 1 weight 0.10000E+01 volume 0.81240E-03 ppm1 10.073 ppm2 1.195 CV 1
ASSI { 2596}
(( segid " " and resid 198 and name H ))
(( segid " " and resid 198 and name HB ))
2.600 0.800 0.800 peak 2596 spectrum 1 weight 0.10000E+01 volume 0.23083E-02 ppm1 8.608 ppm2 2.063 CV 1
ASSI { 1622}
(( segid " " and resid 408 and name H ))
(( segid " " and resid 406 and name H ))
4.600 2.600 1.400 peak 1622 spectrum 1 weight 0.10000E+01 volume 0.25604E-03 ppm1 7.492 ppm2 9.264 CV 1
ASSI { 196}
(( segid " " and resid 425 and name H ))
(( segid " " and resid 425 and name HE3 ))
5.600 3.900 0.400 peak 196 spectrum 1 weight 0.10000E+01 volume 0.46975E-03 ppm1 7.753 ppm2 2.914 CV 1
OR { 196}
(( segid " " and resid 425 and name H ))
(( segid " " and resid 425 and name HE2 ))
ASSI { 811}
(( segid " " and resid 360 and name H ))
(( segid " " and resid 356 and name HA ))
4.600 2.600 1.400 peak 811 spectrum 1 weight 0.10000E+01 volume 0.35615E-03 ppm1 7.276 ppm2 3.626 CV 1
ASSI { 1199}
(( segid " " and resid 303 and name H ))
( segid " " and resid 300 and name HG1%)
6.000 4.500 0.000 peak 1199 spectrum 1 weight 0.10000E+01 volume 0.29070E-03 ppm1 8.744 ppm2 0.089 CV 1
ASSI { 1265}
(( segid " " and resid 202 and name H ))
( segid " " and resid 198 and name HG1%)
4.200 2.200 1.800 peak 1265 spectrum 1 weight 0.10000E+01 volume 0.11320E-02 ppm1 8.208 ppm2 0.617 CV 1
OR { 1265}
(( segid " " and resid 202 and name H ))
( segid " " and resid 198 and name HG2%)
ASSI { 999}
(( segid " " and resid 317 and name H ))
( segid " " and resid 317 and name HD2%)
4.300 2.300 1.700 peak 999 spectrum 1 weight 0.10000E+01 volume 0.20099E-02 ppm1 7.530 ppm2 0.380 CV 1
ASSI { 2465}
(( segid " " and resid 227 and name H ))
( segid " " and resid 230 and name HG2%)
4.200 2.200 1.800 peak 2465 spectrum 1 weight 0.10000E+01 volume 0.10839E-02 ppm1 7.122 ppm2 0.964 CV 1
OR { 2465}
(( segid " " and resid 227 and name H ))
(( segid " " and resid 230 and name HG13))
ASSI { 3126}
(( segid " " and resid 301 and name HE21))
(( segid " " and resid 301 and name H ))
4.700 2.800 1.300 peak 3126 spectrum 1 weight 0.10000E+01 volume 0.52556E-03 ppm1 6.701 ppm2 8.074 CV 1
ASSI { 2962}
(( segid " " and resid 340 and name H ))
(( segid " " and resid 340 and name HB3 ))
2.400 0.700 0.700 peak 2962 spectrum 1 weight 0.10000E+01 volume 0.44912E-02 ppm1 8.164 ppm2 2.046 CV 1
ASSI { 2581}
(( segid " " and resid 338 and name H ))
( segid " " and resid 329 and name HD1%)
5.500 3.700 0.500 peak 2581 spectrum 1 weight 0.10000E+01 volume 0.24064E-03 ppm1 7.705 ppm2 0.124 CV 1
ASSI { 2800}
(( segid " " and resid 239 and name H ))
(( segid " " and resid 240 and name HA ))
5.300 3.500 0.700 peak 2800 spectrum 1 weight 0.10000E+01 volume 0.38118E-03 ppm1 7.094 ppm2 3.245 CV 1
ASSI { 1709}
(( segid " " and resid 396 and name H ))
(( segid " " and resid 395 and name HB3 ))
2.700 0.900 0.900 peak 1709 spectrum 1 weight 0.10000E+01 volume 0.30148E-02 ppm1 8.690 ppm2 2.043 CV 1
OR { 1709}
(( segid " " and resid 396 and name H ))
(( segid " " and resid 395 and name HB2 ))
ASSI { 2394}
(( segid " " and resid 304 and name HE21))
( segid " " and resid 300 and name HG2%)
2.900 1.000 1.000 peak 2394 spectrum 1 weight 0.10000E+01 volume 0.23448E-02 ppm1 6.656 ppm2 0.544 CV 1
ASSI { 1907}
(( segid " " and resid 279 and name H ))
(( segid " " and resid 279 and name HA ))
2.800 0.900 0.900 peak 1907 spectrum 1 weight 0.10000E+01 volume 0.11243E-02 ppm1 9.037 ppm2 4.319 CV 1
ASSI { 2159}
(( segid " " and resid 423 and name H ))
( segid " " and resid 423 and name HD2%)
4.600 2.700 1.400 peak 2159 spectrum 1 weight 0.10000E+01 volume 0.13688E-02 ppm1 8.687 ppm2 0.856 CV 1
OR { 2159}
(( segid " " and resid 423 and name H ))
( segid " " and resid 423 and name HD1%)
ASSI { 4}
(( segid " " and resid 375 and name HE21))
(( segid " " and resid 218 and name HA ))
4.600 2.600 1.400 peak 4 spectrum 1 weight 0.10000E+01 volume 0.46397E-03 ppm1 6.678 ppm2 4.069 CV 1
ASSI { 2547}
(( segid " " and resid 340 and name H ))
(( segid " " and resid 338 and name HA ))
4.800 2.800 1.200 peak 2547 spectrum 1 weight 0.10000E+01 volume 0.49668E-03 ppm1 8.163 ppm2 4.660 CV 1
ASSI { 2663}
(( segid " " and resid 430 and name HE1 ))
(( segid " " and resid 430 and name HZ2 ))
2.500 0.800 0.800 peak 2663 spectrum 1 weight 0.10000E+01 volume 0.70497E-02 ppm1 10.080 ppm2 7.309 CV 1
ASSI { 3154}
(( segid " " and resid 223 and name H ))
(( segid " " and resid 221 and name HB2 ))
5.100 3.300 0.900 peak 3154 spectrum 1 weight 0.10000E+01 volume 0.35809E-03 ppm1 8.417 ppm2 2.094 CV 1
ASSI { 2404}
(( segid " " and resid 209 and name H ))
(( segid " " and resid 209 and name HA ))
3.400 1.400 1.400 peak 2404 spectrum 1 weight 0.10000E+01 volume 0.54290E-03 ppm1 7.823 ppm2 4.384 CV 1
ASSI { 2595}
(( segid " " and resid 353 and name H ))
(( segid " " and resid 355 and name H ))
5.400 3.600 0.600 peak 2595 spectrum 1 weight 0.10000E+01 volume 0.38309E-03 ppm1 8.954 ppm2 8.088 CV 1
ASSI { 1560}
(( segid " " and resid 340 and name H ))
( segid " " and resid 329 and name HD1%)
5.000 3.200 1.000 peak 1560 spectrum 1 weight 0.10000E+01 volume 0.58524E-03 ppm1 8.154 ppm2 0.110 CV 1
ASSI { 2175}
(( segid " " and resid 419 and name H ))
(( segid " " and resid 417 and name HA ))
3.600 1.600 1.600 peak 2175 spectrum 1 weight 0.10000E+01 volume 0.61606E-03 ppm1 7.960 ppm2 4.138 CV 1
ASSI { 2777}
(( segid " " and resid 369 and name H ))
(( segid " " and resid 365 and name HB3 ))
3.600 1.600 1.600 peak 2777 spectrum 1 weight 0.10000E+01 volume 0.10704E-02 ppm1 7.756 ppm2 1.992 CV 1
ASSI { 1577}
(( segid " " and resid 340 and name HE21))
(( segid " " and resid 344 and name HG13))
4.200 2.200 1.800 peak 1577 spectrum 1 weight 0.10000E+01 volume 0.34845E-03 ppm1 6.786 ppm2 1.237 CV 1
ASSI { 2615}
(( segid " " and resid 214 and name H ))
(( segid " " and resid 212 and name HA ))
4.900 3.000 1.100 peak 2615 spectrum 1 weight 0.10000E+01 volume 0.23102E-03 ppm1 7.188 ppm2 3.239 CV 1
ASSI { 2531}
(( segid " " and resid 294 and name H ))
(( segid " " and resid 294 and name HA ))
2.600 0.900 0.900 peak 2531 spectrum 1 weight 0.10000E+01 volume 0.31823E-02 ppm1 8.530 ppm2 3.906 CV 1
ASSI { 406}
(( segid " " and resid 417 and name HE21))
( segid " " and resid 416 and name HD2%)
5.100 3.200 0.900 peak 406 spectrum 1 weight 0.10000E+01 volume 0.45050E-03 ppm1 7.360 ppm2 0.670 CV 1
ASSI { 1328}
(( segid " " and resid 196 and name H ))
(( segid " " and resid 193 and name HG3 ))
3.100 3.100 2.900 peak 1328 spectrum 1 weight 0.10000E+01 volume 0.41968E-03 ppm1 7.180 ppm2 1.836 CV 1
ASSI { 2067}
(( segid " " and resid 232 and name H ))
(( segid " " and resid 231 and name HA ))
3.800 1.800 1.800 peak 2067 spectrum 1 weight 0.10000E+01 volume 0.41968E-03 ppm1 8.787 ppm2 3.556 CV 1
ASSI { 1299}
(( segid " " and resid 262 and name H ))
( segid " " and resid 262 and name HG2%)
4.100 2.100 1.900 peak 1299 spectrum 1 weight 0.10000E+01 volume 0.13130E-02 ppm1 7.887 ppm2 1.084 CV 1
ASSI { 2720}
(( segid " " and resid 349 and name H ))
( segid " " and resid 349 and name HG2%)
4.100 2.100 1.900 peak 2720 spectrum 1 weight 0.10000E+01 volume 0.18616E-02 ppm1 7.105 ppm2 1.243 CV 1
ASSI { 1559}
(( segid " " and resid 248 and name H ))
(( segid " " and resid 251 and name H ))
4.800 2.900 1.200 peak 1559 spectrum 1 weight 0.10000E+01 volume 0.47553E-03 ppm1 8.881 ppm2 7.880 CV 1
ASSI { 2477}
(( segid " " and resid 357 and name H ))
(( segid " " and resid 357 and name HB3 ))
3.600 1.600 1.600 peak 2477 spectrum 1 weight 0.10000E+01 volume 0.17345E-02 ppm1 8.143 ppm2 1.807 CV 1
OR { 2477}
(( segid " " and resid 357 and name H ))
(( segid " " and resid 357 and name HG ))
ASSI { 2908}
(( segid " " and resid 354 and name HD22))
( segid " " and resid 344 and name HG2%)
4.000 2.000 2.000 peak 2908 spectrum 1 weight 0.10000E+01 volume 0.14708E-02 ppm1 6.455 ppm2 0.871 CV 1
ASSI { 1925}
(( segid " " and resid 304 and name HE21))
(( segid " " and resid 304 and name HB3 ))
4.000 2.000 2.000 peak 1925 spectrum 1 weight 0.10000E+01 volume 0.19579E-02 ppm1 6.656 ppm2 1.883 CV 1
ASSI { 1242}
(( segid " " and resid 290 and name H ))
(( segid " " and resid 289 and name HG2 ))
4.200 2.200 1.800 peak 1242 spectrum 1 weight 0.10000E+01 volume 0.10300E-02 ppm1 7.820 ppm2 2.336 CV 1
ASSI { 1822}
(( segid " " and resid 261 and name H ))
(( segid " " and resid 260 and name HD2 ))
3.200 1.300 1.300 peak 1822 spectrum 1 weight 0.10000E+01 volume 0.65071E-03 ppm1 8.908 ppm2 3.959 CV 1
ASSI { 3061}
(( segid " " and resid 284 and name H ))
( segid " " and resid 283 and name HD2%)
4.700 2.800 1.300 peak 3061 spectrum 1 weight 0.10000E+01 volume 0.62953E-03 ppm1 8.120 ppm2 0.907 CV 1
ASSI { 155}
(( segid " " and resid 340 and name HE22))
( segid " " and resid 344 and name HD1%)
2.800 0.900 0.900 peak 155 spectrum 1 weight 0.10000E+01 volume 0.31014E-02 ppm1 7.417 ppm2 0.836 CV 1
OR { 155}
(( segid " " and resid 340 and name HE22))
( segid " " and resid 344 and name HG2%)
ASSI { 1105}
(( segid " " and resid 304 and name HE21))
(( segid " " and resid 304 and name H ))
4.900 3.000 1.100 peak 1105 spectrum 1 weight 0.10000E+01 volume 0.46012E-03 ppm1 6.659 ppm2 8.674 CV 1
ASSI { 476}
(( segid " " and resid 396 and name H ))
( segid " " and resid 398 and name HD1%)
5.100 3.300 0.900 peak 476 spectrum 1 weight 0.10000E+01 volume 0.53518E-03 ppm1 8.687 ppm2 0.566 CV 1
OR { 476}
(( segid " " and resid 396 and name H ))
(( segid " " and resid 398 and name HG12))
ASSI { 2353}
(( segid " " and resid 352 and name H ))
(( segid " " and resid 352 and name HB ))
2.800 1.000 1.000 peak 2353 spectrum 1 weight 0.10000E+01 volume 0.17827E-02 ppm1 7.053 ppm2 1.144 CV 1
ASSI { 1053}
(( segid " " and resid 304 and name HE21))
(( segid " " and resid 304 and name HE22))
1.400 0.300 0.800 peak 1053 spectrum 1 weight 0.10000E+01 volume 0.23192E-01 ppm1 6.656 ppm2 7.016 CV 1
ASSI { 1730}
(( segid " " and resid 249 and name H ))
(( segid " " and resid 249 and name HG2 ))
3.500 1.600 1.600 peak 1730 spectrum 1 weight 0.10000E+01 volume 0.14304E-02 ppm1 7.300 ppm2 1.530 CV 1
ASSI { 775}
(( segid " " and resid 236 and name H ))
( segid " " and resid 236 and name HD1%)
4.500 2.500 1.500 peak 775 spectrum 1 weight 0.10000E+01 volume 0.14208E-02 ppm1 7.805 ppm2 0.839 CV 1
ASSI { 1301}
(( segid " " and resid 258 and name H ))
(( segid " " and resid 256 and name HA ))
3.700 1.700 1.700 peak 1301 spectrum 1 weight 0.10000E+01 volume 0.91637E-03 ppm1 8.128 ppm2 4.128 CV 1
ASSI { 1146}
(( segid " " and resid 368 and name H ))
(( segid " " and resid 368 and name HB3 ))
3.800 1.800 1.800 peak 1146 spectrum 1 weight 0.10000E+01 volume 0.92599E-03 ppm1 8.218 ppm2 2.676 CV 1
ASSI { 1537}
(( segid " " and resid 339 and name H ))
( segid " " and resid 329 and name HD1%)
4.600 2.600 1.400 peak 1537 spectrum 1 weight 0.10000E+01 volume 0.66418E-03 ppm1 8.369 ppm2 0.125 CV 1
ASSI { 2565}
(( segid " " and resid 291 and name H ))
(( segid " " and resid 291 and name HA ))
2.800 1.000 1.000 peak 2565 spectrum 1 weight 0.10000E+01 volume 0.32593E-02 ppm1 7.364 ppm2 3.953 CV 1
ASSI { 2173}
(( segid " " and resid 413 and name H ))
(( segid " " and resid 415 and name H ))
4.400 2.400 1.600 peak 2173 spectrum 1 weight 0.10000E+01 volume 0.40812E-03 ppm1 8.490 ppm2 7.965 CV 1
ASSI { 225}
(( segid " " and resid 373 and name H ))
(( segid " " and resid 372 and name HB ))
4.400 2.400 1.600 peak 225 spectrum 1 weight 0.10000E+01 volume 0.11262E-02 ppm1 8.238 ppm2 1.715 CV 1
ASSI { 2624}
(( segid " " and resid 386 and name H ))
(( segid " " and resid 385 and name HB3 ))
4.700 2.700 1.300 peak 2624 spectrum 1 weight 0.10000E+01 volume 0.55637E-03 ppm1 7.964 ppm2 2.830 CV 1
ASSI { 1191}
(( segid " " and resid 397 and name H ))
( segid " " and resid 396 and name HB% )
2.900 1.000 1.000 peak 1191 spectrum 1 weight 0.10000E+01 volume 0.30167E-02 ppm1 8.081 ppm2 1.356 CV 1
ASSI { 2690}
(( segid " " and resid 187 and name H ))
(( segid " " and resid 186 and name HA ))
1.700 0.400 0.500 peak 2690 spectrum 1 weight 0.10000E+01 volume 0.15961E-01 ppm1 8.524 ppm2 4.263 CV 1
ASSI { 625}
(( segid " " and resid 254 and name H ))
( segid " " and resid 258 and name HE% )
3.900 1.900 1.900 peak 625 spectrum 1 weight 0.10000E+01 volume 0.43509E-03 ppm1 8.704 ppm2 6.650 CV 1
ASSI { 2956}
(( segid " " and resid 259 and name H ))
(( segid " " and resid 258 and name HA ))
2.500 0.800 0.800 peak 2956 spectrum 1 weight 0.10000E+01 volume 0.42258E-02 ppm1 8.460 ppm2 4.412 CV 1
ASSI { 1252}
(( segid " " and resid 393 and name H ))
(( segid " " and resid 393 and name HG3 ))
2.900 1.100 1.100 peak 1252 spectrum 1 weight 0.10000E+01 volume 0.22967E-02 ppm1 8.269 ppm2 2.287 CV 1
ASSI { 1895}
(( segid " " and resid 409 and name H ))
(( segid " " and resid 409 and name HG ))
4.700 2.700 1.300 peak 1895 spectrum 1 weight 0.10000E+01 volume 0.73924E-03 ppm1 8.734 ppm2 1.400 CV 1
ASSI { 1535}
(( segid " " and resid 446 and name H ))
(( segid " " and resid 445 and name HG2 ))
3.500 1.500 1.500 peak 1535 spectrum 1 weight 0.10000E+01 volume 0.17211E-02 ppm1 7.644 ppm2 2.252 CV 1
ASSI { 2677}
(( segid " " and resid 304 and name H ))
(( segid " " and resid 304 and name HG3 ))
2.200 0.600 0.600 peak 2677 spectrum 1 weight 0.10000E+01 volume 0.36384E-02 ppm1 8.673 ppm2 2.273 CV 1
OR { 2677}
(( segid " " and resid 304 and name H ))
(( segid " " and resid 304 and name HB2 ))
ASSI { 2185}
(( segid " " and resid 335 and name H ))
(( segid " " and resid 334 and name HB3 ))
4.300 2.300 1.700 peak 2185 spectrum 1 weight 0.10000E+01 volume 0.85668E-03 ppm1 8.876 ppm2 1.971 CV 1
OR { 2185}
(( segid " " and resid 335 and name H ))
(( segid " " and resid 334 and name HB2 ))
ASSI { 115}
(( segid " " and resid 304 and name HE22))
(( segid " " and resid 304 and name HG3 ))
3.100 1.200 1.200 peak 115 spectrum 1 weight 0.10000E+01 volume 0.48438E-02 ppm1 7.013 ppm2 2.288 CV 1
OR { 115}
(( segid " " and resid 304 and name HE22))
(( segid " " and resid 304 and name HB2 ))
ASSI { 801}
(( segid " " and resid 301 and name HE22))
( segid " " and resid 297 and name HG2%)
3.600 1.700 1.700 peak 801 spectrum 1 weight 0.10000E+01 volume 0.58680E-02 ppm1 7.360 ppm2 1.123 CV 1
ASSI { 258}
(( segid " " and resid 409 and name H ))
( segid " " and resid 432 and name HG2%)
4.000 2.000 2.000 peak 258 spectrum 1 weight 0.10000E+01 volume 0.10819E-02 ppm1 8.733 ppm2 1.087 CV 1
OR { 258}
(( segid " " and resid 409 and name H ))
( segid " " and resid 432 and name HG1%)
ASSI { 1928}
(( segid " " and resid 347 and name H ))
(( segid " " and resid 348 and name HD3 ))
3.200 1.300 1.300 peak 1928 spectrum 1 weight 0.10000E+01 volume 0.11012E-02 ppm1 9.032 ppm2 3.740 CV 1
ASSI { 3025}
(( segid " " and resid 254 and name HD22))
(( segid " " and resid 254 and name HB3 ))
3.100 1.200 1.200 peak 3025 spectrum 1 weight 0.10000E+01 volume 0.43587E-02 ppm1 6.859 ppm2 2.954 CV 1
ASSI { 741}
(( segid " " and resid 423 and name H ))
(( segid " " and resid 422 and name HA ))
2.400 0.700 0.700 peak 741 spectrum 1 weight 0.10000E+01 volume 0.35943E-02 ppm1 8.688 ppm2 4.591 CV 1
ASSI { 1761}
(( segid " " and resid 425 and name H ))
(( segid " " and resid 422 and name HA ))
5.000 3.100 1.000 peak 1761 spectrum 1 weight 0.10000E+01 volume 0.33113E-03 ppm1 7.758 ppm2 4.597 CV 1
ASSI { 945}
(( segid " " and resid 268 and name H ))
( segid " " and resid 267 and name HD1%)
3.800 1.800 1.800 peak 945 spectrum 1 weight 0.10000E+01 volume 0.18924E-02 ppm1 7.869 ppm2 0.946 CV 1
OR { 945}
(( segid " " and resid 268 and name H ))
( segid " " and resid 267 and name HD2%)
ASSI { 1354}
(( segid " " and resid 268 and name H ))
(( segid " " and resid 267 and name HB3 ))
2.400 0.700 0.700 peak 1354 spectrum 1 weight 0.10000E+01 volume 0.14747E-02 ppm1 7.870 ppm2 2.265 CV 1
ASSI { 236}
(( segid " " and resid 336 and name H ))
(( segid " " and resid 332 and name HB3 ))
4.900 3.000 1.100 peak 236 spectrum 1 weight 0.10000E+01 volume 0.23872E-03 ppm1 9.128 ppm2 2.596 CV 1
ASSI { 1413}
(( segid " " and resid 226 and name H ))
(( segid " " and resid 226 and name HB2 ))
2.700 0.900 0.900 peak 1413 spectrum 1 weight 0.10000E+01 volume 0.17095E-02 ppm1 7.438 ppm2 1.526 CV 1
ASSI { 871}
(( segid " " and resid 316 and name H ))
( segid " " and resid 316 and name HD1%)
3.700 1.800 1.800 peak 871 spectrum 1 weight 0.10000E+01 volume 0.33921E-02 ppm1 8.716 ppm2 0.766 CV 1
OR { 871}
(( segid " " and resid 316 and name H ))
( segid " " and resid 316 and name HD2%)
ASSI { 1507}
(( segid " " and resid 293 and name HE ))
(( segid " " and resid 293 and name H ))
6.000 4.500 0.000 peak 1507 spectrum 1 weight 0.10000E+01 volume 0.23680E-03 ppm1 7.800 ppm2 7.019 CV 1
ASSI { 2853}
(( segid " " and resid 420 and name H ))
(( segid " " and resid 416 and name HA ))
3.900 1.900 1.900 peak 2853 spectrum 1 weight 0.10000E+01 volume 0.12899E-02 ppm1 7.494 ppm2 4.288 CV 1
ASSI { 2426}
(( segid " " and resid 304 and name HE21))
( segid " " and resid 367 and name HD1%)
2.900 1.100 1.100 peak 2426 spectrum 1 weight 0.10000E+01 volume 0.15440E-02 ppm1 6.655 ppm2 0.678 CV 1
ASSI { 2966}
(( segid " " and resid 352 and name H ))
(( segid " " and resid 352 and name HG12))
3.800 1.800 1.800 peak 2966 spectrum 1 weight 0.10000E+01 volume 0.11570E-02 ppm1 7.052 ppm2 1.763 CV 1
ASSI { 88}
(( segid " " and resid 397 and name H ))
( segid " " and resid 398 and name HD1%)
5.200 3.400 0.800 peak 88 spectrum 1 weight 0.10000E+01 volume 0.66996E-03 ppm1 8.082 ppm2 0.576 CV 1
OR { 88}
(( segid " " and resid 397 and name H ))
(( segid " " and resid 398 and name HG12))
ASSI { 1395}
(( segid " " and resid 264 and name H ))
( segid " " and resid 263 and name HG1%)
4.200 2.200 1.800 peak 1395 spectrum 1 weight 0.10000E+01 volume 0.13245E-02 ppm1 8.510 ppm2 0.077 CV 1
ASSI { 1099}
(( segid " " and resid 282 and name H ))
( segid " " and resid 283 and name HD1%)
5.200 3.300 0.800 peak 1099 spectrum 1 weight 0.10000E+01 volume 0.66803E-03 ppm1 8.700 ppm2 0.728 CV 1
ASSI { 960}
(( segid " " and resid 286 and name H ))
( segid " " and resid 283 and name HD1%)
4.800 2.900 1.200 peak 960 spectrum 1 weight 0.10000E+01 volume 0.77584E-03 ppm1 7.450 ppm2 0.726 CV 1
ASSI { 2322}
(( segid " " and resid 218 and name H ))
(( segid " " and resid 218 and name HA ))
3.100 1.200 1.200 peak 2322 spectrum 1 weight 0.10000E+01 volume 0.17423E-02 ppm1 7.976 ppm2 4.075 CV 1
ASSI { 1956}
(( segid " " and resid 361 and name H ))
( segid " " and resid 322 and name HG2%)
3.800 1.800 1.800 peak 1956 spectrum 1 weight 0.10000E+01 volume 0.87787E-03 ppm1 8.405 ppm2 0.409 CV 1
ASSI { 1360}
(( segid " " and resid 189 and name H ))
(( segid " " and resid 248 and name HB3 ))
5.800 4.200 0.200 peak 1360 spectrum 1 weight 0.10000E+01 volume 0.22332E-03 ppm1 8.874 ppm2 2.935 CV 1
ASSI { 523}
(( segid " " and resid 254 and name HD21))
(( segid " " and resid 256 and name H ))
3.400 1.400 1.400 peak 523 spectrum 1 weight 0.10000E+01 volume 0.77584E-03 ppm1 7.494 ppm2 8.256 CV 1
ASSI { 1216}
(( segid " " and resid 236 and name H ))
(( segid " " and resid 235 and name HA3 ))
3.000 1.200 1.200 peak 1216 spectrum 1 weight 0.10000E+01 volume 0.13765E-02 ppm1 7.802 ppm2 3.066 CV 1
ASSI { 703}
(( segid " " and resid 393 and name H ))
( segid " " and resid 394 and name HG2%)
4.300 2.300 1.700 peak 703 spectrum 1 weight 0.10000E+01 volume 0.80087E-03 ppm1 8.267 ppm2 1.237 CV 1
ASSI { 2674}
(( segid " " and resid 370 and name HD21))
(( segid " " and resid 369 and name HA3 ))
5.800 4.200 0.200 peak 2674 spectrum 1 weight 0.10000E+01 volume 0.28877E-03 ppm1 6.828 ppm2 4.017 CV 1
ASSI { 2199}
(( segid " " and resid 242 and name H ))
(( segid " " and resid 242 and name HB3 ))
2.300 0.700 0.700 peak 2199 spectrum 1 weight 0.10000E+01 volume 0.86747E-02 ppm1 7.548 ppm2 2.229 CV 1
OR { 2199}
(( segid " " and resid 242 and name H ))
(( segid " " and resid 242 and name HB2 ))
OR { 2199}
(( segid " " and resid 242 and name H ))
(( segid " " and resid 242 and name HG2 ))
ASSI { 3090}
(( segid " " and resid 214 and name H ))
(( segid " " and resid 214 and name HG3 ))
3.000 1.100 1.100 peak 3090 spectrum 1 weight 0.10000E+01 volume 0.52940E-03 ppm1 7.187 ppm2 1.236 CV 1
ASSI { 2667}
(( segid " " and resid 325 and name H ))
( segid " " and resid 217 and name HD1%)
5.100 3.300 0.900 peak 2667 spectrum 1 weight 0.10000E+01 volume 0.32150E-03 ppm1 8.505 ppm2 -0.042 CV 1
ASSI { 3058}
(( segid " " and resid 292 and name H ))
(( segid " " and resid 291 and name HB2 ))
4.300 2.300 1.700 peak 3058 spectrum 1 weight 0.10000E+01 volume 0.11224E-02 ppm1 7.810 ppm2 2.759 CV 1
ASSI { 2028}
(( segid " " and resid 363 and name H ))
( segid " " and resid 359 and name HG2%)
3.900 1.900 1.900 peak 2028 spectrum 1 weight 0.10000E+01 volume 0.57178E-03 ppm1 7.262 ppm2 -0.460 CV 1
ASSI { 2072}
(( segid " " and resid 265 and name H ))
(( segid " " and resid 267 and name H ))
4.300 2.300 1.700 peak 2072 spectrum 1 weight 0.10000E+01 volume 0.44662E-03 ppm1 7.748 ppm2 8.045 CV 1
ASSI { 306}
(( segid " " and resid 352 and name H ))
(( segid " " and resid 351 and name HB3 ))
3.500 1.500 1.500 peak 306 spectrum 1 weight 0.10000E+01 volume 0.20599E-02 ppm1 7.053 ppm2 2.070 CV 1
OR { 306}
(( segid " " and resid 352 and name H ))
(( segid " " and resid 351 and name HB2 ))
OR { 306}
(( segid " " and resid 352 and name H ))
(( segid " " and resid 351 and name HG3 ))
ASSI { 2206}
(( segid " " and resid 381 and name H ))
(( segid " " and resid 380 and name H ))
4.400 2.400 1.600 peak 2206 spectrum 1 weight 0.10000E+01 volume 0.42931E-03 ppm1 8.206 ppm2 9.027 CV 1
ASSI { 3077}
(( segid " " and resid 347 and name H ))
(( segid " " and resid 347 and name HB3 ))
3.200 1.300 1.300 peak 3077 spectrum 1 weight 0.10000E+01 volume 0.63915E-03 ppm1 9.033 ppm2 3.892 CV 1
OR { 3077}
(( segid " " and resid 347 and name H ))
(( segid " " and resid 347 and name HB2 ))
ASSI { 158}
(( segid " " and resid 365 and name HE21))
(( segid " " and resid 364 and name HA ))
5.000 3.100 1.000 peak 158 spectrum 1 weight 0.10000E+01 volume 0.27144E-03 ppm1 6.882 ppm2 3.633 CV 1
ASSI { 2399}
(( segid " " and resid 239 and name H ))
(( segid " " and resid 239 and name HA ))
3.000 1.100 1.100 peak 2399 spectrum 1 weight 0.10000E+01 volume 0.12764E-02 ppm1 7.094 ppm2 4.297 CV 1
ASSI { 2361}
(( segid " " and resid 406 and name H ))
(( segid " " and resid 406 and name HG3 ))
2.600 0.800 0.800 peak 2361 spectrum 1 weight 0.10000E+01 volume 0.17480E-02 ppm1 9.263 ppm2 2.111 CV 1
ASSI { 2217}
(( segid " " and resid 264 and name H ))
( segid " " and resid 230 and name HD1%)
3.800 1.800 1.800 peak 2217 spectrum 1 weight 0.10000E+01 volume 0.77006E-03 ppm1 8.514 ppm2 0.655 CV 1
ASSI { 1948}
(( segid " " and resid 410 and name H ))
(( segid " " and resid 409 and name HB3 ))
2.300 0.700 0.700 peak 1948 spectrum 1 weight 0.10000E+01 volume 0.17519E-02 ppm1 7.898 ppm2 1.931 CV 1
ASSI { 1264}
(( segid " " and resid 277 and name H ))
(( segid " " and resid 276 and name HB3 ))
4.900 3.100 1.100 peak 1264 spectrum 1 weight 0.10000E+01 volume 0.61606E-03 ppm1 8.687 ppm2 1.816 CV 1
OR { 1264}
(( segid " " and resid 277 and name H ))
(( segid " " and resid 276 and name HB2 ))
ASSI { 1564}
(( segid " " and resid 354 and name HD21))
(( segid " " and resid 354 and name HD22))
1.300 0.200 0.900 peak 1564 spectrum 1 weight 0.10000E+01 volume 0.28475E-01 ppm1 7.474 ppm2 6.452 CV 1
ASSI { 2785}
(( segid " " and resid 369 and name H ))
(( segid " " and resid 368 and name HB2 ))
2.200 0.600 0.600 peak 2785 spectrum 1 weight 0.10000E+01 volume 0.97027E-03 ppm1 7.758 ppm2 3.280 CV 1
ASSI { 62}
(( segid " " and resid 414 and name H ))
(( segid " " and resid 413 and name HB2 ))
3.600 1.600 1.600 peak 62 spectrum 1 weight 0.10000E+01 volume 0.19945E-02 ppm1 7.674 ppm2 3.118 CV 1
ASSI { 2118}
(( segid " " and resid 265 and name H ))
(( segid " " and resid 264 and name H ))
2.900 1.000 1.000 peak 2118 spectrum 1 weight 0.10000E+01 volume 0.13187E-02 ppm1 7.751 ppm2 8.508 CV 1
ASSI { 1913}
(( segid " " and resid 280 and name H ))
(( segid " " and resid 277 and name HB2 ))
3.300 1.300 1.300 peak 1913 spectrum 1 weight 0.10000E+01 volume 0.39081E-03 ppm1 7.658 ppm2 2.698 CV 1
ASSI { 1613}
(( segid " " and resid 412 and name H ))
(( segid " " and resid 412 and name HB3 ))
4.200 2.200 1.800 peak 1613 spectrum 1 weight 0.10000E+01 volume 0.78546E-03 ppm1 8.445 ppm2 1.881 CV 1
ASSI { 84}
(( segid " " and resid 258 and name H ))
( segid " " and resid 219 and name HE% )
4.700 2.700 1.300 peak 84 spectrum 1 weight 0.10000E+01 volume 0.34653E-03 ppm1 8.136 ppm2 6.401 CV 1
ASSI { 55}
(( segid " " and resid 351 and name HE22))
(( segid " " and resid 351 and name HG3 ))
3.300 1.400 1.400 peak 55 spectrum 1 weight 0.10000E+01 volume 0.57100E-02 ppm1 7.561 ppm2 2.117 CV 1
OR { 55}
(( segid " " and resid 351 and name HE22))
(( segid " " and resid 351 and name HB3 ))
OR { 55}
(( segid " " and resid 351 and name HE22))
(( segid " " and resid 351 and name HG2 ))
ASSI { 45}
(( segid " " and resid 419 and name H ))
( segid " " and resid 420 and name HD1%)
5.800 4.200 0.200 peak 45 spectrum 1 weight 0.10000E+01 volume 0.57368E-03 ppm1 7.959 ppm2 0.806 CV 1
OR { 45}
(( segid " " and resid 419 and name H ))
( segid " " and resid 420 and name HG2%)
ASSI { 1789}
(( segid " " and resid 244 and name H ))
(( segid " " and resid 244 and name HD2 ))
4.000 2.000 2.000 peak 1789 spectrum 1 weight 0.10000E+01 volume 0.16672E-02 ppm1 8.559 ppm2 0.964 CV 1
ASSI { 1118}
(( segid " " and resid 269 and name HE21))
(( segid " " and resid 269 and name HE22))
1.800 0.400 0.400 peak 1118 spectrum 1 weight 0.10000E+01 volume 0.88961E-02 ppm1 8.095 ppm2 6.862 CV 1
ASSI { 2144}
(( segid " " and resid 199 and name H ))
( segid " " and resid 198 and name HG1%)
3.200 1.300 1.300 peak 2144 spectrum 1 weight 0.10000E+01 volume 0.30090E-02 ppm1 7.772 ppm2 0.610 CV 1
OR { 2144}
(( segid " " and resid 199 and name H ))
( segid " " and resid 198 and name HG2%)
ASSI { 1595}
(( segid " " and resid 342 and name H ))
(( segid " " and resid 342 and name HB ))
2.500 0.800 0.800 peak 1595 spectrum 1 weight 0.10000E+01 volume 0.20772E-02 ppm1 8.646 ppm2 1.729 CV 1
ASSI { 2146}
(( segid " " and resid 340 and name HE22))
(( segid " " and resid 340 and name HE21))
1.100 0.100 1.100 peak 2146 spectrum 1 weight 0.10000E+01 volume 0.10363E+00 ppm1 7.417 ppm2 6.783 CV 1
ASSI { 1546}
(( segid " " and resid 200 and name H ))
(( segid " " and resid 200 and name HG2 ))
4.200 2.200 1.800 peak 1546 spectrum 1 weight 0.10000E+01 volume 0.10839E-02 ppm1 7.610 ppm2 1.726 CV 1
ASSI { 1879}
(( segid " " and resid 330 and name H ))
(( segid " " and resid 329 and name HG12))
4.500 2.600 1.500 peak 1879 spectrum 1 weight 0.10000E+01 volume 0.55253E-03 ppm1 8.629 ppm2 1.390 CV 1
ASSI { 3033}
(( segid " " and resid 425 and name H ))
(( segid " " and resid 425 and name HB2 ))
2.800 1.000 1.000 peak 3033 spectrum 1 weight 0.10000E+01 volume 0.24353E-02 ppm1 7.759 ppm2 1.623 CV 1
OR { 3033}
(( segid " " and resid 425 and name H ))
(( segid " " and resid 425 and name HD3 ))
OR { 3033}
(( segid " " and resid 425 and name H ))
(( segid " " and resid 425 and name HD2 ))
ASSI { 652}
(( segid " " and resid 213 and name H ))
( segid " " and resid 211 and name HB% )
5.000 3.100 1.000 peak 652 spectrum 1 weight 0.10000E+01 volume 0.41968E-03 ppm1 5.883 ppm2 1.722 CV 1
ASSI { 3028}
(( segid " " and resid 209 and name H ))
( segid " " and resid 209 and name HD2%)
5.400 3.600 0.600 peak 3028 spectrum 1 weight 0.10000E+01 volume 0.37925E-03 ppm1 7.833 ppm2 -0.896 CV 1
ASSI { 3160}
(( segid " " and resid 338 and name H ))
(( segid " " and resid 338 and name HA ))
3.500 1.500 1.500 peak 3160 spectrum 1 weight 0.10000E+01 volume 0.52365E-03 ppm1 7.706 ppm2 4.643 CV 1
ASSI { 1980}
(( segid " " and resid 410 and name HD21))
(( segid " " and resid 410 and name HD22))
1.200 0.200 1.000 peak 1980 spectrum 1 weight 0.10000E+01 volume 0.27268E-01 ppm1 6.913 ppm2 7.485 CV 1
ASSI { 2634}
(( segid " " and resid 257 and name H ))
(( segid " " and resid 254 and name HA ))
4.700 2.700 1.300 peak 2634 spectrum 1 weight 0.10000E+01 volume 0.38697E-03 ppm1 7.442 ppm2 4.860 CV 1
ASSI { 1116}
(( segid " " and resid 394 and name H ))
(( segid " " and resid 393 and name HG3 ))
4.100 2.100 1.900 peak 1116 spectrum 1 weight 0.10000E+01 volume 0.19810E-02 ppm1 7.545 ppm2 2.289 CV 1
ASSI { 1944}
(( segid " " and resid 221 and name H ))
(( segid " " and resid 220 and name HA ))
4.000 2.000 2.000 peak 1944 spectrum 1 weight 0.10000E+01 volume 0.26952E-03 ppm1 8.735 ppm2 3.330 CV 1
ASSI { 900}
(( segid " " and resid 294 and name H ))
(( segid " " and resid 293 and name HB3 ))
2.200 0.600 0.600 peak 900 spectrum 1 weight 0.10000E+01 volume 0.14246E-02 ppm1 8.530 ppm2 1.709 CV 1
OR { 900}
(( segid " " and resid 294 and name H ))
(( segid " " and resid 293 and name HB2 ))
ASSI { 1518}
(( segid " " and resid 254 and name HD22))
(( segid " " and resid 254 and name H ))
5.000 3.100 1.000 peak 1518 spectrum 1 weight 0.10000E+01 volume 0.89518E-03 ppm1 6.860 ppm2 8.692 CV 1
ASSI { 2458}
(( segid " " and resid 227 and name H ))
(( segid " " and resid 224 and name HA3 ))
5.200 3.400 0.800 peak 2458 spectrum 1 weight 0.10000E+01 volume 0.25219E-03 ppm1 7.131 ppm2 3.608 CV 1
ASSI { 269}
(( segid " " and resid 428 and name H ))
(( segid " " and resid 426 and name HB2 ))
3.800 1.800 1.800 peak 269 spectrum 1 weight 0.10000E+01 volume 0.13996E-02 ppm1 7.728 ppm2 1.882 CV 1
OR { 269}
(( segid " " and resid 428 and name H ))
(( segid " " and resid 426 and name HB3 ))
ASSI { 2366}
(( segid " " and resid 244 and name H ))
(( segid " " and resid 241 and name HA ))
3.400 1.400 1.400 peak 2366 spectrum 1 weight 0.10000E+01 volume 0.94908E-03 ppm1 8.556 ppm2 4.141 CV 1
ASSI { 2545}
(( segid " " and resid 331 and name H ))
(( segid " " and resid 331 and name HB3 ))
2.900 1.100 1.100 peak 2545 spectrum 1 weight 0.10000E+01 volume 0.14747E-02 ppm1 7.178 ppm2 2.550 CV 1
OR { 2545}
(( segid " " and resid 331 and name H ))
(( segid " " and resid 331 and name HB2 ))
ASSI { 1643}
(( segid " " and resid 291 and name H ))
(( segid " " and resid 291 and name HB3 ))
2.500 0.800 0.800 peak 1643 spectrum 1 weight 0.10000E+01 volume 0.52577E-02 ppm1 7.364 ppm2 3.093 CV 1
ASSI { 2871}
(( segid " " and resid 356 and name H ))
(( segid " " and resid 356 and name HB ))
2.700 0.900 0.900 peak 2871 spectrum 1 weight 0.10000E+01 volume 0.16479E-02 ppm1 7.365 ppm2 1.961 CV 1
ASSI { 1343}
(( segid " " and resid 269 and name HE22))
(( segid " " and resid 269 and name HB2 ))
4.400 2.400 1.600 peak 1343 spectrum 1 weight 0.10000E+01 volume 0.18905E-02 ppm1 6.866 ppm2 2.184 CV 1
ASSI { 1724}
(( segid " " and resid 206 and name H ))
(( segid " " and resid 205 and name HB2 ))
3.800 1.800 1.800 peak 1724 spectrum 1 weight 0.10000E+01 volume 0.86630E-03 ppm1 7.662 ppm2 2.754 CV 1
ASSI { 2867}
(( segid " " and resid 205 and name H ))
(( segid " " and resid 205 and name HA ))
2.900 1.100 1.100 peak 2867 spectrum 1 weight 0.10000E+01 volume 0.20734E-02 ppm1 6.381 ppm2 3.820 CV 1
ASSI { 2466}
(( segid " " and resid 378 and name H ))
(( segid " " and resid 377 and name HA ))
2.600 0.800 0.800 peak 2466 spectrum 1 weight 0.10000E+01 volume 0.27799E-02 ppm1 8.584 ppm2 4.683 CV 1
ASSI { 834}
(( segid " " and resid 219 and name H ))
( segid " " and resid 217 and name HG2%)
5.100 3.200 0.900 peak 834 spectrum 1 weight 0.10000E+01 volume 0.44087E-03 ppm1 7.699 ppm2 0.494 CV 1
OR { 834}
(( segid " " and resid 219 and name H ))
(( segid " " and resid 217 and name HG13))
OR { 834}
(( segid " " and resid 219 and name H ))
(( segid " " and resid 217 and name HG12))
ASSI { 2722}
(( segid " " and resid 320 and name H ))
(( segid " " and resid 320 and name HD1 ))
2.600 0.800 0.800 peak 2722 spectrum 1 weight 0.10000E+01 volume 0.21138E-02 ppm1 8.417 ppm2 7.259 CV 1
ASSI { 3083}
(( segid " " and resid 221 and name H ))
(( segid " " and resid 218 and name HA ))
3.500 1.500 1.500 peak 3083 spectrum 1 weight 0.10000E+01 volume 0.84515E-03 ppm1 8.747 ppm2 4.077 CV 1
ASSI { 2793}
(( segid " " and resid 230 and name H ))
(( segid " " and resid 230 and name HB ))
2.400 0.700 0.700 peak 2793 spectrum 1 weight 0.10000E+01 volume 0.24122E-02 ppm1 7.111 ppm2 1.821 CV 1
ASSI { 1419}
(( segid " " and resid 338 and name H ))
(( segid " " and resid 332 and name HA ))
3.300 3.300 2.700 peak 1419 spectrum 1 weight 0.10000E+01 volume 0.28877E-03 ppm1 7.708 ppm2 4.173 CV 1
ASSI { 2716}
(( segid " " and resid 312 and name H ))
(( segid " " and resid 312 and name HB3 ))
2.800 1.000 1.000 peak 2716 spectrum 1 weight 0.10000E+01 volume 0.28685E-02 ppm1 8.789 ppm2 1.939 CV 1
ASSI { 2364}
(( segid " " and resid 281 and name H ))
(( segid " " and resid 281 and name HB3 ))
3.600 1.600 1.600 peak 2364 spectrum 1 weight 0.10000E+01 volume 0.25701E-02 ppm1 9.177 ppm2 1.918 CV 1
ASSI { 2731}
(( segid " " and resid 233 and name H ))
( segid " " and resid 233 and name HG2%)
2.400 0.700 0.700 peak 2731 spectrum 1 weight 0.10000E+01 volume 0.46435E-02 ppm1 7.995 ppm2 0.949 CV 1
ASSI { 1912}
(( segid " " and resid 257 and name H ))
( segid " " and resid 258 and name HD% )
3.500 1.500 1.500 peak 1912 spectrum 1 weight 0.10000E+01 volume 0.19175E-02 ppm1 7.440 ppm2 7.096 CV 1
ASSI { 2948}
(( segid " " and resid 318 and name H ))
(( segid " " and resid 317 and name HA ))
3.500 1.500 1.500 peak 2948 spectrum 1 weight 0.10000E+01 volume 0.83165E-03 ppm1 8.050 ppm2 3.124 CV 1
ASSI { 2098}
(( segid " " and resid 307 and name H ))
(( segid " " and resid 304 and name HA ))
3.500 1.600 1.600 peak 2098 spectrum 1 weight 0.10000E+01 volume 0.72771E-03 ppm1 8.734 ppm2 3.977 CV 1
ASSI { 640}
(( segid " " and resid 234 and name H ))
( segid " " and resid 233 and name HG2%)
3.800 1.800 1.800 peak 640 spectrum 1 weight 0.10000E+01 volume 0.17076E-02 ppm1 8.666 ppm2 0.897 CV 1
OR { 640}
(( segid " " and resid 234 and name H ))
( segid " " and resid 233 and name HG1%)
ASSI { 2081}
(( segid " " and resid 320 and name HE1 ))
( segid " " and resid 371 and name HG1%)
2.900 1.000 1.000 peak 2081 spectrum 1 weight 0.10000E+01 volume 0.33709E-02 ppm1 10.124 ppm2 0.386 CV 1
ASSI { 2821}
(( segid " " and resid 252 and name H ))
(( segid " " and resid 251 and name HA ))
2.700 0.900 0.900 peak 2821 spectrum 1 weight 0.10000E+01 volume 0.38464E-02 ppm1 8.425 ppm2 4.216 CV 1
ASSI { 2754}
(( segid " " and resid 317 and name H ))
(( segid " " and resid 317 and name HB2 ))
2.500 0.800 0.800 peak 2754 spectrum 1 weight 0.10000E+01 volume 0.20946E-02 ppm1 7.528 ppm2 1.366 CV 1
ASSI { 2387}
(( segid " " and resid 382 and name HE1 ))
( segid " " and resid 387 and name HG2%)
5.700 4.000 0.300 peak 2387 spectrum 1 weight 0.10000E+01 volume 0.37734E-03 ppm1 9.607 ppm2 1.120 CV 1
ASSI { 1646}
(( segid " " and resid 373 and name H ))
(( segid " " and resid 372 and name H ))
4.300 2.300 1.700 peak 1646 spectrum 1 weight 0.10000E+01 volume 0.62953E-03 ppm1 8.239 ppm2 7.926 CV 1
ASSI { 2708}
(( segid " " and resid 246 and name H ))
( segid " " and resid 243 and name HD2%)
5.400 3.600 0.600 peak 2708 spectrum 1 weight 0.10000E+01 volume 0.39850E-03 ppm1 7.452 ppm2 0.180 CV 1
ASSI { 319}
(( segid " " and resid 293 and name H ))
(( segid " " and resid 298 and name HG2 ))
6.000 4.500 0.000 peak 319 spectrum 1 weight 0.10000E+01 volume 0.46781E-03 ppm1 7.001 ppm2 2.180 CV 1
OR { 319}
(( segid " " and resid 293 and name H ))
(( segid " " and resid 298 and name HG3 ))
ASSI { 548}
(( segid " " and resid 304 and name H ))
(( segid " " and resid 302 and name HA ))
4.200 2.200 1.800 peak 548 spectrum 1 weight 0.10000E+01 volume 0.34845E-03 ppm1 8.674 ppm2 4.336 CV 1
ASSI { 2828}
(( segid " " and resid 321 and name H ))
(( segid " " and resid 320 and name H ))
3.100 1.200 1.200 peak 2828 spectrum 1 weight 0.10000E+01 volume 0.80665E-03 ppm1 8.588 ppm2 8.414 CV 1
ASSI { 861}
(( segid " " and resid 378 and name H ))
(( segid " " and resid 377 and name HB3 ))
3.900 1.900 1.900 peak 861 spectrum 1 weight 0.10000E+01 volume 0.15940E-02 ppm1 8.584 ppm2 1.933 CV 1
OR { 861}
(( segid " " and resid 378 and name H ))
(( segid " " and resid 377 and name HB2 ))
ASSI { 2099}
(( segid " " and resid 248 and name H ))
(( segid " " and resid 245 and name HA ))
3.400 1.500 1.500 peak 2099 spectrum 1 weight 0.10000E+01 volume 0.12745E-02 ppm1 8.881 ppm2 3.987 CV 1
ASSI { 2613}
(( segid " " and resid 413 and name H ))
( segid " " and resid 429 and name HD2%)
3.400 1.500 1.500 peak 2613 spectrum 1 weight 0.10000E+01 volume 0.19964E-02 ppm1 8.483 ppm2 0.664 CV 1
ASSI { 1619}
(( segid " " and resid 253 and name H ))
(( segid " " and resid 252 and name HA ))
2.100 0.500 0.500 peak 1619 spectrum 1 weight 0.10000E+01 volume 0.13732E-01 ppm1 8.257 ppm2 4.345 CV 1
ASSI { 2656}
(( segid " " and resid 395 and name H ))
( segid " " and resid 394 and name HG2%)
5.100 3.200 0.900 peak 2656 spectrum 1 weight 0.10000E+01 volume 0.56021E-03 ppm1 9.083 ppm2 1.237 CV 1
ASSI { 1670}
(( segid " " and resid 313 and name H ))
(( segid " " and resid 314 and name H ))
2.800 1.000 1.000 peak 1670 spectrum 1 weight 0.10000E+01 volume 0.19136E-02 ppm1 8.627 ppm2 7.345 CV 1
ASSI { 2780}
(( segid " " and resid 192 and name H ))
(( segid " " and resid 192 and name HG12))
3.000 1.200 1.200 peak 2780 spectrum 1 weight 0.10000E+01 volume 0.65840E-03 ppm1 6.704 ppm2 1.351 CV 1
ASSI { 2925}
(( segid " " and resid 375 and name HE21))
( segid " " and resid 377 and name HE% )
3.900 1.900 1.900 peak 2925 spectrum 1 weight 0.10000E+01 volume 0.97605E-03 ppm1 6.679 ppm2 2.001 CV 1
ASSI { 2114}
(( segid " " and resid 375 and name HE21))
(( segid " " and resid 375 and name HB2 ))
3.500 1.500 1.500 peak 2114 spectrum 1 weight 0.10000E+01 volume 0.11358E-02 ppm1 6.677 ppm2 1.877 CV 1
OR { 2114}
(( segid " " and resid 375 and name HE21))
(( segid " " and resid 375 and name HB3 ))
ASSI { 2049}
(( segid " " and resid 265 and name H ))
(( segid " " and resid 265 and name HA ))
2.700 0.900 0.900 peak 2049 spectrum 1 weight 0.10000E+01 volume 0.31226E-02 ppm1 7.752 ppm2 4.112 CV 1
ASSI { 1786}
(( segid " " and resid 274 and name H ))
(( segid " " and resid 274 and name HB3 ))
3.300 1.400 1.400 peak 1786 spectrum 1 weight 0.10000E+01 volume 0.36810E-02 ppm1 7.027 ppm2 1.824 CV 1
ASSI { 2393}
(( segid " " and resid 359 and name H ))
( segid " " and resid 359 and name HG1%)
2.000 0.500 0.500 peak 2393 spectrum 1 weight 0.10000E+01 volume 0.51787E-02 ppm1 7.196 ppm2 0.900 CV 1
ASSI { 2196}
(( segid " " and resid 363 and name H ))
(( segid " " and resid 360 and name HA ))
3.200 1.300 1.300 peak 2196 spectrum 1 weight 0.10000E+01 volume 0.11801E-02 ppm1 7.264 ppm2 4.260 CV 1
ASSI { 1752}
(( segid " " and resid 386 and name H ))
( segid " " and resid 386 and name HB% )
2.700 0.900 0.900 peak 1752 spectrum 1 weight 0.10000E+01 volume 0.84437E-02 ppm1 7.961 ppm2 1.463 CV 1
ASSI { 2102}
(( segid " " and resid 196 and name H ))
(( segid " " and resid 193 and name HB2 ))
2.800 1.000 1.000 peak 2102 spectrum 1 weight 0.10000E+01 volume 0.10608E-02 ppm1 7.179 ppm2 2.332 CV 1
ASSI { 2034}
(( segid " " and resid 429 and name H ))
( segid " " and resid 416 and name HD1%)
2.700 2.700 3.300 peak 2034 spectrum 1 weight 0.10000E+01 volume 0.90868E-03 ppm1 8.118 ppm2 0.861 CV 1
ASSI { 1627}
(( segid " " and resid 421 and name H ))
(( segid " " and resid 420 and name H ))
4.200 2.200 1.800 peak 1627 spectrum 1 weight 0.10000E+01 volume 0.13361E-02 ppm1 8.385 ppm2 7.495 CV 1
ASSI { 3189}
(( segid " " and resid 431 and name H ))
(( segid " " and resid 430 and name H ))
3.200 1.300 1.300 peak 3189 spectrum 1 weight 0.10000E+01 volume 0.68343E-03 ppm1 7.968 ppm2 7.786 CV 1
ASSI { 1397}
(( segid " " and resid 424 and name H ))
(( segid " " and resid 424 and name HB2 ))
2.500 0.800 0.800 peak 1397 spectrum 1 weight 0.10000E+01 volume 0.61278E-02 ppm1 8.280 ppm2 3.912 CV 1
OR { 1397}
(( segid " " and resid 424 and name H ))
(( segid " " and resid 424 and name HB3 ))
ASSI { 2707}
(( segid " " and resid 240 and name H ))
( segid " " and resid 240 and name HG1%)
4.000 2.000 2.000 peak 2707 spectrum 1 weight 0.10000E+01 volume 0.31110E-02 ppm1 8.016 ppm2 1.046 CV 1
ASSI { 1306}
(( segid " " and resid 196 and name H ))
(( segid " " and resid 193 and name HG2 ))
3.700 1.700 1.700 peak 1306 spectrum 1 weight 0.10000E+01 volume 0.12436E-02 ppm1 7.179 ppm2 2.094 CV 1
ASSI { 2590}
(( segid " " and resid 247 and name H ))
( segid " " and resid 247 and name HD% )
2.900 1.000 1.000 peak 2590 spectrum 1 weight 0.10000E+01 volume 0.17750E-02 ppm1 8.434 ppm2 7.341 CV 1
ASSI { 1899}
(( segid " " and resid 281 and name H ))
(( segid " " and resid 280 and name HB ))
2.400 0.700 0.700 peak 1899 spectrum 1 weight 0.10000E+01 volume 0.24411E-02 ppm1 9.178 ppm2 4.562 CV 1
ASSI { 1713}
(( segid " " and resid 284 and name H ))
( segid " " and resid 280 and name HG2%)
2.900 2.900 3.100 peak 1713 spectrum 1 weight 0.10000E+01 volume 0.56021E-03 ppm1 8.115 ppm2 1.122 CV 1
ASSI { 2281}
(( segid " " and resid 391 and name H ))
(( segid " " and resid 392 and name HD3 ))
4.700 2.800 1.300 peak 2281 spectrum 1 weight 0.10000E+01 volume 0.61606E-03 ppm1 8.204 ppm2 3.572 CV 1
ASSI { 1030}
(( segid " " and resid 257 and name H ))
(( segid " " and resid 254 and name HD22))
3.500 1.500 1.500 peak 1030 spectrum 1 weight 0.10000E+01 volume 0.64493E-03 ppm1 7.444 ppm2 6.862 CV 1
ASSI { 1951}
(( segid " " and resid 185 and name H ))
( segid " " and resid 186 and name HD2%)
5.200 3.300 0.800 peak 1951 spectrum 1 weight 0.10000E+01 volume 0.27722E-03 ppm1 8.455 ppm2 0.797 CV 1
OR { 1951}
(( segid " " and resid 185 and name H ))
( segid " " and resid 186 and name HD1%)
ASSI { 1470}
(( segid " " and resid 341 and name HD22))
(( segid " " and resid 341 and name HA ))
4.500 2.500 1.500 peak 1470 spectrum 1 weight 0.10000E+01 volume 0.77968E-03 ppm1 7.336 ppm2 4.419 CV 1
ASSI { 2242}
(( segid " " and resid 261 and name H ))
(( segid " " and resid 261 and name HB2 ))
3.500 1.500 1.500 peak 2242 spectrum 1 weight 0.10000E+01 volume 0.23448E-02 ppm1 8.907 ppm2 2.267 CV 1
ASSI { 1776}
(( segid " " and resid 315 and name H ))
( segid " " and resid 315 and name HD% )
4.700 2.700 1.300 peak 1776 spectrum 1 weight 0.10000E+01 volume 0.11628E-02 ppm1 8.319 ppm2 7.050 CV 1
ASSI { 2074}
(( segid " " and resid 441 and name H ))
(( segid " " and resid 438 and name HA ))
2.700 0.900 0.900 peak 2074 spectrum 1 weight 0.10000E+01 volume 0.38274E-02 ppm1 7.638 ppm2 4.059 CV 1
ASSI { 913}
(( segid " " and resid 417 and name H ))
(( segid " " and resid 415 and name HB3 ))
4.700 2.800 1.300 peak 913 spectrum 1 weight 0.10000E+01 volume 0.52171E-03 ppm1 7.762 ppm2 2.564 CV 1
ASSI { 1103}
(( segid " " and resid 185 and name H ))
(( segid " " and resid 186 and name H ))
4.600 2.700 1.400 peak 1103 spectrum 1 weight 0.10000E+01 volume 0.75274E-03 ppm1 8.464 ppm2 8.049 CV 1
ASSI { 2698}
(( segid " " and resid 322 and name H ))
(( segid " " and resid 321 and name HG ))
4.200 2.200 1.800 peak 2698 spectrum 1 weight 0.10000E+01 volume 0.37734E-03 ppm1 8.218 ppm2 1.763 CV 1
ASSI { 2332}
(( segid " " and resid 283 and name H ))
( segid " " and resid 279 and name HD2%)
5.600 3.900 0.400 peak 2332 spectrum 1 weight 0.10000E+01 volume 0.32920E-03 ppm1 7.322 ppm2 0.390 CV 1
ASSI { 2774}
(( segid " " and resid 238 and name H ))
(( segid " " and resid 240 and name H ))
4.500 2.600 1.500 peak 2774 spectrum 1 weight 0.10000E+01 volume 0.25797E-03 ppm1 8.667 ppm2 8.038 CV 1
ASSI { 1276}
(( segid " " and resid 272 and name H ))
(( segid " " and resid 271 and name HB2 ))
3.000 1.100 1.100 peak 1276 spectrum 1 weight 0.10000E+01 volume 0.17095E-02 ppm1 8.504 ppm2 1.261 CV 1
ASSI { 1532}
(( segid " " and resid 295 and name H ))
(( segid " " and resid 299 and name HE2 ))
4.900 3.000 1.100 peak 1532 spectrum 1 weight 0.10000E+01 volume 0.30995E-03 ppm1 7.387 ppm2 2.885 CV 1
ASSI { 1672}
(( segid " " and resid 361 and name H ))
(( segid " " and resid 358 and name HA ))
3.600 1.600 1.600 peak 1672 spectrum 1 weight 0.10000E+01 volume 0.78162E-03 ppm1 8.405 ppm2 4.020 CV 1
ASSI { 2571}
(( segid " " and resid 361 and name H ))
(( segid " " and resid 361 and name HB3 ))
4.000 2.000 2.000 peak 2571 spectrum 1 weight 0.10000E+01 volume 0.13418E-02 ppm1 8.406 ppm2 2.545 CV 1
ASSI { 228}
(( segid " " and resid 410 and name HD22))
( segid " " and resid 412 and name HD1%)
4.000 2.000 2.000 peak 228 spectrum 1 weight 0.10000E+01 volume 0.77006E-03 ppm1 7.495 ppm2 0.793 CV 1
ASSI { 2478}
(( segid " " and resid 196 and name H ))
(( segid " " and resid 196 and name HB2 ))
2.800 1.000 1.000 peak 2478 spectrum 1 weight 0.10000E+01 volume 0.16229E-02 ppm1 7.179 ppm2 2.628 CV 1
ASSI { 1628}
(( segid " " and resid 211 and name H ))
(( segid " " and resid 201 and name HA ))
5.300 3.500 0.700 peak 1628 spectrum 1 weight 0.10000E+01 volume 0.40622E-03 ppm1 7.468 ppm2 4.944 CV 1
ASSI { 2225}
(( segid " " and resid 195 and name H ))
(( segid " " and resid 194 and name HB2 ))
3.200 1.200 1.200 peak 2225 spectrum 1 weight 0.10000E+01 volume 0.14708E-02 ppm1 8.992 ppm2 1.523 CV 1
OR { 2225}
(( segid " " and resid 195 and name H ))
(( segid " " and resid 194 and name HB3 ))
ASSI { 2371}
(( segid " " and resid 290 and name H ))
(( segid " " and resid 291 and name HB2 ))
5.100 3.300 0.900 peak 2371 spectrum 1 weight 0.10000E+01 volume 0.52365E-03 ppm1 7.821 ppm2 2.755 CV 1
ASSI { 2734}
(( segid " " and resid 234 and name H ))
(( segid " " and resid 233 and name H ))
5.700 4.100 0.300 peak 2734 spectrum 1 weight 0.10000E+01 volume 0.22139E-03 ppm1 8.664 ppm2 8.028 CV 1
ASSI { 2647}
(( segid " " and resid 248 and name H ))
(( segid " " and resid 248 and name HB2 ))
3.000 1.100 1.100 peak 2647 spectrum 1 weight 0.10000E+01 volume 0.17192E-02 ppm1 8.880 ppm2 2.522 CV 1
ASSI { 3202}
(( segid " " and resid 388 and name H ))
(( segid " " and resid 389 and name HD3 ))
3.600 1.700 1.700 peak 3202 spectrum 1 weight 0.10000E+01 volume 0.58524E-03 ppm1 8.236 ppm2 2.790 CV 1
ASSI { 1180}
(( segid " " and resid 371 and name H ))
( segid " " and resid 371 and name HG2%)
2.500 0.800 0.800 peak 1180 spectrum 1 weight 0.10000E+01 volume 0.57830E-02 ppm1 7.540 ppm2 0.969 CV 1
ASSI { 740}
(( segid " " and resid 419 and name H ))
(( segid " " and resid 420 and name HB ))
4.700 2.800 1.300 peak 740 spectrum 1 weight 0.10000E+01 volume 0.88749E-03 ppm1 7.957 ppm2 1.770 CV 1
ASSI { 1910}
(( segid " " and resid 333 and name H ))
(( segid " " and resid 333 and name HA ))
2.700 0.900 0.900 peak 1910 spectrum 1 weight 0.10000E+01 volume 0.35481E-02 ppm1 8.641 ppm2 4.007 CV 1
ASSI { 2405}
(( segid " " and resid 220 and name H ))
(( segid " " and resid 220 and name HA ))
3.000 1.100 1.100 peak 2405 spectrum 1 weight 0.10000E+01 volume 0.71615E-03 ppm1 8.677 ppm2 3.312 CV 1
ASSI { 43}
(( segid " " and resid 288 and name H ))
( segid " " and resid 356 and name HG1%)
3.900 1.900 1.900 peak 43 spectrum 1 weight 0.10000E+01 volume 0.13226E-02 ppm1 7.477 ppm2 0.781 CV 1
ASSI { 1350}
(( segid " " and resid 352 and name H ))
(( segid " " and resid 351 and name HA ))
2.600 0.800 0.800 peak 1350 spectrum 1 weight 0.10000E+01 volume 0.32516E-02 ppm1 7.053 ppm2 3.842 CV 1
ASSI { 1986}
(( segid " " and resid 356 and name H ))
(( segid " " and resid 354 and name HA ))
3.500 1.500 1.500 peak 1986 spectrum 1 weight 0.10000E+01 volume 0.86056E-03 ppm1 7.368 ppm2 4.186 CV 1
ASSI { 997}
(( segid " " and resid 243 and name H ))
(( segid " " and resid 242 and name HA ))
3.600 1.600 1.600 peak 997 spectrum 1 weight 0.10000E+01 volume 0.11955E-02 ppm1 7.867 ppm2 3.984 CV 1
ASSI { 891}
(( segid " " and resid 185 and name HD22))
(( segid " " and resid 188 and name HB2 ))
4.900 3.000 1.100 peak 891 spectrum 1 weight 0.10000E+01 volume 0.10454E-02 ppm1 7.565 ppm2 2.120 CV 1
ASSI { 2570}
(( segid " " and resid 342 and name H ))
(( segid " " and resid 342 and name HG13))
4.100 2.100 1.900 peak 2570 spectrum 1 weight 0.10000E+01 volume 0.91446E-03 ppm1 8.634 ppm2 1.315 CV 1
ASSI { 1219}
(( segid " " and resid 262 and name H ))
(( segid " " and resid 261 and name HB3 ))
4.100 2.100 1.900 peak 1219 spectrum 1 weight 0.10000E+01 volume 0.87018E-03 ppm1 7.888 ppm2 3.050 CV 1
ASSI { 1281}
(( segid " " and resid 395 and name HE21))
( segid " " and resid 446 and name HB% )
4.000 2.000 2.000 peak 1281 spectrum 1 weight 0.10000E+01 volume 0.41584E-03 ppm1 7.771 ppm2 1.266 CV 1
ASSI { 2253}
(( segid " " and resid 301 and name HE22))
(( segid " " and resid 301 and name HG2 ))
3.200 1.300 1.300 peak 2253 spectrum 1 weight 0.10000E+01 volume 0.51459E-02 ppm1 7.360 ppm2 2.494 CV 1
ASSI { 1629}
(( segid " " and resid 230 and name H ))
( segid " " and resid 230 and name HD1%)
4.400 2.400 1.600 peak 1629 spectrum 1 weight 0.10000E+01 volume 0.15882E-02 ppm1 7.112 ppm2 0.669 CV 1
ASSI { 2961}
(( segid " " and resid 390 and name H ))
(( segid " " and resid 389 and name HA ))
2.000 0.500 0.500 peak 2961 spectrum 1 weight 0.10000E+01 volume 0.94295E-02 ppm1 8.064 ppm2 4.273 CV 1
ASSI { 2652}
(( segid " " and resid 370 and name HD22))
(( segid " " and resid 370 and name H ))
3.900 1.900 1.900 peak 2652 spectrum 1 weight 0.10000E+01 volume 0.87787E-03 ppm1 7.522 ppm2 8.410 CV 1
ASSI { 1391}
(( segid " " and resid 399 and name H ))
(( segid " " and resid 398 and name HA ))
4.300 2.300 1.700 peak 1391 spectrum 1 weight 0.10000E+01 volume 0.28492E-03 ppm1 8.344 ppm2 3.428 CV 1
ASSI { 1821}
(( segid " " and resid 396 and name H ))
(( segid " " and resid 397 and name H ))
3.000 1.100 1.100 peak 1821 spectrum 1 weight 0.10000E+01 volume 0.13630E-02 ppm1 8.690 ppm2 8.076 CV 1
ASSI { 1982}
(( segid " " and resid 352 and name H ))
(( segid " " and resid 347 and name HA ))
3.100 1.200 1.200 peak 1982 spectrum 1 weight 0.10000E+01 volume 0.18597E-02 ppm1 7.053 ppm2 4.644 CV 1
ASSI { 1803}
(( segid " " and resid 370 and name HD21))
(( segid " " and resid 370 and name H ))
3.200 1.300 1.300 peak 1803 spectrum 1 weight 0.10000E+01 volume 0.93946E-03 ppm1 6.834 ppm2 8.409 CV 1
ASSI { 2365}
(( segid " " and resid 304 and name HE22))
( segid " " and resid 300 and name HG1%)
6.000 4.500 0.000 peak 2365 spectrum 1 weight 0.10000E+01 volume 0.44856E-03 ppm1 7.014 ppm2 0.059 CV 1
ASSI { 612}
(( segid " " and resid 201 and name H ))
(( segid " " and resid 202 and name HG2 ))
4.700 2.700 1.300 peak 612 spectrum 1 weight 0.10000E+01 volume 0.59293E-03 ppm1 7.502 ppm2 2.284 CV 1
OR { 612}
(( segid " " and resid 201 and name H ))
(( segid " " and resid 202 and name HB3 ))
ASSI { 3015}
(( segid " " and resid 239 and name H ))
( segid " " and resid 236 and name HG2%)
2.500 0.800 0.800 peak 3015 spectrum 1 weight 0.10000E+01 volume 0.32612E-02 ppm1 7.097 ppm2 0.986 CV 1
ASSI { 2873}
(( segid " " and resid 417 and name HE22))
(( segid " " and resid 417 and name HB2 ))
4.700 2.800 1.300 peak 2873 spectrum 1 weight 0.10000E+01 volume 0.10338E-02 ppm1 6.741 ppm2 2.069 CV 1
OR { 2873}
(( segid " " and resid 417 and name HE22))
(( segid " " and resid 417 and name HB3 ))
ASSI { 1735}
(( segid " " and resid 319 and name H ))
( segid " " and resid 368 and name HD% )
5.100 3.200 0.900 peak 1735 spectrum 1 weight 0.10000E+01 volume 0.59487E-03 ppm1 7.857 ppm2 7.148 CV 1
ASSI { 2921}
(( segid " " and resid 277 and name HD22))
(( segid " " and resid 277 and name HB3 ))
4.100 2.100 1.900 peak 2921 spectrum 1 weight 0.10000E+01 volume 0.73156E-03 ppm1 6.128 ppm2 1.989 CV 1
ASSI { 2959}
(( segid " " and resid 357 and name H ))
( segid " " and resid 357 and name HD2%)
2.400 0.700 0.700 peak 2959 spectrum 1 weight 0.10000E+01 volume 0.24565E-02 ppm1 8.144 ppm2 0.890 CV 1
ASSI { 2929}
(( segid " " and resid 281 and name H ))
( segid " " and resid 280 and name HG2%)
4.000 2.000 2.000 peak 2929 spectrum 1 weight 0.10000E+01 volume 0.18597E-02 ppm1 9.177 ppm2 1.140 CV 1
ASSI { 2400}
(( segid " " and resid 417 and name HE21))
(( segid " " and resid 417 and name HG3 ))
2.400 0.700 0.700 peak 2400 spectrum 1 weight 0.10000E+01 volume 0.64395E-02 ppm1 7.362 ppm2 2.381 CV 1
OR { 2400}
(( segid " " and resid 417 and name HE21))
(( segid " " and resid 417 and name HG2 ))
ASSI { 1968}
(( segid " " and resid 387 and name H ))
(( segid " " and resid 386 and name HA ))
2.800 0.900 0.900 peak 1968 spectrum 1 weight 0.10000E+01 volume 0.54019E-02 ppm1 7.974 ppm2 4.463 CV 1
ASSI { 1185}
(( segid " " and resid 408 and name H ))
(( segid " " and resid 407 and name HA ))
3.400 1.500 1.500 peak 1185 spectrum 1 weight 0.10000E+01 volume 0.92793E-03 ppm1 7.485 ppm2 4.304 CV 1
ASSI { 2054}
(( segid " " and resid 270 and name H ))
(( segid " " and resid 270 and name HB2 ))
3.200 1.300 1.300 peak 2054 spectrum 1 weight 0.10000E+01 volume 0.90290E-03 ppm1 8.540 ppm2 2.879 CV 1
ASSI { 1367}
(( segid " " and resid 288 and name H ))
(( segid " " and resid 287 and name HB3 ))
3.600 1.600 1.600 peak 1367 spectrum 1 weight 0.10000E+01 volume 0.83743E-03 ppm1 7.475 ppm2 2.450 CV 1
ASSI { 2260}
(( segid " " and resid 185 and name HD22))
(( segid " " and resid 185 and name HB3 ))
3.300 1.400 1.400 peak 2260 spectrum 1 weight 0.10000E+01 volume 0.48879E-02 ppm1 7.561 ppm2 2.679 CV 1
ASSI { 365}
(( segid " " and resid 407 and name H ))
(( segid " " and resid 406 and name HG2 ))
5.100 3.200 0.900 peak 365 spectrum 1 weight 0.10000E+01 volume 0.82012E-03 ppm1 7.798 ppm2 2.618 CV 1
ASSI { 1561}
(( segid " " and resid 370 and name H ))
(( segid " " and resid 369 and name HA2 ))
3.600 1.600 1.600 peak 1561 spectrum 1 weight 0.10000E+01 volume 0.23198E-02 ppm1 8.417 ppm2 3.848 CV 1
ASSI { 2165}
(( segid " " and resid 294 and name H ))
( segid " " and resid 294 and name HG2%)
2.400 0.700 0.700 peak 2165 spectrum 1 weight 0.10000E+01 volume 0.34075E-02 ppm1 8.530 ppm2 1.226 CV 1
ASSI { 3157}
(( segid " " and resid 202 and name H ))
(( segid " " and resid 201 and name HA ))
3.200 1.300 1.300 peak 3157 spectrum 1 weight 0.10000E+01 volume 0.11955E-02 ppm1 8.209 ppm2 4.945 CV 1
ASSI { 2676}
(( segid " " and resid 187 and name H ))
(( segid " " and resid 188 and name HG3 ))
5.500 3.700 0.500 peak 2676 spectrum 1 weight 0.10000E+01 volume 0.73734E-03 ppm1 8.521 ppm2 1.938 CV 1
OR { 2676}
(( segid " " and resid 187 and name H ))
(( segid " " and resid 188 and name HG2 ))
ASSI { 268}
(( segid " " and resid 298 and name H ))
(( segid " " and resid 295 and name HB ))
3.300 1.300 1.300 peak 268 spectrum 1 weight 0.10000E+01 volume 0.72962E-03 ppm1 7.339 ppm2 4.396 CV 1
ASSI { 2689}
(( segid " " and resid 437 and name H ))
(( segid " " and resid 437 and name HA ))
2.900 1.100 1.100 peak 2689 spectrum 1 weight 0.10000E+01 volume 0.20156E-02 ppm1 8.216 ppm2 3.815 CV 1
ASSI { 2909}
(( segid " " and resid 446 and name H ))
(( segid " " and resid 446 and name HA ))
2.200 0.600 0.600 peak 2909 spectrum 1 weight 0.10000E+01 volume 0.14092E-01 ppm1 7.644 ppm2 4.059 CV 1
ASSI { 1435}
(( segid " " and resid 430 and name HE1 ))
(( segid " " and resid 430 and name HA ))
4.700 2.800 1.300 peak 1435 spectrum 1 weight 0.10000E+01 volume 0.11551E-02 ppm1 10.080 ppm2 4.416 CV 1
ASSI { 2077}
(( segid " " and resid 413 and name H ))
(( segid " " and resid 412 and name HA ))
3.500 1.500 1.500 peak 2077 spectrum 1 weight 0.10000E+01 volume 0.11320E-02 ppm1 8.482 ppm2 3.985 CV 1
ASSI { 2480}
(( segid " " and resid 212 and name H ))
(( segid " " and resid 212 and name HB ))
3.100 1.200 1.200 peak 2480 spectrum 1 weight 0.10000E+01 volume 0.81434E-03 ppm1 9.083 ppm2 1.195 CV 1
ASSI { 1788}
(( segid " " and resid 386 and name H ))
(( segid " " and resid 385 and name HB2 ))
4.400 2.400 1.600 peak 1788 spectrum 1 weight 0.10000E+01 volume 0.36384E-03 ppm1 7.959 ppm2 2.680 CV 1
ASSI { 2688}
(( segid " " and resid 273 and name H ))
(( segid " " and resid 273 and name HB2 ))
2.600 2.600 3.400 peak 2688 spectrum 1 weight 0.10000E+01 volume 0.20310E-02 ppm1 7.706 ppm2 2.614 CV 1
ASSI { 609}
(( segid " " and resid 276 and name H ))
(( segid " " and resid 275 and name HD2 ))
2.700 0.900 0.900 peak 609 spectrum 1 weight 0.10000E+01 volume 0.20464E-02 ppm1 6.946 ppm2 3.628 CV 1
ASSI { 3200}
(( segid " " and resid 325 and name H ))
(( segid " " and resid 325 and name HG2 ))
4.000 2.000 2.000 peak 3200 spectrum 1 weight 0.10000E+01 volume 0.17211E-02 ppm1 8.509 ppm2 2.415 CV 1
ASSI { 2695}
(( segid " " and resid 428 and name H ))
(( segid " " and resid 429 and name HB2 ))
4.900 3.000 1.100 peak 2695 spectrum 1 weight 0.10000E+01 volume 0.57368E-03 ppm1 7.752 ppm2 1.412 CV 1
OR { 2695}
(( segid " " and resid 428 and name H ))
(( segid " " and resid 429 and name HG ))
ASSI { 3024}
(( segid " " and resid 334 and name H ))
(( segid " " and resid 333 and name HA ))
3.300 1.400 1.400 peak 3024 spectrum 1 weight 0.10000E+01 volume 0.15902E-02 ppm1 8.129 ppm2 3.999 CV 1
ASSI { 2751}
(( segid " " and resid 374 and name H ))
(( segid " " and resid 320 and name HH2 ))
2.900 1.100 1.100 peak 2751 spectrum 1 weight 0.10000E+01 volume 0.12263E-02 ppm1 6.330 ppm2 7.158 CV 1
ASSI { 1387}
(( segid " " and resid 301 and name HE22))
(( segid " " and resid 301 and name HG3 ))
3.300 1.400 1.400 peak 1387 spectrum 1 weight 0.10000E+01 volume 0.59409E-02 ppm1 7.360 ppm2 2.303 CV 1
ASSI { 370}
(( segid " " and resid 235 and name H ))
( segid " " and resid 233 and name HG2%)
5.100 3.200 0.900 peak 370 spectrum 1 weight 0.10000E+01 volume 0.40622E-03 ppm1 7.896 ppm2 0.891 CV 1
OR { 370}
(( segid " " and resid 235 and name H ))
( segid " " and resid 233 and name HG1%)
ASSI { 1338}
(( segid " " and resid 245 and name H ))
(( segid " " and resid 245 and name HA ))
2.700 0.900 0.900 peak 1338 spectrum 1 weight 0.10000E+01 volume 0.41736E-02 ppm1 7.532 ppm2 3.991 CV 1
ASSI { 1764}
(( segid " " and resid 387 and name H ))
(( segid " " and resid 387 and name HB ))
2.800 1.000 1.000 peak 1764 spectrum 1 weight 0.10000E+01 volume 0.32208E-02 ppm1 7.974 ppm2 4.030 CV 1
ASSI { 785}
(( segid " " and resid 443 and name H ))
(( segid " " and resid 443 and name HA ))
2.600 0.900 0.900 peak 785 spectrum 1 weight 0.10000E+01 volume 0.32593E-02 ppm1 7.649 ppm2 4.124 CV 1
ASSI { 2554}
(( segid " " and resid 438 and name H ))
(( segid " " and resid 382 and name HZ3 ))
4.600 2.600 1.400 peak 2554 spectrum 1 weight 0.10000E+01 volume 0.45240E-03 ppm1 7.570 ppm2 6.851 CV 1
ASSI { 1911}
(( segid " " and resid 224 and name H ))
( segid " " and resid 223 and name HD% )
4.700 2.800 1.300 peak 1911 spectrum 1 weight 0.10000E+01 volume 0.53712E-03 ppm1 9.054 ppm2 6.433 CV 1
ASSI { 2079}
(( segid " " and resid 284 and name H ))
(( segid " " and resid 284 and name HA ))
2.600 0.900 0.900 peak 2079 spectrum 1 weight 0.10000E+01 volume 0.23063E-02 ppm1 8.116 ppm2 4.296 CV 1
ASSI { 2988}
(( segid " " and resid 198 and name H ))
(( segid " " and resid 198 and name HA ))
3.100 1.200 1.200 peak 2988 spectrum 1 weight 0.10000E+01 volume 0.11455E-02 ppm1 8.607 ppm2 2.896 CV 1
ASSI { 2913}
(( segid " " and resid 341 and name HD21))
(( segid " " and resid 338 and name H ))
3.400 1.400 1.400 peak 2913 spectrum 1 weight 0.10000E+01 volume 0.96833E-03 ppm1 6.990 ppm2 7.708 CV 1
ASSI { 2101}
(( segid " " and resid 284 and name H ))
( segid " " and resid 287 and name HD% )
4.500 2.600 1.500 peak 2101 spectrum 1 weight 0.10000E+01 volume 0.38887E-03 ppm1 8.116 ppm2 6.335 CV 1
ASSI { 1154}
(( segid " " and resid 218 and name H ))
(( segid " " and resid 214 and name HA ))
4.200 2.200 1.800 peak 1154 spectrum 1 weight 0.10000E+01 volume 0.28877E-03 ppm1 7.981 ppm2 3.565 CV 1
ASSI { 2819}
(( segid " " and resid 227 and name H ))
(( segid " " and resid 227 and name HB3 ))
2.600 0.900 0.900 peak 2819 spectrum 1 weight 0.10000E+01 volume 0.30032E-02 ppm1 7.130 ppm2 2.823 CV 1
ASSI { 2542}
(( segid " " and resid 267 and name H ))
(( segid " " and resid 267 and name HB3 ))
2.700 0.900 0.900 peak 2542 spectrum 1 weight 0.10000E+01 volume 0.13611E-02 ppm1 8.067 ppm2 2.295 CV 1
ASSI { 1384}
(( segid " " and resid 293 and name HE ))
(( segid " " and resid 293 and name HG2 ))
3.700 1.700 1.700 peak 1384 spectrum 1 weight 0.10000E+01 volume 0.66034E-03 ppm1 7.799 ppm2 1.529 CV 1
ASSI { 914}
(( segid " " and resid 265 and name H ))
(( segid " " and resid 268 and name HG3 ))
4.900 3.000 1.100 peak 914 spectrum 1 weight 0.10000E+01 volume 0.46012E-03 ppm1 7.753 ppm2 1.279 CV 1
OR { 914}
(( segid " " and resid 265 and name H ))
(( segid " " and resid 268 and name HG2 ))
ASSI { 2086}
(( segid " " and resid 195 and name H ))
(( segid " " and resid 193 and name HA ))
4.600 2.600 1.400 peak 2086 spectrum 1 weight 0.10000E+01 volume 0.55831E-03 ppm1 8.992 ppm2 4.117 CV 1
ASSI { 1311}
(( segid " " and resid 354 and name HD21))
( segid " " and resid 344 and name HG2%)
4.100 2.100 1.900 peak 1311 spectrum 1 weight 0.10000E+01 volume 0.15305E-02 ppm1 7.476 ppm2 0.876 CV 1
ASSI { 3011}
(( segid " " and resid 195 and name H ))
(( segid " " and resid 195 and name HA ))
2.900 1.000 1.000 peak 3011 spectrum 1 weight 0.10000E+01 volume 0.27741E-02 ppm1 8.992 ppm2 3.898 CV 1
ASSI { 1472}
(( segid " " and resid 338 and name H ))
(( segid " " and resid 339 and name H ))
4.500 2.500 1.500 peak 1472 spectrum 1 weight 0.10000E+01 volume 0.30225E-03 ppm1 7.703 ppm2 8.358 CV 1
ASSI { 2193}
(( segid " " and resid 283 and name H ))
( segid " " and resid 280 and name HG2%)
4.300 2.300 1.700 peak 2193 spectrum 1 weight 0.10000E+01 volume 0.11936E-02 ppm1 7.321 ppm2 1.128 CV 1
ASSI { 1250}
(( segid " " and resid 337 and name H ))
(( segid " " and resid 337 and name HG2 ))
4.100 2.100 1.900 peak 1250 spectrum 1 weight 0.10000E+01 volume 0.93562E-03 ppm1 7.312 ppm2 1.811 CV 1
ASSI { 1114}
(( segid " " and resid 390 and name H ))
(( segid " " and resid 389 and name HD2 ))
3.300 3.300 2.700 peak 1114 spectrum 1 weight 0.10000E+01 volume 0.29262E-03 ppm1 8.064 ppm2 3.190 CV 1
ASSI { 2433}
(( segid " " and resid 375 and name H ))
(( segid " " and resid 376 and name H ))
4.800 2.900 1.200 peak 2433 spectrum 1 weight 0.10000E+01 volume 0.63915E-03 ppm1 8.483 ppm2 9.513 CV 1
ASSI { 1938}
(( segid " " and resid 394 and name H ))
(( segid " " and resid 395 and name H ))
4.900 3.000 1.100 peak 1938 spectrum 1 weight 0.10000E+01 volume 0.43125E-03 ppm1 7.547 ppm2 9.072 CV 1
ASSI { 2633}
(( segid " " and resid 245 and name H ))
(( segid " " and resid 244 and name HB3 ))
3.200 1.300 1.300 peak 2633 spectrum 1 weight 0.10000E+01 volume 0.17365E-02 ppm1 7.531 ppm2 1.518 CV 1
ASSI { 2333}
(( segid " " and resid 429 and name H ))
(( segid " " and resid 429 and name HB3 ))
3.300 1.300 1.300 peak 2333 spectrum 1 weight 0.10000E+01 volume 0.16114E-02 ppm1 8.123 ppm2 1.796 CV 1
ASSI { 1760}
(( segid " " and resid 244 and name H ))
(( segid " " and resid 242 and name HB3 ))
4.500 2.500 1.500 peak 1760 spectrum 1 weight 0.10000E+01 volume 0.63337E-03 ppm1 8.560 ppm2 2.221 CV 1
OR { 1760}
(( segid " " and resid 244 and name H ))
(( segid " " and resid 242 and name HG2 ))
ASSI { 1064}
(( segid " " and resid 289 and name H ))
(( segid " " and resid 288 and name H ))
2.700 0.900 0.900 peak 1064 spectrum 1 weight 0.10000E+01 volume 0.24084E-02 ppm1 7.987 ppm2 7.478 CV 1
ASSI { 1636}
(( segid " " and resid 340 and name HE21))
(( segid " " and resid 340 and name HA ))
4.200 2.200 1.800 peak 1636 spectrum 1 weight 0.10000E+01 volume 0.69500E-03 ppm1 6.786 ppm2 4.033 CV 1
ASSI { 3117}
(( segid " " and resid 410 and name HD21))
(( segid " " and resid 410 and name H ))
2.400 0.700 0.700 peak 3117 spectrum 1 weight 0.10000E+01 volume 0.77199E-03 ppm1 6.914 ppm2 7.899 CV 1
ASSI { 2866}
(( segid " " and resid 313 and name H ))
(( segid " " and resid 208 and name HB3 ))
3.900 1.900 1.900 peak 2866 spectrum 1 weight 0.10000E+01 volume 0.66996E-03 ppm1 8.626 ppm2 1.630 CV 1
ASSI { 1474}
(( segid " " and resid 388 and name H ))
(( segid " " and resid 388 and name HB3 ))
2.800 0.900 0.900 peak 1474 spectrum 1 weight 0.10000E+01 volume 0.45067E-02 ppm1 8.234 ppm2 1.361 CV 1
ASSI { 2346}
(( segid " " and resid 241 and name H ))
(( segid " " and resid 240 and name HA ))
3.500 1.500 1.500 peak 2346 spectrum 1 weight 0.10000E+01 volume 0.12533E-02 ppm1 8.373 ppm2 3.245 CV 1
ASSI { 1510}
(( segid " " and resid 341 and name H ))
(( segid " " and resid 338 and name H ))
3.100 1.200 1.200 peak 1510 spectrum 1 weight 0.10000E+01 volume 0.11686E-02 ppm1 8.540 ppm2 7.708 CV 1
ASSI { 2826}
(( segid " " and resid 403 and name H ))
( segid " " and resid 407 and name HE% )
5.800 4.200 0.200 peak 2826 spectrum 1 weight 0.10000E+01 volume 0.67765E-03 ppm1 7.557 ppm2 6.868 CV 1
ASSI { 1656}
(( segid " " and resid 360 and name H ))
(( segid " " and resid 360 and name HB2 ))
2.500 0.800 0.800 peak 1656 spectrum 1 weight 0.10000E+01 volume 0.10222E-02 ppm1 7.281 ppm2 2.756 CV 1
ASSI { 3121}
(( segid " " and resid 305 and name H ))
(( segid " " and resid 305 and name HB2 ))
2.100 0.600 0.600 peak 3121 spectrum 1 weight 0.10000E+01 volume 0.77778E-02 ppm1 7.497 ppm2 1.860 CV 1
OR { 3121}
(( segid " " and resid 305 and name H ))
(( segid " " and resid 305 and name HB3 ))
ASSI { 1101}
(( segid " " and resid 366 and name H ))
(( segid " " and resid 367 and name H ))
2.700 0.900 0.900 peak 1101 spectrum 1 weight 0.10000E+01 volume 0.14708E-02 ppm1 8.334 ppm2 7.844 CV 1
ASSI { 3141}
(( segid " " and resid 238 and name H ))
(( segid " " and resid 237 and name HB2 ))
3.200 1.300 1.300 peak 3141 spectrum 1 weight 0.10000E+01 volume 0.10761E-02 ppm1 8.664 ppm2 1.925 CV 1
ASSI { 1291}
(( segid " " and resid 190 and name H ))
(( segid " " and resid 189 and name HB ))
3.200 1.300 1.300 peak 1291 spectrum 1 weight 0.10000E+01 volume 0.62953E-03 ppm1 10.640 ppm2 2.184 CV 1
ASSI { 3105}
(( segid " " and resid 340 and name HE22))
(( segid " " and resid 340 and name HG3 ))
3.300 1.300 1.300 peak 3105 spectrum 1 weight 0.10000E+01 volume 0.53423E-02 ppm1 7.417 ppm2 2.325 CV 1
OR { 3105}
(( segid " " and resid 340 and name HE22))
(( segid " " and resid 340 and name HG2 ))
ASSI { 262}
(( segid " " and resid 436 and name H ))
( segid " " and resid 437 and name HG2%)
6.000 5.000 0.000 peak 262 spectrum 1 weight 0.10000E+01 volume 0.33498E-03 ppm1 8.923 ppm2 1.164 CV 1
ASSI { 136}
(( segid " " and resid 363 and name H ))
(( segid " " and resid 364 and name HB ))
4.500 2.600 1.500 peak 136 spectrum 1 weight 0.10000E+01 volume 0.66224E-03 ppm1 7.265 ppm2 2.092 CV 1
ASSI { 1422}
(( segid " " and resid 309 and name H ))
(( segid " " and resid 308 and name HG3 ))
4.600 2.600 1.400 peak 1422 spectrum 1 weight 0.10000E+01 volume 0.10896E-02 ppm1 7.487 ppm2 1.392 CV 1
ASSI { 3135}
(( segid " " and resid 280 and name H ))
(( segid " " and resid 279 and name HA ))
3.200 1.200 1.200 peak 3135 spectrum 1 weight 0.10000E+01 volume 0.79893E-03 ppm1 7.653 ppm2 4.322 CV 1
ASSI { 2180}
(( segid " " and resid 324 and name H ))
(( segid " " and resid 324 and name HA ))
2.900 1.000 1.000 peak 2180 spectrum 1 weight 0.10000E+01 volume 0.14901E-02 ppm1 8.503 ppm2 3.954 CV 1
ASSI { 2544}
(( segid " " and resid 211 and name H ))
(( segid " " and resid 210 and name HB3 ))
4.000 2.000 2.000 peak 2544 spectrum 1 weight 0.10000E+01 volume 0.65262E-03 ppm1 7.467 ppm2 1.389 CV 1
ASSI { 3037}
(( segid " " and resid 219 and name H ))
( segid " " and resid 219 and name HD% )
4.600 2.600 1.400 peak 3037 spectrum 1 weight 0.10000E+01 volume 0.12340E-02 ppm1 7.700 ppm2 6.875 CV 1
ASSI { 1479}
(( segid " " and resid 368 and name H ))
( segid " " and resid 368 and name HD% )
3.400 1.500 1.500 peak 1479 spectrum 1 weight 0.10000E+01 volume 0.10184E-02 ppm1 8.218 ppm2 7.163 CV 1
ASSI { 2195}
(( segid " " and resid 222 and name H ))
(( segid " " and resid 221 and name HB3 ))
3.200 1.300 1.300 peak 2195 spectrum 1 weight 0.10000E+01 volume 0.86056E-03 ppm1 7.248 ppm2 1.935 CV 1
ASSI { 2313}
(( segid " " and resid 394 and name H ))
(( segid " " and resid 394 and name HA ))
2.800 1.000 1.000 peak 2313 spectrum 1 weight 0.10000E+01 volume 0.29821E-02 ppm1 7.545 ppm2 4.612 CV 1
OR { 2313}
(( segid " " and resid 394 and name H ))
(( segid " " and resid 394 and name HB ))
ASSI { 2697}
(( segid " " and resid 270 and name H ))
( segid " " and resid 270 and name HD% )
4.900 3.000 1.100 peak 2697 spectrum 1 weight 0.10000E+01 volume 0.77778E-03 ppm1 8.535 ppm2 7.158 CV 1
ASSI { 678}
(( segid " " and resid 290 and name H ))
( segid " " and resid 303 and name HE% )
4.300 2.300 1.700 peak 678 spectrum 1 weight 0.10000E+01 volume 0.80855E-03 ppm1 7.819 ppm2 6.810 CV 1
ASSI { 2205}
(( segid " " and resid 268 and name H ))
(( segid " " and resid 268 and name HG3 ))
2.600 0.900 0.900 peak 2205 spectrum 1 weight 0.10000E+01 volume 0.14150E-02 ppm1 7.878 ppm2 1.260 CV 1
OR { 2205}
(( segid " " and resid 268 and name H ))
(( segid " " and resid 268 and name HG2 ))
ASSI { 2896}
(( segid " " and resid 382 and name H ))
(( segid " " and resid 382 and name HA ))
3.700 1.700 1.700 peak 2896 spectrum 1 weight 0.10000E+01 volume 0.77778E-03 ppm1 8.669 ppm2 4.940 CV 1
ASSI { 1047}
(( segid " " and resid 417 and name H ))
(( segid " " and resid 417 and name HE21))
3.700 1.700 1.700 peak 1047 spectrum 1 weight 0.10000E+01 volume 0.31573E-03 ppm1 7.763 ppm2 7.345 CV 1
ASSI { 2951}
(( segid " " and resid 301 and name H ))
(( segid " " and resid 303 and name H ))
3.800 1.800 1.800 peak 2951 spectrum 1 weight 0.10000E+01 volume 0.58331E-03 ppm1 8.076 ppm2 8.738 CV 1
ASSI { 2469}
(( segid " " and resid 255 and name H ))
(( segid " " and resid 254 and name HB3 ))
4.600 2.700 1.400 peak 2469 spectrum 1 weight 0.10000E+01 volume 0.88555E-03 ppm1 8.608 ppm2 2.959 CV 1
ASSI { 3177}
(( segid " " and resid 303 and name H ))
( segid " " and resid 303 and name HD% )
2.800 1.000 1.000 peak 3177 spectrum 1 weight 0.10000E+01 volume 0.21581E-02 ppm1 8.743 ppm2 7.089 CV 1
ASSI { 2609}
(( segid " " and resid 239 and name H ))
(( segid " " and resid 236 and name HA ))
4.800 2.900 1.200 peak 2609 spectrum 1 weight 0.10000E+01 volume 0.54290E-03 ppm1 7.095 ppm2 3.988 CV 1
ASSI { 2223}
(( segid " " and resid 365 and name HE22))
(( segid " " and resid 365 and name HE21))
0.900 0.100 1.300 peak 2223 spectrum 1 weight 0.10000E+01 volume 0.12530E+00 ppm1 7.588 ppm2 6.879 CV 1
ASSI { 3049}
(( segid " " and resid 202 and name H ))
(( segid " " and resid 202 and name HB3 ))
3.500 1.500 1.500 peak 3049 spectrum 1 weight 0.10000E+01 volume 0.25085E-02 ppm1 8.209 ppm2 2.297 CV 1
OR { 3049}
(( segid " " and resid 202 and name H ))
(( segid " " and resid 202 and name HG2 ))
ASSI { 2920}
(( segid " " and resid 376 and name H ))
( segid " " and resid 376 and name HG2%)
3.000 1.100 1.100 peak 2920 spectrum 1 weight 0.10000E+01 volume 0.24815E-02 ppm1 9.515 ppm2 0.939 CV 1
OR { 2920}
(( segid " " and resid 376 and name H ))
( segid " " and resid 376 and name HG1%)
ASSI { 2188}
(( segid " " and resid 430 and name HE1 ))
(( segid " " and resid 430 and name HH2 ))
4.300 2.300 1.700 peak 2188 spectrum 1 weight 0.10000E+01 volume 0.16575E-02 ppm1 10.081 ppm2 7.004 CV 1
OR { 2188}
(( segid " " and resid 430 and name HE1 ))
(( segid " " and resid 430 and name HZ3 ))
ASSI { 2528}
(( segid " " and resid 224 and name H ))
(( segid " " and resid 224 and name HA2 ))
3.500 1.500 1.500 peak 2528 spectrum 1 weight 0.10000E+01 volume 0.75081E-03 ppm1 9.047 ppm2 4.565 CV 1
ASSI { 1606}
(( segid " " and resid 417 and name HE22))
(( segid " " and resid 414 and name HG3 ))
2.900 2.900 3.100 peak 1606 spectrum 1 weight 0.10000E+01 volume 0.57562E-03 ppm1 6.744 ppm2 1.473 CV 1
ASSI { 947}
(( segid " " and resid 410 and name HD21))
(( segid " " and resid 411 and name HA ))
5.400 3.600 0.600 peak 947 spectrum 1 weight 0.10000E+01 volume 0.26374E-03 ppm1 6.917 ppm2 3.831 CV 1
ASSI { 2501}
(( segid " " and resid 221 and name H ))
( segid " " and resid 217 and name HG2%)
3.800 1.800 1.800 peak 2501 spectrum 1 weight 0.10000E+01 volume 0.78546E-03 ppm1 8.743 ppm2 0.495 CV 1
ASSI { 2214}
(( segid " " and resid 207 and name H ))
(( segid " " and resid 207 and name HG13))
3.400 1.400 1.400 peak 2214 spectrum 1 weight 0.10000E+01 volume 0.13014E-02 ppm1 6.898 ppm2 1.032 CV 1
ASSI { 223}
(( segid " " and resid 395 and name HE22))
(( segid " " and resid 399 and name HE3 ))
4.500 2.500 1.500 peak 223 spectrum 1 weight 0.10000E+01 volume 0.25604E-03 ppm1 6.982 ppm2 2.869 CV 1
OR { 223}
(( segid " " and resid 395 and name HE22))
(( segid " " and resid 399 and name HE2 ))
ASSI { 974}
(( segid " " and resid 254 and name HD22))
(( segid " " and resid 256 and name H ))
3.300 1.400 1.400 peak 974 spectrum 1 weight 0.10000E+01 volume 0.90674E-03 ppm1 6.860 ppm2 8.257 CV 1
ASSI { 314}
(( segid " " and resid 248 and name H ))
(( segid " " and resid 249 and name HA ))
5.400 3.700 0.600 peak 314 spectrum 1 weight 0.10000E+01 volume 0.33883E-03 ppm1 8.872 ppm2 4.378 CV 1
ASSI { 915}
(( segid " " and resid 276 and name H ))
(( segid " " and resid 275 and name HD3 ))
3.800 1.900 1.900 peak 915 spectrum 1 weight 0.10000E+01 volume 0.16383E-02 ppm1 6.947 ppm2 3.087 CV 1
ASSI { 2568}
(( segid " " and resid 430 and name HE1 ))
(( segid " " and resid 429 and name HB2 ))
3.800 1.800 1.800 peak 2568 spectrum 1 weight 0.10000E+01 volume 0.91637E-03 ppm1 10.081 ppm2 1.406 CV 1
ASSI { 1092}
(( segid " " and resid 258 and name H ))
(( segid " " and resid 257 and name HB3 ))
3.200 1.300 1.300 peak 1092 spectrum 1 weight 0.10000E+01 volume 0.20214E-02 ppm1 8.135 ppm2 2.370 CV 1
OR { 1092}
(( segid " " and resid 258 and name H ))
(( segid " " and resid 257 and name HB2 ))
ASSI { 2262}
(( segid " " and resid 305 and name H ))
(( segid " " and resid 304 and name HB2 ))
2.400 0.700 0.700 peak 2262 spectrum 1 weight 0.10000E+01 volume 0.31168E-02 ppm1 7.497 ppm2 2.261 CV 1
ASSI { 1539}
(( segid " " and resid 256 and name H ))
(( segid " " and resid 256 and name HG3 ))
2.700 0.900 0.900 peak 1539 spectrum 1 weight 0.10000E+01 volume 0.24719E-02 ppm1 8.258 ppm2 2.371 CV 1
ASSI { 2781}
(( segid " " and resid 265 and name H ))
( segid " " and resid 264 and name HB% )
2.800 1.000 1.000 peak 2781 spectrum 1 weight 0.10000E+01 volume 0.27607E-02 ppm1 7.752 ppm2 0.967 CV 1
ASSI { 3088}
(( segid " " and resid 305 and name H ))
(( segid " " and resid 305 and name HA ))
2.300 0.600 0.600 peak 3088 spectrum 1 weight 0.10000E+01 volume 0.52556E-02 ppm1 7.498 ppm2 3.820 CV 1
ASSI { 798}
(( segid " " and resid 341 and name H ))
(( segid " " and resid 342 and name HG13))
5.600 3.900 0.400 peak 798 spectrum 1 weight 0.10000E+01 volume 0.47359E-03 ppm1 8.540 ppm2 1.334 CV 1
ASSI { 1055}
(( segid " " and resid 424 and name H ))
(( segid " " and resid 424 and name HG ))
4.600 2.700 1.400 peak 1055 spectrum 1 weight 0.10000E+01 volume 0.31765E-03 ppm1 8.278 ppm2 3.730 CV 1
ASSI { 2532}
(( segid " " and resid 243 and name H ))
(( segid " " and resid 240 and name HA ))
3.400 1.500 1.500 peak 2532 spectrum 1 weight 0.10000E+01 volume 0.85284E-03 ppm1 7.863 ppm2 3.252 CV 1
ASSI { 1160}
(( segid " " and resid 363 and name H ))
(( segid " " and resid 362 and name HA ))
3.400 1.500 1.500 peak 1160 spectrum 1 weight 0.10000E+01 volume 0.13823E-02 ppm1 7.267 ppm2 4.127 CV 1
ASSI { 1596}
(( segid " " and resid 239 and name H ))
(( segid " " and resid 238 and name HB3 ))
3.500 1.500 1.500 peak 1596 spectrum 1 weight 0.10000E+01 volume 0.92599E-03 ppm1 7.096 ppm2 3.833 CV 1
OR { 1596}
(( segid " " and resid 239 and name H ))
(( segid " " and resid 238 and name HB2 ))
ASSI { 820}
(( segid " " and resid 237 and name H ))
(( segid " " and resid 236 and name H ))
5.400 3.600 0.600 peak 820 spectrum 1 weight 0.10000E+01 volume 0.29455E-03 ppm1 8.766 ppm2 7.807 CV 1
ASSI { 628}
(( segid " " and resid 297 and name H ))
( segid " " and resid 300 and name HG2%)
5.400 3.700 0.600 peak 628 spectrum 1 weight 0.10000E+01 volume 0.25412E-03 ppm1 8.076 ppm2 0.556 CV 1
ASSI { 2274}
(( segid " " and resid 278 and name H ))
(( segid " " and resid 278 and name HA ))
3.000 1.100 1.100 peak 2274 spectrum 1 weight 0.10000E+01 volume 0.79124E-03 ppm1 10.073 ppm2 3.822 CV 1
ASSI { 1897}
(( segid " " and resid 276 and name H ))
(( segid " " and resid 275 and name HG2 ))
2.700 0.900 0.900 peak 1897 spectrum 1 weight 0.10000E+01 volume 0.22794E-02 ppm1 6.947 ppm2 1.559 CV 1
ASSI { 577}
(( segid " " and resid 262 and name H ))
(( segid " " and resid 261 and name HD22))
4.600 2.600 1.400 peak 577 spectrum 1 weight 0.10000E+01 volume 0.29840E-03 ppm1 7.886 ppm2 6.640 CV 1
ASSI { 2537}
(( segid " " and resid 433 and name HE22))
(( segid " " and resid 433 and name HG3 ))
3.800 1.800 1.800 peak 2537 spectrum 1 weight 0.10000E+01 volume 0.16710E-02 ppm1 6.711 ppm2 2.490 CV 1
ASSI { 1021}
(( segid " " and resid 420 and name H ))
(( segid " " and resid 420 and name HG13))
2.300 0.600 0.600 peak 1021 spectrum 1 weight 0.10000E+01 volume 0.46107E-02 ppm1 7.494 ppm2 1.391 CV 1
ASSI { 1746}
(( segid " " and resid 433 and name HE21))
(( segid " " and resid 433 and name HE22))
1.500 0.300 0.700 peak 1746 spectrum 1 weight 0.10000E+01 volume 0.22732E-01 ppm1 6.975 ppm2 6.703 CV 1
ASSI { 2148}
(( segid " " and resid 212 and name H ))
( segid " " and resid 212 and name HG2%)
4.400 2.400 1.600 peak 2148 spectrum 1 weight 0.10000E+01 volume 0.69306E-03 ppm1 9.086 ppm2 -0.159 CV 1
ASSI { 2660}
(( segid " " and resid 312 and name H ))
(( segid " " and resid 208 and name HG3 ))
5.500 3.700 0.500 peak 2660 spectrum 1 weight 0.10000E+01 volume 0.28685E-03 ppm1 8.788 ppm2 0.743 CV 1
OR { 2660}
(( segid " " and resid 312 and name H ))
(( segid " " and resid 208 and name HG2 ))
ASSI { 1324}
(( segid " " and resid 259 and name H ))
(( segid " " and resid 258 and name HB3 ))
2.800 1.000 1.000 peak 1324 spectrum 1 weight 0.10000E+01 volume 0.18616E-02 ppm1 8.460 ppm2 2.689 CV 1
OR { 1324}
(( segid " " and resid 259 and name H ))
(( segid " " and resid 258 and name HB2 ))
ASSI { 2923}
(( segid " " and resid 340 and name HE22))
(( segid " " and resid 340 and name H ))
6.000 5.000 0.000 peak 2923 spectrum 1 weight 0.10000E+01 volume 0.62374E-03 ppm1 7.417 ppm2 8.168 CV 1
ASSI { 2778}
(( segid " " and resid 354 and name HD22))
(( segid " " and resid 354 and name HB3 ))
3.700 1.700 1.700 peak 2778 spectrum 1 weight 0.10000E+01 volume 0.20387E-02 ppm1 6.454 ppm2 2.723 CV 1
OR { 2778}
(( segid " " and resid 354 and name HD22))
(( segid " " and resid 354 and name HB2 ))
ASSI { 2184}
(( segid " " and resid 226 and name H ))
(( segid " " and resid 226 and name HB3 ))
3.600 1.600 1.600 peak 2184 spectrum 1 weight 0.10000E+01 volume 0.25739E-02 ppm1 7.437 ppm2 1.968 CV 1
ASSI { 674}
(( segid " " and resid 301 and name HE21))
(( segid " " and resid 301 and name HA ))
3.700 1.700 1.700 peak 674 spectrum 1 weight 0.10000E+01 volume 0.12475E-02 ppm1 6.701 ppm2 3.954 CV 1
ASSI { 2392}
(( segid " " and resid 408 and name H ))
(( segid " " and resid 408 and name HB2 ))
2.700 0.900 0.900 peak 2392 spectrum 1 weight 0.10000E+01 volume 0.16884E-02 ppm1 7.480 ppm2 1.936 CV 1
ASSI { 2870}
(( segid " " and resid 200 and name H ))
(( segid " " and resid 200 and name HA ))
3.200 1.300 1.300 peak 2870 spectrum 1 weight 0.10000E+01 volume 0.13919E-02 ppm1 7.609 ppm2 4.159 CV 1
ASSI { 1269}
(( segid " " and resid 361 and name H ))
(( segid " " and resid 360 and name HB2 ))
3.500 1.500 1.500 peak 1269 spectrum 1 weight 0.10000E+01 volume 0.79124E-03 ppm1 8.405 ppm2 2.757 CV 1
ASSI { 1772}
(( segid " " and resid 326 and name H ))
(( segid " " and resid 323 and name HA ))
3.400 1.400 1.400 peak 1772 spectrum 1 weight 0.10000E+01 volume 0.10107E-02 ppm1 8.928 ppm2 3.291 CV 1
ASSI { 1571}
(( segid " " and resid 295 and name H ))
(( segid " " and resid 294 and name HA ))
2.700 0.900 0.900 peak 1571 spectrum 1 weight 0.10000E+01 volume 0.49496E-02 ppm1 7.396 ppm2 3.913 CV 1
ASSI { 2729}
(( segid " " and resid 338 and name H ))
(( segid " " and resid 340 and name H ))
4.800 2.900 1.200 peak 2729 spectrum 1 weight 0.10000E+01 volume 0.29070E-03 ppm1 7.704 ppm2 8.170 CV 1
ASSI { 2247}
(( segid " " and resid 246 and name H ))
( segid " " and resid 246 and name HB% )
2.400 0.700 0.700 peak 2247 spectrum 1 weight 0.10000E+01 volume 0.64455E-02 ppm1 7.448 ppm2 1.186 CV 1
ASSI { 1436}
(( segid " " and resid 194 and name H ))
( segid " " and resid 194 and name HD2%)
5.000 3.100 1.000 peak 1436 spectrum 1 weight 0.10000E+01 volume 0.80855E-03 ppm1 9.118 ppm2 0.598 CV 1
ASSI { 2431}
(( segid " " and resid 424 and name H ))
(( segid " " and resid 422 and name HB2 ))
4.900 2.900 1.100 peak 2431 spectrum 1 weight 0.10000E+01 volume 0.46397E-03 ppm1 8.283 ppm2 2.405 CV 1
ASSI { 2382}
(( segid " " and resid 353 and name H ))
( segid " " and resid 356 and name HG2%)
4.100 2.100 1.900 peak 2382 spectrum 1 weight 0.10000E+01 volume 0.67381E-03 ppm1 8.950 ppm2 0.383 CV 1
ASSI { 96}
(( segid " " and resid 211 and name H ))
(( segid " " and resid 201 and name HB ))
2.900 1.000 1.000 peak 96 spectrum 1 weight 0.10000E+01 volume 0.61218E-03 ppm1 7.469 ppm2 4.436 CV 1
OR { 96}
(( segid " " and resid 211 and name H ))
(( segid " " and resid 201 and name HG1 ))
ASSI { 1183}
(( segid " " and resid 292 and name H ))
(( segid " " and resid 292 and name HA3 ))
2.500 0.800 0.800 peak 1183 spectrum 1 weight 0.10000E+01 volume 0.50708E-02 ppm1 7.809 ppm2 4.203 CV 1
ASSI { 1766}
(( segid " " and resid 322 and name H ))
( segid " " and resid 321 and name HD2%)
4.500 2.600 1.500 peak 1766 spectrum 1 weight 0.10000E+01 volume 0.82780E-03 ppm1 8.221 ppm2 0.680 CV 1
ASSI { 1717}
(( segid " " and resid 370 and name H ))
(( segid " " and resid 368 and name HA ))
4.200 2.200 1.800 peak 1717 spectrum 1 weight 0.10000E+01 volume 0.42353E-03 ppm1 8.414 ppm2 5.168 CV 1
ASSI { 171}
(( segid " " and resid 417 and name H ))
(( segid " " and resid 416 and name HB3 ))
3.200 1.300 1.300 peak 171 spectrum 1 weight 0.10000E+01 volume 0.22582E-02 ppm1 7.759 ppm2 1.634 CV 1
OR { 171}
(( segid " " and resid 417 and name H ))
(( segid " " and resid 416 and name HG ))
ASSI { 2602}
(( segid " " and resid 256 and name H ))
(( segid " " and resid 255 and name HB2 ))
3.300 1.400 1.400 peak 2602 spectrum 1 weight 0.10000E+01 volume 0.96833E-03 ppm1 8.258 ppm2 1.715 CV 1
OR { 2602}
(( segid " " and resid 256 and name H ))
(( segid " " and resid 255 and name HG ))
ASSI { 2953}
(( segid " " and resid 388 and name H ))
(( segid " " and resid 388 and name HG2 ))
4.600 2.600 1.400 peak 2953 spectrum 1 weight 0.10000E+01 volume 0.79893E-03 ppm1 8.234 ppm2 1.850 CV 1
OR { 2953}
(( segid " " and resid 388 and name H ))
( segid " " and resid 388 and name HE% )
ASSI { 3008}
(( segid " " and resid 317 and name H ))
( segid " " and resid 209 and name HD2%)
4.800 2.900 1.200 peak 3008 spectrum 1 weight 0.10000E+01 volume 0.36000E-03 ppm1 7.529 ppm2 -0.898 CV 1
ASSI { 3038}
(( segid " " and resid 288 and name H ))
(( segid " " and resid 287 and name HB2 ))
3.000 1.100 1.100 peak 3038 spectrum 1 weight 0.10000E+01 volume 0.15517E-02 ppm1 7.472 ppm2 3.054 CV 1
ASSI { 613}
(( segid " " and resid 224 and name H ))
( segid " " and resid 220 and name HG2%)
4.600 2.600 1.400 peak 613 spectrum 1 weight 0.10000E+01 volume 0.92599E-03 ppm1 9.046 ppm2 1.134 CV 1
OR { 613}
(( segid " " and resid 224 and name H ))
( segid " " and resid 220 and name HG1%)
ASSI { 2022}
(( segid " " and resid 276 and name H ))
(( segid " " and resid 274 and name HA ))
3.700 1.700 1.700 peak 2022 spectrum 1 weight 0.10000E+01 volume 0.16749E-02 ppm1 6.947 ppm2 3.998 CV 1
ASSI { 1113}
(( segid " " and resid 204 and name H ))
(( segid " " and resid 205 and name H ))
3.100 3.100 2.900 peak 1113 spectrum 1 weight 0.10000E+01 volume 0.23102E-03 ppm1 8.126 ppm2 6.394 CV 1
ASSI { 2428}
(( segid " " and resid 337 and name H ))
(( segid " " and resid 337 and name HA ))
3.700 1.700 1.700 peak 2428 spectrum 1 weight 0.10000E+01 volume 0.49668E-03 ppm1 7.312 ppm2 4.987 CV 1
ASSI { 1863}
(( segid " " and resid 266 and name H ))
(( segid " " and resid 266 and name HB3 ))
2.800 1.000 1.000 peak 1863 spectrum 1 weight 0.10000E+01 volume 0.12976E-02 ppm1 8.232 ppm2 1.554 CV 1
OR { 1863}
(( segid " " and resid 266 and name H ))
(( segid " " and resid 266 and name HB2 ))
ASSI { 760}
(( segid " " and resid 340 and name H ))
(( segid " " and resid 339 and name HA ))
3.200 1.300 1.300 peak 760 spectrum 1 weight 0.10000E+01 volume 0.10839E-02 ppm1 8.163 ppm2 3.012 CV 1
ASSI { 1666}
(( segid " " and resid 388 and name H ))
(( segid " " and resid 388 and name HB2 ))
2.800 1.000 1.000 peak 1666 spectrum 1 weight 0.10000E+01 volume 0.42603E-02 ppm1 8.234 ppm2 1.550 CV 1
ASSI { 720}
(( segid " " and resid 351 and name HE22))
(( segid " " and resid 349 and name HA ))
4.100 2.100 1.900 peak 720 spectrum 1 weight 0.10000E+01 volume 0.61218E-03 ppm1 7.561 ppm2 3.964 CV 1
ASSI { 649}
(( segid " " and resid 338 and name H ))
(( segid " " and resid 332 and name HB3 ))
3.900 1.900 1.900 peak 649 spectrum 1 weight 0.10000E+01 volume 0.45818E-03 ppm1 7.719 ppm2 2.627 CV 1
ASSI { 588}
(( segid " " and resid 249 and name H ))
(( segid " " and resid 247 and name H ))
4.500 2.500 1.500 peak 588 spectrum 1 weight 0.10000E+01 volume 0.36384E-03 ppm1 7.294 ppm2 8.442 CV 1
ASSI { 1465}
(( segid " " and resid 395 and name H ))
(( segid " " and resid 395 and name HA ))
4.000 2.000 2.000 peak 1465 spectrum 1 weight 0.10000E+01 volume 0.30032E-03 ppm1 9.088 ppm2 3.770 CV 1
ASSI { 2681}
(( segid " " and resid 209 and name H ))
(( segid " " and resid 208 and name HA ))
2.800 1.000 1.000 peak 2681 spectrum 1 weight 0.10000E+01 volume 0.13842E-02 ppm1 7.824 ppm2 3.878 CV 1
ASSI { 849}
(( segid " " and resid 430 and name HE1 ))
(( segid " " and resid 427 and name HA ))
3.400 1.400 1.400 peak 849 spectrum 1 weight 0.10000E+01 volume 0.15209E-02 ppm1 10.080 ppm2 3.960 CV 1
ASSI { 2117}
(( segid " " and resid 418 and name H ))
(( segid " " and resid 417 and name HB2 ))
3.500 1.500 1.500 peak 2117 spectrum 1 weight 0.10000E+01 volume 0.15690E-02 ppm1 8.187 ppm2 2.065 CV 1
OR { 2117}
(( segid " " and resid 418 and name H ))
(( segid " " and resid 417 and name HB3 ))
ASSI { 661}
(( segid " " and resid 301 and name H ))
(( segid " " and resid 299 and name HB2 ))
4.200 2.200 1.800 peak 661 spectrum 1 weight 0.10000E+01 volume 0.78352E-03 ppm1 8.069 ppm2 1.442 CV 1
ASSI { 521}
(( segid " " and resid 259 and name H ))
(( segid " " and resid 261 and name HD22))
4.500 2.500 1.500 peak 521 spectrum 1 weight 0.10000E+01 volume 0.46781E-03 ppm1 8.463 ppm2 6.648 CV 1
ASSI { 712}
(( segid " " and resid 435 and name H ))
( segid " " and resid 437 and name HG2%)
5.500 3.800 0.500 peak 712 spectrum 1 weight 0.10000E+01 volume 0.41006E-03 ppm1 8.203 ppm2 1.217 CV 1
ASSI { 2928}
(( segid " " and resid 371 and name H ))
(( segid " " and resid 370 and name H ))
2.500 0.800 0.800 peak 2928 spectrum 1 weight 0.10000E+01 volume 0.26567E-02 ppm1 7.539 ppm2 8.415 CV 1
ASSI { 2269}
(( segid " " and resid 390 and name H ))
(( segid " " and resid 389 and name HD3 ))
3.100 3.100 2.900 peak 2269 spectrum 1 weight 0.10000E+01 volume 0.37734E-03 ppm1 8.064 ppm2 2.792 CV 1
ASSI { 767}
(( segid " " and resid 410 and name H ))
(( segid " " and resid 411 and name HA ))
4.600 2.700 1.400 peak 767 spectrum 1 weight 0.10000E+01 volume 0.85093E-03 ppm1 7.902 ppm2 3.841 CV 1
ASSI { 2222}
(( segid " " and resid 185 and name HD21))
(( segid " " and resid 185 and name HD22))
1.300 0.200 0.900 peak 2222 spectrum 1 weight 0.10000E+01 volume 0.66880E-01 ppm1 6.793 ppm2 7.555 CV 1
ASSI { 2187}
(( segid " " and resid 430 and name H ))
(( segid " " and resid 430 and name HB2 ))
3.300 1.400 1.400 peak 2187 spectrum 1 weight 0.10000E+01 volume 0.14400E-02 ppm1 7.770 ppm2 3.328 CV 1
OR { 2187}
(( segid " " and resid 430 and name H ))
(( segid " " and resid 430 and name HB3 ))
ASSI { 382}
(( segid " " and resid 417 and name HE21))
(( segid " " and resid 420 and name HB ))
4.400 2.400 1.600 peak 382 spectrum 1 weight 0.10000E+01 volume 0.95102E-03 ppm1 7.362 ppm2 1.762 CV 1
ASSI { 1597}
(( segid " " and resid 430 and name HE1 ))
(( segid " " and resid 426 and name HG2 ))
4.000 2.000 2.000 peak 1597 spectrum 1 weight 0.10000E+01 volume 0.12610E-02 ppm1 10.081 ppm2 2.244 CV 1
ASSI { 2421}
(( segid " " and resid 446 and name H ))
(( segid " " and resid 445 and name HB3 ))
2.500 0.800 0.800 peak 2421 spectrum 1 weight 0.10000E+01 volume 0.55503E-02 ppm1 7.644 ppm2 1.884 CV 1
ASSI { 226}
(( segid " " and resid 264 and name H ))
(( segid " " and resid 260 and name HA ))
4.100 2.200 1.900 peak 226 spectrum 1 weight 0.10000E+01 volume 0.38887E-03 ppm1 8.510 ppm2 4.310 CV 1
ASSI { 1663}
(( segid " " and resid 263 and name H ))
(( segid " " and resid 262 and name HA ))
4.300 2.300 1.700 peak 1663 spectrum 1 weight 0.10000E+01 volume 0.30995E-03 ppm1 7.112 ppm2 3.638 CV 1
ASSI { 1959}
(( segid " " and resid 261 and name H ))
( segid " " and resid 230 and name HD1%)
3.900 1.900 1.900 peak 1959 spectrum 1 weight 0.10000E+01 volume 0.56406E-03 ppm1 8.909 ppm2 0.658 CV 1
ASSI { 1841}
(( segid " " and resid 338 and name HD21))
(( segid " " and resid 339 and name H ))
4.200 2.200 1.800 peak 1841 spectrum 1 weight 0.10000E+01 volume 0.21947E-03 ppm1 6.627 ppm2 8.369 CV 1
ASSI { 3175}
(( segid " " and resid 338 and name H ))
( segid " " and resid 329 and name HG2%)
4.200 2.200 1.800 peak 3175 spectrum 1 weight 0.10000E+01 volume 0.13091E-02 ppm1 7.696 ppm2 0.766 CV 1
ASSI { 2859}
(( segid " " and resid 418 and name H ))
(( segid " " and resid 417 and name H ))
3.000 1.100 1.100 peak 2859 spectrum 1 weight 0.10000E+01 volume 0.93946E-03 ppm1 8.188 ppm2 7.754 CV 1
ASSI { 388}
(( segid " " and resid 314 and name HD22))
(( segid " " and resid 314 and name HB2 ))
4.700 2.800 1.300 peak 388 spectrum 1 weight 0.10000E+01 volume 0.42353E-03 ppm1 8.332 ppm2 2.811 CV 1
OR { 388}
(( segid " " and resid 314 and name HD22))
(( segid " " and resid 314 and name HB3 ))
ASSI { 2027}
(( segid " " and resid 222 and name H ))
(( segid " " and resid 222 and name HA ))
2.800 1.000 1.000 peak 2027 spectrum 1 weight 0.10000E+01 volume 0.30668E-02 ppm1 7.251 ppm2 3.794 CV 1
ASSI { 1179}
(( segid " " and resid 196 and name H ))
(( segid " " and resid 193 and name HB3 ))
4.200 2.200 1.800 peak 1179 spectrum 1 weight 0.10000E+01 volume 0.13303E-02 ppm1 7.179 ppm2 1.678 CV 1
ASSI { 2029}
(( segid " " and resid 225 and name H ))
(( segid " " and resid 224 and name HA2 ))
3.600 1.600 1.600 peak 2029 spectrum 1 weight 0.10000E+01 volume 0.67187E-03 ppm1 7.796 ppm2 4.563 CV 1
ASSI { 1572}
(( segid " " and resid 333 and name H ))
(( segid " " and resid 332 and name HB3 ))
3.600 1.600 1.600 peak 1572 spectrum 1 weight 0.10000E+01 volume 0.96449E-03 ppm1 8.640 ppm2 2.622 CV 1
ASSI { 1631}
(( segid " " and resid 388 and name H ))
( segid " " and resid 387 and name HG2%)
3.000 1.200 1.200 peak 1631 spectrum 1 weight 0.10000E+01 volume 0.35057E-02 ppm1 8.234 ppm2 1.114 CV 1
ASSI { 539}
(( segid " " and resid 185 and name HD21))
(( segid " " and resid 186 and name HB3 ))
4.700 2.700 1.300 peak 539 spectrum 1 weight 0.10000E+01 volume 0.61606E-03 ppm1 6.795 ppm2 1.532 CV 1
OR { 539}
(( segid " " and resid 185 and name HD21))
(( segid " " and resid 186 and name HB2 ))
OR { 539}
(( segid " " and resid 185 and name HD21))
(( segid " " and resid 186 and name HG ))
ASSI { 762}
(( segid " " and resid 284 and name H ))
(( segid " " and resid 279 and name HB3 ))
3.600 1.600 1.600 peak 762 spectrum 1 weight 0.10000E+01 volume 0.11089E-02 ppm1 8.118 ppm2 1.460 CV 1
OR { 762}
(( segid " " and resid 284 and name H ))
(( segid " " and resid 279 and name HG ))
ASSI { 1875}
(( segid " " and resid 363 and name H ))
(( segid " " and resid 363 and name HB3 ))
3.200 1.300 1.300 peak 1875 spectrum 1 weight 0.10000E+01 volume 0.16460E-02 ppm1 7.267 ppm2 2.681 CV 1
ASSI { 2229}
(( segid " " and resid 388 and name H ))
(( segid " " and resid 389 and name HD2 ))
2.600 0.800 0.800 peak 2229 spectrum 1 weight 0.10000E+01 volume 0.16056E-02 ppm1 8.235 ppm2 3.134 CV 1
ASSI { 1048}
(( segid " " and resid 393 and name H ))
(( segid " " and resid 392 and name HB3 ))
3.600 1.600 1.600 peak 1048 spectrum 1 weight 0.10000E+01 volume 0.13823E-02 ppm1 8.264 ppm2 1.650 CV 1
ASSI { 1348}
(( segid " " and resid 375 and name HE22))
( segid " " and resid 377 and name HE% )
4.300 2.300 1.700 peak 1348 spectrum 1 weight 0.10000E+01 volume 0.95487E-03 ppm1 7.506 ppm2 2.002 CV 1
ASSI { 2608}
(( segid " " and resid 227 and name H ))
(( segid " " and resid 230 and name HA ))
6.000 4.900 0.000 peak 2608 spectrum 1 weight 0.10000E+01 volume 0.28107E-03 ppm1 7.129 ppm2 3.915 CV 1
ASSI { 392}
(( segid " " and resid 250 and name H ))
(( segid " " and resid 247 and name HB3 ))
3.900 1.900 1.900 peak 392 spectrum 1 weight 0.10000E+01 volume 0.49284E-03 ppm1 8.061 ppm2 3.001 CV 1
ASSI { 778}
(( segid " " and resid 377 and name H ))
(( segid " " and resid 376 and name HA ))
2.300 0.700 0.700 peak 778 spectrum 1 weight 0.10000E+01 volume 0.56444E-02 ppm1 8.234 ppm2 3.869 CV 1
ASSI { 2705}
(( segid " " and resid 290 and name H ))
( segid " " and resid 306 and name HD1%)
4.600 2.600 1.400 peak 2705 spectrum 1 weight 0.10000E+01 volume 0.45434E-03 ppm1 7.822 ppm2 0.379 CV 1
ASSI { 3065}
(( segid " " and resid 300 and name H ))
(( segid " " and resid 300 and name HA ))
2.800 1.000 1.000 peak 3065 spectrum 1 weight 0.10000E+01 volume 0.17115E-02 ppm1 7.921 ppm2 2.907 CV 1
ASSI { 2448}
(( segid " " and resid 425 and name H ))
(( segid " " and resid 424 and name HA ))
3.500 1.500 1.500 peak 2448 spectrum 1 weight 0.10000E+01 volume 0.10569E-02 ppm1 7.752 ppm2 4.244 CV 1
ASSI { 1812}
(( segid " " and resid 242 and name H ))
(( segid " " and resid 241 and name HA ))
3.200 1.300 1.300 peak 1812 spectrum 1 weight 0.10000E+01 volume 0.20118E-02 ppm1 7.548 ppm2 4.140 CV 1
ASSI { 2564}
(( segid " " and resid 316 and name H ))
( segid " " and resid 209 and name HD2%)
5.700 4.000 0.300 peak 2564 spectrum 1 weight 0.10000E+01 volume 0.29262E-03 ppm1 8.713 ppm2 -0.897 CV 1
ASSI { 2841}
(( segid " " and resid 225 and name H ))
(( segid " " and resid 220 and name HA ))
4.200 2.200 1.800 peak 2841 spectrum 1 weight 0.10000E+01 volume 0.47743E-03 ppm1 7.797 ppm2 3.336 CV 1
ASSI { 2450}
(( segid " " and resid 338 and name HD21))
(( segid " " and resid 338 and name HB2 ))
3.400 1.500 1.500 peak 2450 spectrum 1 weight 0.10000E+01 volume 0.12148E-02 ppm1 6.623 ppm2 2.820 CV 1
ASSI { 1280}
(( segid " " and resid 234 and name H ))
(( segid " " and resid 234 and name HA ))
3.800 1.800 1.800 peak 1280 spectrum 1 weight 0.10000E+01 volume 0.60256E-03 ppm1 8.665 ppm2 4.163 CV 1
ASSI { 2395}
(( segid " " and resid 257 and name H ))
(( segid " " and resid 257 and name HB3 ))
2.600 0.900 0.900 peak 2395 spectrum 1 weight 0.10000E+01 volume 0.43199E-02 ppm1 7.440 ppm2 2.395 CV 1
OR { 2395}
(( segid " " and resid 257 and name H ))
(( segid " " and resid 257 and name HB2 ))
ASSI { 435}
(( segid " " and resid 263 and name H ))
(( segid " " and resid 260 and name HA ))
3.900 1.900 1.900 peak 435 spectrum 1 weight 0.10000E+01 volume 0.42547E-03 ppm1 7.124 ppm2 4.338 CV 1
ASSI { 1286}
(( segid " " and resid 232 and name H ))
(( segid " " and resid 232 and name HB2 ))
2.900 1.100 1.100 peak 1286 spectrum 1 weight 0.10000E+01 volume 0.23333E-02 ppm1 8.792 ppm2 1.499 CV 1
OR { 1286}
(( segid " " and resid 232 and name H ))
(( segid " " and resid 232 and name HG3 ))
OR { 1286}
(( segid " " and resid 232 and name H ))
(( segid " " and resid 232 and name HG2 ))
ASSI { 2661}
(( segid " " and resid 354 and name HD21))
(( segid " " and resid 354 and name HB3 ))
2.600 0.900 0.900 peak 2661 spectrum 1 weight 0.10000E+01 volume 0.25681E-02 ppm1 7.473 ppm2 2.722 CV 1
OR { 2661}
(( segid " " and resid 354 and name HD21))
(( segid " " and resid 354 and name HB2 ))
ASSI { 1323}
(( segid " " and resid 200 and name H ))
(( segid " " and resid 200 and name HG3 ))
3.900 1.900 1.900 peak 1323 spectrum 1 weight 0.10000E+01 volume 0.97796E-03 ppm1 7.611 ppm2 1.577 CV 1
ASSI { 2259}
(( segid " " and resid 228 and name H ))
(( segid " " and resid 227 and name HB3 ))
4.400 2.400 1.600 peak 2259 spectrum 1 weight 0.10000E+01 volume 0.97605E-03 ppm1 8.444 ppm2 2.824 CV 1
ASSI { 2452}
(( segid " " and resid 254 and name H ))
(( segid " " and resid 254 and name HB3 ))
2.800 0.900 0.900 peak 2452 spectrum 1 weight 0.10000E+01 volume 0.20850E-02 ppm1 8.707 ppm2 2.952 CV 1
ASSI { 3091}
(( segid " " and resid 371 and name H ))
(( segid " " and resid 370 and name HB3 ))
3.700 1.700 1.700 peak 3091 spectrum 1 weight 0.10000E+01 volume 0.23083E-02 ppm1 7.539 ppm2 2.765 CV 1
OR { 3091}
(( segid " " and resid 371 and name H ))
(( segid " " and resid 370 and name HB2 ))
ASSI { 28}
(( segid " " and resid 430 and name HE1 ))
( segid " " and resid 423 and name HD1%)
5.000 3.200 1.000 peak 28 spectrum 1 weight 0.10000E+01 volume 0.62184E-03 ppm1 10.083 ppm2 0.849 CV 1
OR { 28}
(( segid " " and resid 430 and name HE1 ))
( segid " " and resid 423 and name HD2%)
ASSI { 998}
(( segid " " and resid 195 and name H ))
(( segid " " and resid 193 and name HB2 ))
3.200 1.300 1.300 peak 998 spectrum 1 weight 0.10000E+01 volume 0.69306E-03 ppm1 8.993 ppm2 2.340 CV 1
ASSI { 2965}
(( segid " " and resid 243 and name H ))
(( segid " " and resid 241 and name HA ))
4.100 2.100 1.900 peak 2965 spectrum 1 weight 0.10000E+01 volume 0.56600E-03 ppm1 7.862 ppm2 4.137 CV 1
ASSI { 1969}
(( segid " " and resid 340 and name HE22))
(( segid " " and resid 341 and name HA ))
4.000 2.000 2.000 peak 1969 spectrum 1 weight 0.10000E+01 volume 0.45240E-03 ppm1 7.419 ppm2 4.405 CV 1
ASSI { 2934}
(( segid " " and resid 232 and name H ))
(( segid " " and resid 231 and name HB3 ))
3.900 1.900 1.900 peak 2934 spectrum 1 weight 0.10000E+01 volume 0.40237E-03 ppm1 8.790 ppm2 2.825 CV 1
OR { 2934}
(( segid " " and resid 232 and name H ))
(( segid " " and resid 231 and name HB2 ))
ASSI { 1132}
(( segid " " and resid 382 and name HE1 ))
(( segid " " and resid 382 and name HA ))
4.500 2.500 1.500 peak 1132 spectrum 1 weight 0.10000E+01 volume 0.12533E-02 ppm1 9.606 ppm2 4.946 CV 1
ASSI { 2631}
(( segid " " and resid 228 and name H ))
( segid " " and resid 230 and name HG2%)
5.100 3.300 0.900 peak 2631 spectrum 1 weight 0.10000E+01 volume 0.55831E-03 ppm1 8.446 ppm2 0.946 CV 1
ASSI { 489}
(( segid " " and resid 333 and name H ))
(( segid " " and resid 334 and name HG2 ))
4.200 2.200 1.800 peak 489 spectrum 1 weight 0.10000E+01 volume 0.10300E-02 ppm1 8.642 ppm2 2.163 CV 1
OR { 489}
(( segid " " and resid 333 and name H ))
(( segid " " and resid 334 and name HG3 ))
ASSI { 2070}
(( segid " " and resid 334 and name H ))
(( segid " " and resid 332 and name HA ))
3.600 1.700 1.700 peak 2070 spectrum 1 weight 0.10000E+01 volume 0.12821E-02 ppm1 8.128 ppm2 4.179 CV 1
ASSI { 2145}
(( segid " " and resid 314 and name H ))
(( segid " " and resid 312 and name H ))
4.700 2.700 1.300 peak 2145 spectrum 1 weight 0.10000E+01 volume 0.50440E-03 ppm1 7.342 ppm2 8.768 CV 1
ASSI { 1212}
(( segid " " and resid 245 and name H ))
(( segid " " and resid 248 and name H ))
4.700 2.800 1.300 peak 1212 spectrum 1 weight 0.10000E+01 volume 0.33113E-03 ppm1 7.538 ppm2 8.871 CV 1
ASSI { 1884}
(( segid " " and resid 414 and name H ))
(( segid " " and resid 414 and name HA ))
2.800 1.000 1.000 peak 1884 spectrum 1 weight 0.10000E+01 volume 0.30822E-02 ppm1 7.674 ppm2 3.979 CV 1
ASSI { 462}
(( segid " " and resid 294 and name H ))
(( segid " " and resid 298 and name HG2 ))
4.100 2.200 1.900 peak 462 spectrum 1 weight 0.10000E+01 volume 0.40812E-03 ppm1 8.529 ppm2 2.179 CV 1
OR { 462}
(( segid " " and resid 294 and name H ))
(( segid " " and resid 298 and name HG3 ))
ASSI { 2415}
(( segid " " and resid 254 and name H ))
(( segid " " and resid 254 and name HA ))
3.100 1.200 1.200 peak 2415 spectrum 1 weight 0.10000E+01 volume 0.15401E-02 ppm1 8.705 ppm2 4.874 CV 1
ASSI { 427}
(( segid " " and resid 346 and name H ))
(( segid " " and resid 349 and name HB ))
4.700 2.700 1.300 peak 427 spectrum 1 weight 0.10000E+01 volume 0.39659E-03 ppm1 8.991 ppm2 4.419 CV 1
ASSI { 2982}
(( segid " " and resid 228 and name H ))
( segid " " and resid 230 and name HD1%)
6.000 5.000 0.000 peak 2982 spectrum 1 weight 0.10000E+01 volume 0.31380E-03 ppm1 8.445 ppm2 0.662 CV 1
ASSI { 243}
(( segid " " and resid 410 and name H ))
( segid " " and resid 407 and name HD% )
6.000 6.000 0.000 peak 243 spectrum 1 weight 0.10000E+01 volume 0.26182E-03 ppm1 7.896 ppm2 7.327 CV 1
ASSI { 2811}
(( segid " " and resid 274 and name H ))
(( segid " " and resid 274 and name HG ))
2.300 0.600 0.600 peak 2811 spectrum 1 weight 0.10000E+01 volume 0.30494E-02 ppm1 7.027 ppm2 1.510 CV 1
ASSI { 2605}
(( segid " " and resid 375 and name H ))
(( segid " " and resid 374 and name H ))
4.300 2.300 1.700 peak 2605 spectrum 1 weight 0.10000E+01 volume 0.84705E-03 ppm1 8.483 ppm2 6.323 CV 1
ASSI { 2536}
(( segid " " and resid 313 and name H ))
(( segid " " and resid 313 and name HB3 ))
2.900 1.000 1.000 peak 2536 spectrum 1 weight 0.10000E+01 volume 0.29551E-02 ppm1 8.626 ppm2 2.873 CV 1
OR { 2536}
(( segid " " and resid 313 and name H ))
(( segid " " and resid 313 and name HB2 ))
ASSI { 2506}
(( segid " " and resid 317 and name H ))
(( segid " " and resid 317 and name HA ))
3.000 1.100 1.100 peak 2506 spectrum 1 weight 0.10000E+01 volume 0.14054E-02 ppm1 7.529 ppm2 3.132 CV 1
ASSI { 1019}
(( segid " " and resid 341 and name HD21))
(( segid " " and resid 341 and name HD22))
1.800 0.400 0.400 peak 1019 spectrum 1 weight 0.10000E+01 volume 0.66323E-02 ppm1 6.991 ppm2 7.340 CV 1
ASSI { 3026}
(( segid " " and resid 370 and name HD21))
(( segid " " and resid 370 and name HA ))
2.800 1.000 1.000 peak 3026 spectrum 1 weight 0.10000E+01 volume 0.56367E-02 ppm1 6.834 ppm2 4.704 CV 1
ASSI { 1611}
(( segid " " and resid 352 and name H ))
(( segid " " and resid 350 and name HB ))
4.600 2.700 1.400 peak 1611 spectrum 1 weight 0.10000E+01 volume 0.57562E-03 ppm1 7.054 ppm2 2.490 CV 1
ASSI { 1165}
(( segid " " and resid 198 and name H ))
( segid " " and resid 198 and name HG2%)
2.800 1.000 1.000 peak 1165 spectrum 1 weight 0.10000E+01 volume 0.32939E-02 ppm1 8.608 ppm2 0.623 CV 1
OR { 1165}
(( segid " " and resid 198 and name H ))
( segid " " and resid 198 and name HG1%)
ASSI { 1414}
(( segid " " and resid 371 and name H ))
(( segid " " and resid 368 and name HA ))
4.700 2.700 1.300 peak 1414 spectrum 1 weight 0.10000E+01 volume 0.66418E-03 ppm1 7.537 ppm2 5.183 CV 1
ASSI { 1763}
(( segid " " and resid 220 and name H ))
(( segid " " and resid 219 and name HB2 ))
3.000 1.100 1.100 peak 1763 spectrum 1 weight 0.10000E+01 volume 0.93371E-03 ppm1 8.680 ppm2 3.169 CV 1
OR { 1763}
(( segid " " and resid 220 and name H ))
(( segid " " and resid 219 and name HB3 ))
ASSI { 2583}
(( segid " " and resid 194 and name H ))
(( segid " " and resid 194 and name HB3 ))
3.000 1.100 1.100 peak 2583 spectrum 1 weight 0.10000E+01 volume 0.10973E-02 ppm1 9.118 ppm2 1.495 CV 1
OR { 2583}
(( segid " " and resid 194 and name H ))
(( segid " " and resid 194 and name HB2 ))
ASSI { 2669}
(( segid " " and resid 191 and name H ))
(( segid " " and resid 273 and name HA ))
4.500 2.500 1.500 peak 2669 spectrum 1 weight 0.10000E+01 volume 0.65262E-03 ppm1 9.241 ppm2 4.459 CV 1
ASSI { 2658}
(( segid " " and resid 290 and name H ))
( segid " " and resid 287 and name HD% )
5.600 3.900 0.400 peak 2658 spectrum 1 weight 0.10000E+01 volume 0.23294E-03 ppm1 7.823 ppm2 6.336 CV 1
ASSI { 2235}
(( segid " " and resid 395 and name H ))
(( segid " " and resid 395 and name HG3 ))
5.500 3.800 0.500 peak 2235 spectrum 1 weight 0.10000E+01 volume 0.33113E-03 ppm1 9.086 ppm2 2.455 CV 1
ASSI { 1514}
(( segid " " and resid 290 and name H ))
( segid " " and resid 306 and name HD2%)
3.600 1.600 1.600 peak 1514 spectrum 1 weight 0.10000E+01 volume 0.10877E-02 ppm1 7.821 ppm2 -0.356 CV 1
ASSI { 2719}
(( segid " " and resid 403 and name H ))
(( segid " " and resid 402 and name HA ))
3.700 1.700 1.700 peak 2719 spectrum 1 weight 0.10000E+01 volume 0.67959E-03 ppm1 7.564 ppm2 3.409 CV 1
ASSI { 2968}
(( segid " " and resid 192 and name H ))
(( segid " " and resid 193 and name HD2 ))
5.500 3.800 0.500 peak 2968 spectrum 1 weight 0.10000E+01 volume 0.31958E-03 ppm1 6.703 ppm2 3.869 CV 1
ASSI { 2189}
(( segid " " and resid 298 and name H ))
(( segid " " and resid 298 and name HG3 ))
2.000 0.500 0.500 peak 2189 spectrum 1 weight 0.10000E+01 volume 0.43699E-02 ppm1 7.338 ppm2 2.178 CV 1
OR { 2189}
(( segid " " and resid 298 and name H ))
(( segid " " and resid 298 and name HG2 ))
ASSI { 101}
(( segid " " and resid 224 and name H ))
(( segid " " and resid 220 and name HA ))
3.000 1.100 1.100 peak 101 spectrum 1 weight 0.10000E+01 volume 0.65262E-03 ppm1 9.043 ppm2 3.335 CV 1
ASSI { 2490}
(( segid " " and resid 227 and name H ))
(( segid " " and resid 226 and name HB2 ))
3.600 1.700 1.700 peak 2490 spectrum 1 weight 0.10000E+01 volume 0.13649E-02 ppm1 7.128 ppm2 1.524 CV 1
ASSI { 2461}
(( segid " " and resid 238 and name H ))
(( segid " " and resid 237 and name HG3 ))
3.600 1.600 1.600 peak 2461 spectrum 1 weight 0.10000E+01 volume 0.98762E-03 ppm1 8.664 ppm2 1.374 CV 1
ASSI { 1406}
(( segid " " and resid 395 and name H ))
(( segid " " and resid 394 and name HA ))
3.300 1.400 1.400 peak 1406 spectrum 1 weight 0.10000E+01 volume 0.73350E-03 ppm1 9.083 ppm2 4.618 CV 1
OR { 1406}
(( segid " " and resid 395 and name H ))
(( segid " " and resid 394 and name HB ))
ASSI { 1807}
(( segid " " and resid 286 and name H ))
(( segid " " and resid 286 and name HA ))
3.000 1.100 1.100 peak 1807 spectrum 1 weight 0.10000E+01 volume 0.15709E-02 ppm1 7.443 ppm2 4.123 CV 1
ASSI { 1243}
(( segid " " and resid 271 and name H ))
( segid " " and resid 271 and name HD2%)
3.900 1.900 1.900 peak 1243 spectrum 1 weight 0.10000E+01 volume 0.21620E-02 ppm1 7.669 ppm2 0.739 CV 1
ASSI { 2017}
(( segid " " and resid 213 and name H ))
(( segid " " and resid 213 and name HB3 ))
3.500 1.600 1.600 peak 2017 spectrum 1 weight 0.10000E+01 volume 0.41200E-03 ppm1 5.886 ppm2 2.720 CV 1
ASSI { 1697}
(( segid " " and resid 382 and name HE1 ))
(( segid " " and resid 382 and name HD1 ))
2.400 0.700 0.700 peak 1697 spectrum 1 weight 0.10000E+01 volume 0.71943E-02 ppm1 9.606 ppm2 6.936 CV 1
ASSI { 2245}
(( segid " " and resid 368 and name H ))
(( segid " " and resid 368 and name HA ))
3.200 1.300 1.300 peak 2245 spectrum 1 weight 0.10000E+01 volume 0.11070E-02 ppm1 8.216 ppm2 5.171 CV 1
ASSI { 1853}
(( segid " " and resid 340 and name H ))
(( segid " " and resid 340 and name HA ))
2.500 0.800 0.800 peak 1853 spectrum 1 weight 0.10000E+01 volume 0.39215E-02 ppm1 8.164 ppm2 4.024 CV 1
ASSI { 1008}
(( segid " " and resid 320 and name HE1 ))
(( segid " " and resid 320 and name HB2 ))
5.000 3.100 1.000 peak 1008 spectrum 1 weight 0.10000E+01 volume 0.36578E-03 ppm1 10.123 ppm2 2.920 CV 1
ASSI { 2917}
(( segid " " and resid 222 and name H ))
(( segid " " and resid 222 and name HB2 ))
2.300 0.700 0.700 peak 2917 spectrum 1 weight 0.10000E+01 volume 0.30764E-02 ppm1 7.251 ppm2 1.235 CV 1
ASSI { 1169}
(( segid " " and resid 261 and name HD21))
(( segid " " and resid 261 and name HA ))
4.400 2.500 1.600 peak 1169 spectrum 1 weight 0.10000E+01 volume 0.64878E-03 ppm1 7.531 ppm2 4.509 CV 1
ASSI { 47}
(( segid " " and resid 433 and name HE22))
( segid " " and resid 429 and name HD2%)
3.100 1.200 1.200 peak 47 spectrum 1 weight 0.10000E+01 volume 0.31264E-02 ppm1 6.711 ppm2 0.667 CV 1
ASSI { 1984}
(( segid " " and resid 341 and name H ))
(( segid " " and resid 340 and name HB3 ))
2.400 0.700 0.700 peak 1984 spectrum 1 weight 0.10000E+01 volume 0.25951E-02 ppm1 8.540 ppm2 2.037 CV 1
ASSI { 192}
(( segid " " and resid 346 and name H ))
( segid " " and resid 342 and name HG2%)
4.300 2.300 1.700 peak 192 spectrum 1 weight 0.10000E+01 volume 0.36772E-03 ppm1 8.987 ppm2 0.535 CV 1
ASSI { 434}
(( segid " " and resid 222 and name H ))
(( segid " " and resid 219 and name HB2 ))
4.300 2.300 1.700 peak 434 spectrum 1 weight 0.10000E+01 volume 0.43893E-03 ppm1 7.252 ppm2 3.199 CV 1
ASSI { 2210}
(( segid " " and resid 433 and name H ))
(( segid " " and resid 432 and name HA ))
4.100 2.100 1.900 peak 2210 spectrum 1 weight 0.10000E+01 volume 0.38503E-03 ppm1 8.312 ppm2 3.638 CV 1
ASSI { 1203}
(( segid " " and resid 237 and name H ))
( segid " " and resid 236 and name HD1%)
6.000 5.500 0.000 peak 1203 spectrum 1 weight 0.10000E+01 volume 0.40237E-03 ppm1 8.775 ppm2 0.828 CV 1
ASSI { 659}
(( segid " " and resid 224 and name H ))
(( segid " " and resid 225 and name HG3 ))
5.200 3.300 0.800 peak 659 spectrum 1 weight 0.10000E+01 volume 0.24642E-03 ppm1 9.047 ppm2 2.689 CV 1
ASSI { 1223}
(( segid " " and resid 320 and name HE1 ))
(( segid " " and resid 319 and name HB3 ))
5.900 4.400 0.100 peak 1223 spectrum 1 weight 0.10000E+01 volume 0.28300E-03 ppm1 10.119 ppm2 3.104 CV 1
ASSI { 1851}
(( segid " " and resid 320 and name H ))
(( segid " " and resid 320 and name HB2 ))
2.700 0.900 0.900 peak 1851 spectrum 1 weight 0.10000E+01 volume 0.86246E-03 ppm1 8.414 ppm2 2.913 CV 1
ASSI { 1667}
(( segid " " and resid 196 and name H ))
( segid " " and resid 192 and name HD1%)
4.300 2.300 1.700 peak 1667 spectrum 1 weight 0.10000E+01 volume 0.11070E-02 ppm1 7.178 ppm2 0.884 CV 1
ASSI { 2522}
(( segid " " and resid 303 and name H ))
(( segid " " and resid 303 and name HA ))
2.700 0.900 0.900 peak 2522 spectrum 1 weight 0.10000E+01 volume 0.20638E-02 ppm1 8.738 ppm2 3.817 CV 1
ASSI { 1159}
(( segid " " and resid 239 and name H ))
(( segid " " and resid 238 and name H ))
3.100 1.200 1.200 peak 1159 spectrum 1 weight 0.10000E+01 volume 0.74118E-03 ppm1 7.101 ppm2 8.662 CV 1
ASSI { 3187}
(( segid " " and resid 227 and name H ))
(( segid " " and resid 228 and name H ))
4.400 2.500 1.600 peak 3187 spectrum 1 weight 0.10000E+01 volume 0.10165E-02 ppm1 7.130 ppm2 8.441 CV 1
ASSI { 2048}
(( segid " " and resid 420 and name H ))
(( segid " " and resid 418 and name H ))
3.700 1.700 1.700 peak 2048 spectrum 1 weight 0.10000E+01 volume 0.62184E-03 ppm1 7.495 ppm2 8.198 CV 1
ASSI { 2218}
(( segid " " and resid 341 and name H ))
(( segid " " and resid 341 and name HA ))
2.800 1.000 1.000 peak 2218 spectrum 1 weight 0.10000E+01 volume 0.22659E-02 ppm1 8.540 ppm2 4.422 CV 1
ASSI { 970}
(( segid " " and resid 370 and name H ))
( segid " " and resid 371 and name HG2%)
4.500 2.500 1.500 peak 970 spectrum 1 weight 0.10000E+01 volume 0.11493E-02 ppm1 8.417 ppm2 0.971 CV 1
ASSI { 455}
(( segid " " and resid 222 and name H ))
(( segid " " and resid 223 and name HB2 ))
4.700 2.700 1.300 peak 455 spectrum 1 weight 0.10000E+01 volume 0.90480E-03 ppm1 7.249 ppm2 1.767 CV 1
ASSI { 2358}
(( segid " " and resid 353 and name H ))
(( segid " " and resid 352 and name HB ))
4.200 2.300 1.800 peak 2358 spectrum 1 weight 0.10000E+01 volume 0.55253E-03 ppm1 8.945 ppm2 1.162 CV 1
ASSI { 2692}
(( segid " " and resid 251 and name H ))
(( segid " " and resid 251 and name HA ))
3.000 1.100 1.100 peak 2692 spectrum 1 weight 0.10000E+01 volume 0.22313E-02 ppm1 7.886 ppm2 4.205 CV 1
ASSI { 1623}
(( segid " " and resid 224 and name H ))
(( segid " " and resid 224 and name HA3 ))
2.900 1.000 1.000 peak 1623 spectrum 1 weight 0.10000E+01 volume 0.77968E-03 ppm1 9.046 ppm2 3.623 CV 1
ASSI { 1340}
(( segid " " and resid 235 and name H ))
(( segid " " and resid 234 and name HB2 ))
4.000 2.000 2.000 peak 1340 spectrum 1 weight 0.10000E+01 volume 0.96065E-03 ppm1 7.895 ppm2 3.798 CV 1
ASSI { 881}
(( segid " " and resid 273 and name H ))
(( segid " " and resid 271 and name HG ))
4.300 2.300 1.700 peak 881 spectrum 1 weight 0.10000E+01 volume 0.50631E-03 ppm1 7.700 ppm2 2.188 CV 1
ASSI { 429}
(( segid " " and resid 253 and name H ))
( segid " " and resid 247 and name HE% )
4.400 2.400 1.600 peak 429 spectrum 1 weight 0.10000E+01 volume 0.46203E-03 ppm1 8.260 ppm2 6.474 CV 1
ASSI { 2879}
(( segid " " and resid 340 and name HE22))
(( segid " " and resid 340 and name HA ))
5.400 3.600 0.600 peak 2879 spectrum 1 weight 0.10000E+01 volume 0.10184E-02 ppm1 7.417 ppm2 4.023 CV 1
ASSI { 2221}
(( segid " " and resid 322 and name H ))
(( segid " " and resid 322 and name HG13))
4.300 2.300 1.700 peak 2221 spectrum 1 weight 0.10000E+01 volume 0.68921E-03 ppm1 8.219 ppm2 0.216 CV 1
ASSI { 1949}
(( segid " " and resid 309 and name H ))
(( segid " " and resid 309 and name HG3 ))
3.100 1.200 1.200 peak 1949 spectrum 1 weight 0.10000E+01 volume 0.73039E-02 ppm1 7.489 ppm2 2.167 CV 1
ASSI { 631}
(( segid " " and resid 433 and name HE22))
(( segid " " and resid 429 and name HA ))
5.100 3.300 0.900 peak 631 spectrum 1 weight 0.10000E+01 volume 0.30032E-03 ppm1 6.709 ppm2 3.753 CV 1
ASSI { 2459}
(( segid " " and resid 365 and name HE21))
(( segid " " and resid 365 and name HG2 ))
2.000 0.500 0.500 peak 2459 spectrum 1 weight 0.10000E+01 volume 0.65974E-02 ppm1 6.880 ppm2 2.352 CV 1
OR { 2459}
(( segid " " and resid 365 and name HE21))
(( segid " " and resid 365 and name HG3 ))
ASSI { 1603}
(( segid " " and resid 444 and name H ))
(( segid " " and resid 444 and name HA ))
2.500 0.800 0.800 peak 1603 spectrum 1 weight 0.10000E+01 volume 0.49228E-02 ppm1 7.768 ppm2 4.226 CV 1
ASSI { 1102}
(( segid " " and resid 256 and name H ))
( segid " " and resid 255 and name HD2%)
5.000 3.100 1.000 peak 1102 spectrum 1 weight 0.10000E+01 volume 0.61412E-03 ppm1 8.252 ppm2 0.789 CV 1
ASSI { 2427}
(( segid " " and resid 248 and name H ))
(( segid " " and resid 248 and name HB3 ))
2.900 1.100 1.100 peak 2427 spectrum 1 weight 0.10000E+01 volume 0.19598E-02 ppm1 8.880 ppm2 2.931 CV 1
ASSI { 668}
(( segid " " and resid 372 and name H ))
(( segid " " and resid 371 and name HA ))
2.100 0.600 0.600 peak 668 spectrum 1 weight 0.10000E+01 volume 0.70057E-02 ppm1 7.921 ppm2 3.729 CV 1
ASSI { 2381}
(( segid " " and resid 338 and name HD22))
( segid " " and resid 329 and name HG2%)
5.600 3.900 0.400 peak 2381 spectrum 1 weight 0.10000E+01 volume 0.40428E-03 ppm1 7.444 ppm2 0.721 CV 1
ASSI { 3017}
(( segid " " and resid 261 and name H ))
(( segid " " and resid 261 and name HB3 ))
2.800 1.000 1.000 peak 3017 spectrum 1 weight 0.10000E+01 volume 0.22620E-02 ppm1 8.908 ppm2 3.051 CV 1
ASSI { 1313}
(( segid " " and resid 273 and name H ))
(( segid " " and resid 272 and name HA ))
3.100 1.200 1.200 peak 1313 spectrum 1 weight 0.10000E+01 volume 0.19425E-02 ppm1 7.704 ppm2 4.269 CV 1
ASSI { 1533}
(( segid " " and resid 271 and name H ))
(( segid " " and resid 271 and name HB3 ))
3.700 1.700 1.700 peak 1533 spectrum 1 weight 0.10000E+01 volume 0.67765E-03 ppm1 7.669 ppm2 1.124 CV 1
ASSI { 2347}
(( segid " " and resid 249 and name H ))
(( segid " " and resid 249 and name HA ))
3.000 1.100 1.100 peak 2347 spectrum 1 weight 0.10000E+01 volume 0.21812E-02 ppm1 7.300 ppm2 4.363 CV 1
ASSI { 1295}
(( segid " " and resid 374 and name H ))
(( segid " " and resid 372 and name H ))
3.600 1.600 1.600 peak 1295 spectrum 1 weight 0.10000E+01 volume 0.16749E-03 ppm1 6.334 ppm2 7.893 CV 1
ASSI { 1604}
(( segid " " and resid 248 and name H ))
(( segid " " and resid 189 and name HB ))
3.900 1.900 1.900 peak 1604 spectrum 1 weight 0.10000E+01 volume 0.74696E-03 ppm1 8.879 ppm2 2.191 CV 1
ASSI { 363}
(( segid " " and resid 446 and name H ))
( segid " " and resid 398 and name HD1%)
4.100 2.100 1.900 peak 363 spectrum 1 weight 0.10000E+01 volume 0.64493E-03 ppm1 7.645 ppm2 0.565 CV 1
ASSI { 2317}
(( segid " " and resid 288 and name H ))
(( segid " " and resid 288 and name HB3 ))
2.500 0.800 0.800 peak 2317 spectrum 1 weight 0.10000E+01 volume 0.60238E-02 ppm1 7.477 ppm2 2.011 CV 1
OR { 2317}
(( segid " " and resid 288 and name H ))
(( segid " " and resid 288 and name HB2 ))
ASSI { 2512}
(( segid " " and resid 375 and name H ))
(( segid " " and resid 374 and name HB2 ))
3.500 1.500 1.500 peak 2512 spectrum 1 weight 0.10000E+01 volume 0.22736E-02 ppm1 8.483 ppm2 1.622 CV 1
ASSI { 2931}
(( segid " " and resid 261 and name HD21))
(( segid " " and resid 261 and name HB2 ))
3.300 1.300 1.300 peak 2931 spectrum 1 weight 0.10000E+01 volume 0.11570E-02 ppm1 7.526 ppm2 2.269 CV 1
ASSI { 1557}
(( segid " " and resid 375 and name H ))
(( segid " " and resid 374 and name HG3 ))
2.400 2.400 3.600 peak 1557 spectrum 1 weight 0.10000E+01 volume 0.20599E-02 ppm1 8.483 ppm2 1.364 CV 1
ASSI { 146}
(( segid " " and resid 350 and name H ))
(( segid " " and resid 351 and name HG3 ))
4.700 2.700 1.300 peak 146 spectrum 1 weight 0.10000E+01 volume 0.63147E-03 ppm1 7.626 ppm2 2.054 CV 1
OR { 146}
(( segid " " and resid 350 and name H ))
(( segid " " and resid 351 and name HB2 ))
ASSI { 2337}
(( segid " " and resid 314 and name H ))
( segid " " and resid 194 and name HD2%)
3.400 1.500 1.500 peak 2337 spectrum 1 weight 0.10000E+01 volume 0.11339E-02 ppm1 7.344 ppm2 0.577 CV 1
ASSI { 1600}
(( segid " " and resid 445 and name H ))
(( segid " " and resid 444 and name HD3 ))
4.000 2.000 2.000 peak 1600 spectrum 1 weight 0.10000E+01 volume 0.93946E-03 ppm1 7.904 ppm2 3.159 CV 1
ASSI { 2786}
(( segid " " and resid 396 and name H ))
(( segid " " and resid 395 and name HG2 ))
4.700 2.800 1.300 peak 2786 spectrum 1 weight 0.10000E+01 volume 0.87787E-03 ppm1 8.689 ppm2 2.318 CV 1
ASSI { 2425}
(( segid " " and resid 320 and name HE1 ))
(( segid " " and resid 320 and name HA ))
4.400 2.400 1.600 peak 2425 spectrum 1 weight 0.10000E+01 volume 0.10011E-02 ppm1 10.125 ppm2 3.827 CV 1
ASSI { 1196}
(( segid " " and resid 380 and name H ))
(( segid " " and resid 379 and name HA ))
3.600 1.600 1.600 peak 1196 spectrum 1 weight 0.10000E+01 volume 0.50825E-03 ppm1 9.050 ppm2 4.420 CV 1
ASSI { 285}
(( segid " " and resid 295 and name H ))
(( segid " " and resid 293 and name HB3 ))
2.700 0.900 0.900 peak 285 spectrum 1 weight 0.10000E+01 volume 0.16460E-02 ppm1 7.396 ppm2 1.709 CV 1
OR { 285}
(( segid " " and resid 295 and name H ))
(( segid " " and resid 293 and name HB2 ))
ASSI { 1279}
(( segid " " and resid 291 and name H ))
(( segid " " and resid 287 and name HA ))
4.200 2.200 1.800 peak 1279 spectrum 1 weight 0.10000E+01 volume 0.34268E-03 ppm1 7.356 ppm2 3.500 CV 1
ASSI { 2749}
(( segid " " and resid 324 and name H ))
(( segid " " and resid 324 and name HB2 ))
2.700 0.900 0.900 peak 2749 spectrum 1 weight 0.10000E+01 volume 0.15902E-02 ppm1 8.503 ppm2 2.889 CV 1
ASSI { 1662}
(( segid " " and resid 319 and name H ))
(( segid " " and resid 319 and name HA ))
2.900 1.000 1.000 peak 1662 spectrum 1 weight 0.10000E+01 volume 0.13245E-02 ppm1 7.859 ppm2 2.294 CV 1
ASSI { 826}
(( segid " " and resid 272 and name H ))
(( segid " " and resid 272 and name HG3 ))
2.300 0.700 0.700 peak 826 spectrum 1 weight 0.10000E+01 volume 0.45780E-02 ppm1 8.504 ppm2 1.845 CV 1
OR { 826}
(( segid " " and resid 272 and name H ))
(( segid " " and resid 272 and name HB2 ))
OR { 826}
(( segid " " and resid 272 and name H ))
(( segid " " and resid 272 and name HG2 ))
ASSI { 1616}
(( segid " " and resid 255 and name H ))
(( segid " " and resid 255 and name HA ))
3.100 1.200 1.200 peak 1616 spectrum 1 weight 0.10000E+01 volume 0.84705E-03 ppm1 8.608 ppm2 3.973 CV 1
ASSI { 2474}
(( segid " " and resid 369 and name H ))
(( segid " " and resid 369 and name HA2 ))
2.000 0.500 0.500 peak 2474 spectrum 1 weight 0.10000E+01 volume 0.70864E-02 ppm1 7.755 ppm2 3.854 CV 1
ASSI { 745}
(( segid " " and resid 201 and name H ))
(( segid " " and resid 202 and name HG3 ))
4.800 2.900 1.200 peak 745 spectrum 1 weight 0.10000E+01 volume 0.52940E-03 ppm1 7.495 ppm2 2.762 CV 1
ASSI { 492}
(( segid " " and resid 374 and name H ))
(( segid " " and resid 374 and name HE2 ))
5.700 4.100 0.300 peak 492 spectrum 1 weight 0.10000E+01 volume 0.25989E-03 ppm1 6.335 ppm2 2.913 CV 1
OR { 492}
(( segid " " and resid 374 and name H ))
(( segid " " and resid 374 and name HE3 ))
ASSI { 2621}
(( segid " " and resid 394 and name H ))
(( segid " " and resid 393 and name HB3 ))
3.800 1.900 1.900 peak 2621 spectrum 1 weight 0.10000E+01 volume 0.22024E-02 ppm1 7.546 ppm2 1.849 CV 1
ASSI { 989}
(( segid " " and resid 263 and name H ))
(( segid " " and resid 258 and name HB3 ))
4.300 2.300 1.700 peak 989 spectrum 1 weight 0.10000E+01 volume 0.30032E-03 ppm1 7.114 ppm2 2.740 CV 1
ASSI { 2586}
(( segid " " and resid 272 and name H ))
( segid " " and resid 271 and name HD1%)
4.300 2.300 1.700 peak 2586 spectrum 1 weight 0.10000E+01 volume 0.13187E-02 ppm1 8.496 ppm2 0.847 CV 1
ASSI { 2078}
(( segid " " and resid 327 and name H ))
(( segid " " and resid 327 and name HA ))
2.800 1.000 1.000 peak 2078 spectrum 1 weight 0.10000E+01 volume 0.27895E-02 ppm1 7.612 ppm2 4.460 CV 1
ASSI { 2376}
(( segid " " and resid 217 and name H ))
( segid " " and resid 217 and name HG2%)
3.400 1.500 1.500 peak 2376 spectrum 1 weight 0.10000E+01 volume 0.36983E-02 ppm1 7.490 ppm2 0.491 CV 1
OR { 2376}
(( segid " " and resid 217 and name H ))
(( segid " " and resid 217 and name HG12))
OR { 2376}
(( segid " " and resid 217 and name H ))
(( segid " " and resid 217 and name HG13))
ASSI { 2216}
(( segid " " and resid 279 and name H ))
( segid " " and resid 279 and name HD2%)
2.200 0.600 0.600 peak 2216 spectrum 1 weight 0.10000E+01 volume 0.15536E-02 ppm1 9.036 ppm2 0.377 CV 1
ASSI { 3000}
(( segid " " and resid 341 and name HD21))
( segid " " and resid 337 and name HE% )
3.500 1.500 1.500 peak 3000 spectrum 1 weight 0.10000E+01 volume 0.58524E-03 ppm1 6.992 ppm2 1.794 CV 1
OR { 3000}
(( segid " " and resid 341 and name HD21))
(( segid " " and resid 337 and name HG2 ))
ASSI { 448}
(( segid " " and resid 253 and name H ))
(( segid " " and resid 254 and name HB2 ))
5.300 3.500 0.700 peak 448 spectrum 1 weight 0.10000E+01 volume 0.28300E-03 ppm1 8.262 ppm2 2.616 CV 1
ASSI { 993}
(( segid " " and resid 237 and name H ))
(( segid " " and resid 236 and name HG13))
5.800 4.200 0.200 peak 993 spectrum 1 weight 0.10000E+01 volume 0.39850E-03 ppm1 8.774 ppm2 1.581 CV 1
ASSI { 1741}
(( segid " " and resid 336 and name H ))
(( segid " " and resid 336 and name HA ))
2.800 0.900 0.900 peak 1741 spectrum 1 weight 0.10000E+01 volume 0.15536E-02 ppm1 9.128 ppm2 3.977 CV 1
ASSI { 2559}
(( segid " " and resid 410 and name H ))
(( segid " " and resid 412 and name H ))
4.400 2.400 1.600 peak 2559 spectrum 1 weight 0.10000E+01 volume 0.46781E-03 ppm1 7.893 ppm2 8.452 CV 1
ASSI { 919}
(( segid " " and resid 369 and name H ))
(( segid " " and resid 367 and name HB3 ))
3.000 3.000 3.000 peak 919 spectrum 1 weight 0.10000E+01 volume 0.43509E-03 ppm1 7.753 ppm2 0.021 CV 1
ASSI { 1576}
(( segid " " and resid 216 and name H ))
(( segid " " and resid 216 and name HB2 ))
2.900 1.000 1.000 peak 1576 spectrum 1 weight 0.10000E+01 volume 0.13361E-02 ppm1 7.643 ppm2 2.339 CV 1
ASSI { 75}
(( segid " " and resid 394 and name H ))
(( segid " " and resid 442 and name HE3 ))
4.800 2.800 1.200 peak 75 spectrum 1 weight 0.10000E+01 volume 0.37540E-03 ppm1 7.548 ppm2 2.882 CV 1
OR { 75}
(( segid " " and resid 394 and name H ))
(( segid " " and resid 442 and name HE2 ))
ASSI { 1979}
(( segid " " and resid 347 and name H ))
(( segid " " and resid 347 and name HG ))
5.700 4.100 0.300 peak 1979 spectrum 1 weight 0.10000E+01 volume 0.29840E-03 ppm1 9.037 ppm2 5.259 CV 1
ASSI { 2523}
(( segid " " and resid 362 and name H ))
(( segid " " and resid 359 and name HA ))
3.900 1.900 1.900 peak 2523 spectrum 1 weight 0.10000E+01 volume 0.32535E-03 ppm1 7.787 ppm2 3.327 CV 1
ASSI { 2039}
(( segid " " and resid 433 and name HE22))
(( segid " " and resid 430 and name H ))
5.000 3.100 1.000 peak 2039 spectrum 1 weight 0.10000E+01 volume 0.29262E-03 ppm1 6.712 ppm2 7.796 CV 1
ASSI { 1012}
(( segid " " and resid 419 and name H ))
(( segid " " and resid 420 and name HG13))
4.700 2.800 1.300 peak 1012 spectrum 1 weight 0.10000E+01 volume 0.41390E-03 ppm1 7.958 ppm2 1.403 CV 1
ASSI { 1942}
(( segid " " and resid 312 and name H ))
(( segid " " and resid 311 and name HB3 ))
3.500 1.500 1.500 peak 1942 spectrum 1 weight 0.10000E+01 volume 0.11570E-02 ppm1 8.789 ppm2 2.498 CV 1
ASSI { 1091}
(( segid " " and resid 360 and name H ))
(( segid " " and resid 359 and name HA ))
3.400 1.400 1.400 peak 1091 spectrum 1 weight 0.10000E+01 volume 0.89906E-03 ppm1 7.279 ppm2 3.316 CV 1
ASSI { 290}
(( segid " " and resid 417 and name HE22))
(( segid " " and resid 414 and name HA ))
3.500 1.500 1.500 peak 290 spectrum 1 weight 0.10000E+01 volume 0.74118E-03 ppm1 6.742 ppm2 3.974 CV 1
ASSI { 2007}
(( segid " " and resid 212 and name H ))
(( segid " " and resid 211 and name HA ))
4.500 2.500 1.500 peak 2007 spectrum 1 weight 0.10000E+01 volume 0.20599E-03 ppm1 9.091 ppm2 3.842 CV 1
ASSI { 2625}
(( segid " " and resid 336 and name H ))
(( segid " " and resid 336 and name HE2 ))
5.500 3.800 0.500 peak 2625 spectrum 1 weight 0.10000E+01 volume 0.36384E-03 ppm1 9.128 ppm2 2.867 CV 1
OR { 2625}
(( segid " " and resid 336 and name H ))
(( segid " " and resid 336 and name HE3 ))
ASSI { 1442}
(( segid " " and resid 340 and name HE21))
(( segid " " and resid 340 and name HG3 ))
2.900 1.000 1.000 peak 1442 spectrum 1 weight 0.10000E+01 volume 0.34210E-02 ppm1 6.786 ppm2 2.329 CV 1
OR { 1442}
(( segid " " and resid 340 and name HE21))
(( segid " " and resid 340 and name HG2 ))
ASSI { 2513}
(( segid " " and resid 253 and name H ))
(( segid " " and resid 253 and name HB ))
3.100 1.200 1.200 peak 2513 spectrum 1 weight 0.10000E+01 volume 0.32670E-02 ppm1 8.257 ppm2 3.531 CV 1
ASSI { 2971}
(( segid " " and resid 340 and name HE22))
(( segid " " and resid 340 and name HB3 ))
4.100 2.100 1.900 peak 2971 spectrum 1 weight 0.10000E+01 volume 0.79703E-03 ppm1 7.416 ppm2 2.044 CV 1
ASSI { 2799}
(( segid " " and resid 365 and name HE22))
(( segid " " and resid 365 and name HG2 ))
2.600 0.800 0.800 peak 2799 spectrum 1 weight 0.10000E+01 volume 0.11432E-01 ppm1 7.588 ppm2 2.351 CV 1
OR { 2799}
(( segid " " and resid 365 and name HE22))
(( segid " " and resid 365 and name HG3 ))
ASSI { 1476}
(( segid " " and resid 372 and name H ))
(( segid " " and resid 372 and name HB ))
2.800 1.000 1.000 peak 1476 spectrum 1 weight 0.10000E+01 volume 0.41140E-02 ppm1 7.921 ppm2 1.715 CV 1
ASSI { 3171}
(( segid " " and resid 223 and name H ))
(( segid " " and resid 221 and name H ))
5.200 3.400 0.800 peak 3171 spectrum 1 weight 0.10000E+01 volume 0.22717E-03 ppm1 8.423 ppm2 8.712 CV 1
ASSI { 1677}
(( segid " " and resid 272 and name H ))
(( segid " " and resid 271 and name HA ))
3.200 1.300 1.300 peak 1677 spectrum 1 weight 0.10000E+01 volume 0.13803E-02 ppm1 8.495 ppm2 3.660 CV 1
ASSI { 2557}
(( segid " " and resid 280 and name H ))
(( segid " " and resid 280 and name HB ))
3.900 1.900 1.900 peak 2557 spectrum 1 weight 0.10000E+01 volume 0.14997E-02 ppm1 7.654 ppm2 4.554 CV 1
ASSI { 2182}
(( segid " " and resid 305 and name H ))
( segid " " and resid 306 and name HD2%)
4.700 2.700 1.300 peak 2182 spectrum 1 weight 0.10000E+01 volume 0.43315E-03 ppm1 7.498 ppm2 -0.357 CV 1
ASSI { 2533}
(( segid " " and resid 307 and name H ))
( segid " " and resid 306 and name HD1%)
4.500 2.500 1.500 peak 2533 spectrum 1 weight 0.10000E+01 volume 0.72771E-03 ppm1 8.735 ppm2 0.371 CV 1
ASSI { 2807}
(( segid " " and resid 359 and name H ))
(( segid " " and resid 356 and name HA ))
4.300 2.400 1.700 peak 2807 spectrum 1 weight 0.10000E+01 volume 0.57178E-03 ppm1 7.197 ppm2 3.632 CV 1
ASSI { 386}
(( segid " " and resid 257 and name H ))
(( segid " " and resid 258 and name HB2 ))
4.500 2.500 1.500 peak 386 spectrum 1 weight 0.10000E+01 volume 0.10685E-02 ppm1 7.438 ppm2 2.643 CV 1
OR { 386}
(( segid " " and resid 257 and name H ))
(( segid " " and resid 258 and name HB3 ))
ASSI { 2209}
(( segid " " and resid 363 and name H ))
(( segid " " and resid 362 and name HB ))
3.700 1.700 1.700 peak 2209 spectrum 1 weight 0.10000E+01 volume 0.11897E-02 ppm1 7.263 ppm2 3.800 CV 1
ASSI { 1229}
(( segid " " and resid 247 and name H ))
( segid " " and resid 246 and name HB% )
2.800 0.900 0.900 peak 1229 spectrum 1 weight 0.10000E+01 volume 0.25855E-02 ppm1 8.433 ppm2 1.188 CV 1
ASSI { 2766}
(( segid " " and resid 352 and name H ))
(( segid " " and resid 347 and name HG ))
3.900 1.900 1.900 peak 2766 spectrum 1 weight 0.10000E+01 volume 0.47165E-03 ppm1 7.053 ppm2 5.274 CV 1
ASSI { 2492}
(( segid " " and resid 337 and name H ))
(( segid " " and resid 337 and name HB2 ))
3.100 1.200 1.200 peak 2492 spectrum 1 weight 0.10000E+01 volume 0.58331E-03 ppm1 7.313 ppm2 1.678 CV 1
ASSI { 924}
(( segid " " and resid 334 and name H ))
(( segid " " and resid 334 and name HG2 ))
2.400 0.700 0.700 peak 924 spectrum 1 weight 0.10000E+01 volume 0.40237E-02 ppm1 8.129 ppm2 2.185 CV 1
OR { 924}
(( segid " " and resid 334 and name H ))
(( segid " " and resid 334 and name HG3 ))
ASSI { 1052}
(( segid " " and resid 304 and name H ))
(( segid " " and resid 304 and name HB3 ))
3.500 1.500 1.500 peak 1052 spectrum 1 weight 0.10000E+01 volume 0.29320E-02 ppm1 8.674 ppm2 1.884 CV 1
ASSI { 2657}
(( segid " " and resid 375 and name H ))
(( segid " " and resid 375 and name HG2 ))
2.600 0.900 0.900 peak 2657 spectrum 1 weight 0.10000E+01 volume 0.29917E-02 ppm1 8.482 ppm2 2.289 CV 1
OR { 2657}
(( segid " " and resid 375 and name H ))
(( segid " " and resid 375 and name HG3 ))
ASSI { 1133}
(( segid " " and resid 341 and name H ))
(( segid " " and resid 341 and name HD22))
4.200 2.200 1.800 peak 1133 spectrum 1 weight 0.10000E+01 volume 0.71809E-03 ppm1 8.545 ppm2 7.329 CV 1
ASSI { 1443}
(( segid " " and resid 347 and name H ))
(( segid " " and resid 345 and name H ))
4.500 2.500 1.500 peak 1443 spectrum 1 weight 0.10000E+01 volume 0.38697E-03 ppm1 9.039 ppm2 7.052 CV 1
ASSI { 2518}
(( segid " " and resid 222 and name H ))
( segid " " and resid 223 and name HD% )
4.800 2.900 1.200 peak 2518 spectrum 1 weight 0.10000E+01 volume 0.76043E-03 ppm1 7.249 ppm2 6.440 CV 1
ASSI { 2623}
(( segid " " and resid 395 and name H ))
(( segid " " and resid 395 and name HG2 ))
5.300 3.600 0.700 peak 2623 spectrum 1 weight 0.10000E+01 volume 0.34075E-03 ppm1 9.094 ppm2 2.344 CV 1
ASSI { 2134}
(( segid " " and resid 225 and name H ))
(( segid " " and resid 224 and name HA3 ))
3.400 1.500 1.500 peak 2134 spectrum 1 weight 0.10000E+01 volume 0.70846E-03 ppm1 7.797 ppm2 3.621 CV 1
ASSI { 357}
(( segid " " and resid 338 and name H ))
(( segid " " and resid 341 and name HA ))
5.200 3.400 0.800 peak 357 spectrum 1 weight 0.10000E+01 volume 0.47359E-03 ppm1 7.704 ppm2 4.430 CV 1
ASSI { 1349}
(( segid " " and resid 367 and name H ))
( segid " " and resid 367 and name HD2%)
4.200 2.200 1.800 peak 1349 spectrum 1 weight 0.10000E+01 volume 0.18578E-02 ppm1 7.863 ppm2 0.771 CV 1
ASSI { 1998}
(( segid " " and resid 301 and name HE21))
(( segid " " and resid 301 and name HE22))
1.200 0.200 1.000 peak 1998 spectrum 1 weight 0.10000E+01 volume 0.75246E-01 ppm1 6.701 ppm2 7.358 CV 1
ASSI { 1992}
(( segid " " and resid 386 and name H ))
(( segid " " and resid 386 and name HA ))
2.600 0.900 0.900 peak 1992 spectrum 1 weight 0.10000E+01 volume 0.41852E-02 ppm1 7.960 ppm2 4.459 CV 1
ASSI { 1407}
(( segid " " and resid 437 and name H ))
(( segid " " and resid 439 and name H ))
4.800 2.900 1.200 peak 1407 spectrum 1 weight 0.10000E+01 volume 0.23294E-03 ppm1 8.212 ppm2 8.757 CV 1
ASSI { 2553}
(( segid " " and resid 259 and name H ))
(( segid " " and resid 260 and name HD3 ))
4.600 2.700 1.400 peak 2553 spectrum 1 weight 0.10000E+01 volume 0.86630E-03 ppm1 8.459 ppm2 3.818 CV 1
ASSI { 1749}
(( segid " " and resid 253 and name H ))
(( segid " " and resid 253 and name HA ))
2.700 0.900 0.900 peak 1749 spectrum 1 weight 0.10000E+01 volume 0.31072E-02 ppm1 8.257 ppm2 4.166 CV 1
ASSI { 2155}
(( segid " " and resid 189 and name H ))
(( segid " " and resid 248 and name HA ))
3.700 1.700 1.700 peak 2155 spectrum 1 weight 0.10000E+01 volume 0.53518E-03 ppm1 8.865 ppm2 4.872 CV 1
ASSI { 2655}
(( segid " " and resid 445 and name H ))
(( segid " " and resid 444 and name HG3 ))
2.200 2.200 3.800 peak 2655 spectrum 1 weight 0.10000E+01 volume 0.31900E-02 ppm1 7.907 ppm2 1.654 CV 1
ASSI { 2637}
(( segid " " and resid 358 and name H ))
( segid " " and resid 357 and name HD1%)
4.200 2.200 1.800 peak 2637 spectrum 1 weight 0.10000E+01 volume 0.16787E-02 ppm1 8.557 ppm2 0.698 CV 1
ASSI { 3139}
(( segid " " and resid 290 and name H ))
(( segid " " and resid 287 and name HA ))
3.100 1.200 1.200 peak 3139 spectrum 1 weight 0.10000E+01 volume 0.13264E-02 ppm1 7.821 ppm2 3.497 CV 1
ASSI { 2529}
(( segid " " and resid 257 and name H ))
(( segid " " and resid 255 and name HB2 ))
5.000 3.100 1.000 peak 2529 spectrum 1 weight 0.10000E+01 volume 0.37346E-03 ppm1 7.447 ppm2 1.705 CV 1
OR { 2529}
(( segid " " and resid 257 and name H ))
(( segid " " and resid 255 and name HG ))
ASSI { 1371}
(( segid " " and resid 320 and name HE1 ))
(( segid " " and resid 371 and name HB ))
5.700 4.100 0.300 peak 1371 spectrum 1 weight 0.10000E+01 volume 0.28877E-03 ppm1 10.128 ppm2 1.932 CV 1
ASSI { 1079}
(( segid " " and resid 328 and name H ))
(( segid " " and resid 327 and name HA ))
3.600 1.700 1.700 peak 1079 spectrum 1 weight 0.10000E+01 volume 0.76043E-03 ppm1 7.187 ppm2 4.443 CV 1
ASSI { 2132}
(( segid " " and resid 280 and name H ))
(( segid " " and resid 276 and name HG3 ))
4.800 2.900 1.200 peak 2132 spectrum 1 weight 0.10000E+01 volume 0.53518E-03 ppm1 7.664 ppm2 2.190 CV 1
ASSI { 1719}
(( segid " " and resid 428 and name H ))
(( segid " " and resid 428 and name HB2 ))
2.700 0.900 0.900 peak 1719 spectrum 1 weight 0.10000E+01 volume 0.23795E-02 ppm1 7.733 ppm2 2.064 CV 1
OR { 1719}
(( segid " " and resid 428 and name H ))
(( segid " " and resid 428 and name HB3 ))
ASSI { 553}
(( segid " " and resid 357 and name H ))
(( segid " " and resid 360 and name HB3 ))
5.600 3.900 0.400 peak 553 spectrum 1 weight 0.10000E+01 volume 0.30032E-03 ppm1 8.140 ppm2 3.095 CV 1
ASSI { 1797}
(( segid " " and resid 430 and name HE1 ))
(( segid " " and resid 430 and name HB3 ))
4.400 2.400 1.600 peak 1797 spectrum 1 weight 0.10000E+01 volume 0.10338E-02 ppm1 10.080 ppm2 3.310 CV 1
OR { 1797}
(( segid " " and resid 430 and name HE1 ))
(( segid " " and resid 430 and name HB2 ))
ASSI { 2825}
(( segid " " and resid 277 and name HD21))
(( segid " " and resid 277 and name HB2 ))
3.100 1.200 1.200 peak 2825 spectrum 1 weight 0.10000E+01 volume 0.90290E-03 ppm1 7.675 ppm2 2.693 CV 1
ASSI { 1241}
(( segid " " and resid 303 and name H ))
(( segid " " and resid 303 and name HB3 ))
3.900 1.900 1.900 peak 1241 spectrum 1 weight 0.10000E+01 volume 0.12648E-02 ppm1 8.746 ppm2 2.591 CV 1
ASSI { 1094}
(( segid " " and resid 278 and name H ))
(( segid " " and resid 277 and name HA ))
2.800 1.000 1.000 peak 1094 spectrum 1 weight 0.10000E+01 volume 0.18096E-02 ppm1 10.076 ppm2 4.520 CV 1
ASSI { 3031}
(( segid " " and resid 292 and name H ))
(( segid " " and resid 291 and name HB3 ))
3.100 1.200 1.200 peak 3031 spectrum 1 weight 0.10000E+01 volume 0.18212E-02 ppm1 7.808 ppm2 3.102 CV 1
ASSI { 2882}
(( segid " " and resid 280 and name H ))
(( segid " " and resid 282 and name H ))
5.300 3.500 0.700 peak 2882 spectrum 1 weight 0.10000E+01 volume 0.38697E-03 ppm1 7.652 ppm2 8.698 CV 1
ASSI { 1898}
(( segid " " and resid 351 and name HE22))
(( segid " " and resid 272 and name HD3 ))
2.800 2.800 3.200 peak 1898 spectrum 1 weight 0.10000E+01 volume 0.75465E-03 ppm1 7.558 ppm2 3.241 CV 1
OR { 1898}
(( segid " " and resid 351 and name HE22))
(( segid " " and resid 272 and name HD2 ))
ASSI { 318}
(( segid " " and resid 417 and name H ))
(( segid " " and resid 416 and name HA ))
3.000 1.200 1.200 peak 318 spectrum 1 weight 0.10000E+01 volume 0.18828E-02 ppm1 7.759 ppm2 4.280 CV 1
ASSI { 2838}
(( segid " " and resid 269 and name H ))
(( segid " " and resid 269 and name HA ))
2.800 1.000 1.000 peak 2838 spectrum 1 weight 0.10000E+01 volume 0.20734E-02 ppm1 8.201 ppm2 3.818 CV 1
ASSI { 2420}
(( segid " " and resid 236 and name H ))
(( segid " " and resid 236 and name HB ))
2.800 1.000 1.000 peak 2420 spectrum 1 weight 0.10000E+01 volume 0.17442E-02 ppm1 7.806 ppm2 1.770 CV 1
ASSI { 1032}
(( segid " " and resid 243 and name H ))
( segid " " and resid 258 and name HD% )
5.600 3.900 0.400 peak 1032 spectrum 1 weight 0.10000E+01 volume 0.25412E-03 ppm1 7.861 ppm2 7.102 CV 1
ASSI { 2219}
(( segid " " and resid 237 and name H ))
(( segid " " and resid 237 and name HB2 ))
3.300 1.400 1.400 peak 2219 spectrum 1 weight 0.10000E+01 volume 0.88555E-03 ppm1 8.770 ppm2 1.925 CV 1
ASSI { 1292}
(( segid " " and resid 437 and name H ))
(( segid " " and resid 437 and name HB ))
2.600 0.900 0.900 peak 1292 spectrum 1 weight 0.10000E+01 volume 0.19887E-02 ppm1 8.216 ppm2 4.233 CV 1
ASSI { 2104}
(( segid " " and resid 362 and name H ))
(( segid " " and resid 361 and name HB3 ))
4.900 3.000 1.100 peak 2104 spectrum 1 weight 0.10000E+01 volume 0.25989E-03 ppm1 7.798 ppm2 2.559 CV 1
ASSI { 1612}
(( segid " " and resid 320 and name H ))
( segid " " and resid 373 and name HD1%)
5.100 3.300 0.900 peak 1612 spectrum 1 weight 0.10000E+01 volume 0.46781E-03 ppm1 8.413 ppm2 -0.187 CV 1
ASSI { 2540}
(( segid " " and resid 234 and name H ))
(( segid " " and resid 235 and name H ))
5.300 3.500 0.700 peak 2540 spectrum 1 weight 0.10000E+01 volume 0.29455E-03 ppm1 8.663 ppm2 7.912 CV 1
ASSI { 1626}
(( segid " " and resid 319 and name H ))
(( segid " " and resid 319 and name HG ))
2.500 0.800 0.800 peak 1626 spectrum 1 weight 0.10000E+01 volume 0.14670E-02 ppm1 7.860 ppm2 4.098 CV 1
ASSI { 1}
(( segid " " and resid 301 and name HE21))
( segid " " and resid 297 and name HG2%)
2.500 0.800 0.800 peak 1 spectrum 1 weight 0.10000E+01 volume 0.50053E-02 ppm1 6.701 ppm2 1.124 CV 1
ASSI { 180}
(( segid " " and resid 295 and name H ))
(( segid " " and resid 298 and name HB3 ))
2.500 0.800 0.800 peak 180 spectrum 1 weight 0.10000E+01 volume 0.38658E-02 ppm1 7.396 ppm2 1.943 CV 1
OR { 180}
(( segid " " and resid 295 and name H ))
(( segid " " and resid 298 and name HB2 ))
ASSI { 3170}
(( segid " " and resid 246 and name H ))
(( segid " " and resid 243 and name H ))
4.200 2.200 1.800 peak 3170 spectrum 1 weight 0.10000E+01 volume 0.49478E-03 ppm1 7.443 ppm2 7.857 CV 1
ASSI { 2805}
(( segid " " and resid 439 and name H ))
(( segid " " and resid 439 and name HA ))
3.000 1.200 1.200 peak 2805 spectrum 1 weight 0.10000E+01 volume 0.11108E-02 ppm1 8.774 ppm2 3.827 CV 1
ASSI { 2169}
(( segid " " and resid 273 and name H ))
(( segid " " and resid 273 and name HB3 ))
3.600 1.600 1.600 peak 2169 spectrum 1 weight 0.10000E+01 volume 0.22235E-02 ppm1 7.705 ppm2 2.464 CV 1
ASSI { 2252}
(( segid " " and resid 410 and name HD21))
(( segid " " and resid 407 and name HB3 ))
5.800 4.100 0.200 peak 2252 spectrum 1 weight 0.10000E+01 volume 0.30032E-03 ppm1 6.908 ppm2 3.370 CV 1
ASSI { 2106}
(( segid " " and resid 416 and name H ))
(( segid " " and resid 415 and name HB3 ))
3.500 1.600 1.600 peak 2106 spectrum 1 weight 0.10000E+01 volume 0.95681E-03 ppm1 7.934 ppm2 2.592 CV 1
ASSI { 2271}
(( segid " " and resid 313 and name H ))
(( segid " " and resid 315 and name H ))
4.100 2.100 1.900 peak 2271 spectrum 1 weight 0.10000E+01 volume 0.53134E-03 ppm1 8.621 ppm2 8.320 CV 1
ASSI { 2790}
(( segid " " and resid 436 and name H ))
(( segid " " and resid 436 and name HB2 ))
2.900 1.100 1.100 peak 2790 spectrum 1 weight 0.10000E+01 volume 0.95102E-03 ppm1 8.929 ppm2 1.442 CV 1
ASSI { 2505}
(( segid " " and resid 344 and name H ))
(( segid " " and resid 344 and name HB ))
2.300 0.700 0.700 peak 2505 spectrum 1 weight 0.10000E+01 volume 0.36250E-02 ppm1 7.700 ppm2 1.900 CV 1
ASSI { 2520}
(( segid " " and resid 276 and name H ))
(( segid " " and resid 277 and name H ))
4.500 2.500 1.500 peak 2520 spectrum 1 weight 0.10000E+01 volume 0.86056E-03 ppm1 6.947 ppm2 8.690 CV 1
ASSI { 3078}
(( segid " " and resid 237 and name H ))
( segid " " and resid 236 and name HG2%)
3.700 1.700 1.700 peak 3078 spectrum 1 weight 0.10000E+01 volume 0.85284E-03 ppm1 8.771 ppm2 0.972 CV 1
ASSI { 2224}
(( segid " " and resid 246 and name H ))
(( segid " " and resid 247 and name HB2 ))
5.100 3.200 0.900 peak 2224 spectrum 1 weight 0.10000E+01 volume 0.55253E-03 ppm1 7.446 ppm2 3.026 CV 1
OR { 2224}
(( segid " " and resid 246 and name H ))
(( segid " " and resid 247 and name HB3 ))
ASSI { 2163}
(( segid " " and resid 221 and name H ))
(( segid " " and resid 220 and name HB ))
2.700 0.900 0.900 peak 2163 spectrum 1 weight 0.10000E+01 volume 0.16152E-02 ppm1 8.748 ppm2 2.264 CV 1
ASSI { 205}
(( segid " " and resid 390 and name H ))
( segid " " and resid 391 and name HD1%)
4.500 2.500 1.500 peak 205 spectrum 1 weight 0.10000E+01 volume 0.15902E-02 ppm1 8.064 ppm2 0.774 CV 1
ASSI { 2258}
(( segid " " and resid 255 and name H ))
(( segid " " and resid 254 and name HA ))
2.200 0.600 0.600 peak 2258 spectrum 1 weight 0.10000E+01 volume 0.28608E-02 ppm1 8.611 ppm2 4.865 CV 1
ASSI { 3144}
(( segid " " and resid 320 and name HE1 ))
( segid " " and resid 209 and name HD2%)
3.600 1.600 1.600 peak 3144 spectrum 1 weight 0.10000E+01 volume 0.94334E-03 ppm1 10.127 ppm2 -0.898 CV 1
ASSI { 1376}
(( segid " " and resid 433 and name HE21))
(( segid " " and resid 433 and name HG3 ))
2.700 0.900 0.900 peak 1376 spectrum 1 weight 0.10000E+01 volume 0.19059E-02 ppm1 6.976 ppm2 2.490 CV 1
ASSI { 1756}
(( segid " " and resid 415 and name H ))
(( segid " " and resid 415 and name HB3 ))
3.300 1.400 1.400 peak 1756 spectrum 1 weight 0.10000E+01 volume 0.24796E-02 ppm1 7.998 ppm2 2.587 CV 1
ASSI { 850}
(( segid " " and resid 228 and name H ))
(( segid " " and resid 228 and name HB3 ))
3.000 1.100 1.100 peak 850 spectrum 1 weight 0.10000E+01 volume 0.46742E-02 ppm1 8.444 ppm2 1.989 CV 1
OR { 850}
(( segid " " and resid 228 and name H ))
(( segid " " and resid 228 and name HG3 ))
ASSI { 2449}
(( segid " " and resid 296 and name H ))
(( segid " " and resid 295 and name HB ))
4.300 2.400 1.700 peak 2449 spectrum 1 weight 0.10000E+01 volume 0.51978E-03 ppm1 8.926 ppm2 4.389 CV 1
ASSI { 2397}
(( segid " " and resid 335 and name H ))
(( segid " " and resid 334 and name HA ))
3.800 1.800 1.800 peak 2397 spectrum 1 weight 0.10000E+01 volume 0.65840E-03 ppm1 8.874 ppm2 4.425 CV 1
ASSI { 1829}
(( segid " " and resid 190 and name H ))
( segid " " and resid 189 and name HG2%)
4.500 2.500 1.500 peak 1829 spectrum 1 weight 0.10000E+01 volume 0.32150E-03 ppm1 10.644 ppm2 0.955 CV 1
ASSI { 3040}
(( segid " " and resid 248 and name H ))
(( segid " " and resid 246 and name HA ))
4.100 2.100 1.900 peak 3040 spectrum 1 weight 0.10000E+01 volume 0.60256E-03 ppm1 8.885 ppm2 3.825 CV 1
ASSI { 2019}
(( segid " " and resid 435 and name H ))
(( segid " " and resid 435 and name HB ))
3.000 1.200 1.200 peak 2019 spectrum 1 weight 0.10000E+01 volume 0.91446E-03 ppm1 8.215 ppm2 1.987 CV 1
ASSI { 1074}
(( segid " " and resid 395 and name HE22))
(( segid " " and resid 395 and name HA ))
3.800 1.800 1.800 peak 1074 spectrum 1 weight 0.10000E+01 volume 0.13418E-02 ppm1 6.980 ppm2 3.766 CV 1
ASSI { 1263}
(( segid " " and resid 310 and name H ))
( segid " " and resid 283 and name HD2%)
4.100 2.100 1.900 peak 1263 spectrum 1 weight 0.10000E+01 volume 0.13322E-02 ppm1 7.065 ppm2 0.910 CV 1
ASSI { 1568}
(( segid " " and resid 333 and name H ))
(( segid " " and resid 332 and name HG3 ))
4.200 2.200 1.800 peak 1568 spectrum 1 weight 0.10000E+01 volume 0.12725E-02 ppm1 8.638 ppm2 1.978 CV 1
ASSI { 961}
(( segid " " and resid 251 and name H ))
(( segid " " and resid 251 and name HB3 ))
3.400 1.500 1.500 peak 961 spectrum 1 weight 0.10000E+01 volume 0.24064E-02 ppm1 7.888 ppm2 1.590 CV 1
ASSI { 147}
(( segid " " and resid 410 and name HD22))
(( segid " " and resid 411 and name HA ))
4.500 2.500 1.500 peak 147 spectrum 1 weight 0.10000E+01 volume 0.49090E-03 ppm1 7.495 ppm2 3.837 CV 1
ASSI { 1259}
(( segid " " and resid 372 and name H ))
(( segid " " and resid 371 and name HB ))
4.100 2.100 1.900 peak 1259 spectrum 1 weight 0.10000E+01 volume 0.93177E-03 ppm1 7.923 ppm2 1.938 CV 1
ASSI { 2773}
(( segid " " and resid 374 and name H ))
(( segid " " and resid 320 and name HZ2 ))
3.100 1.200 1.200 peak 2773 spectrum 1 weight 0.10000E+01 volume 0.96065E-03 ppm1 6.330 ppm2 7.383 CV 1
ASSI { 2803}
(( segid " " and resid 446 and name H ))
( segid " " and resid 446 and name HB% )
1.900 0.400 0.400 peak 2803 spectrum 1 weight 0.10000E+01 volume 0.26369E-01 ppm1 7.644 ppm2 1.274 CV 1
ASSI { 2668}
(( segid " " and resid 338 and name HD21))
(( segid " " and resid 338 and name HB3 ))
3.300 1.300 1.300 peak 2668 spectrum 1 weight 0.10000E+01 volume 0.75465E-03 ppm1 6.628 ppm2 3.086 CV 1
ASSI { 1989}
(( segid " " and resid 320 and name H ))
(( segid " " and resid 319 and name HA ))
3.800 1.800 1.800 peak 1989 spectrum 1 weight 0.10000E+01 volume 0.53518E-03 ppm1 8.418 ppm2 2.295 CV 1
ASSI { 3048}
(( segid " " and resid 439 and name H ))
(( segid " " and resid 439 and name HB3 ))
3.400 1.400 1.400 peak 3048 spectrum 1 weight 0.10000E+01 volume 0.16749E-02 ppm1 8.766 ppm2 1.939 CV 1
OR { 3048}
(( segid " " and resid 439 and name H ))
(( segid " " and resid 439 and name HG ))
ASSI { 1684}
(( segid " " and resid 340 and name HE21))
(( segid " " and resid 341 and name HA ))
3.500 1.600 1.600 peak 1684 spectrum 1 weight 0.10000E+01 volume 0.30417E-03 ppm1 6.783 ppm2 4.422 CV 1
ASSI { 1939}
(( segid " " and resid 354 and name HD22))
(( segid " " and resid 343 and name HA ))
3.600 1.600 1.600 peak 1939 spectrum 1 weight 0.10000E+01 volume 0.13861E-02 ppm1 6.454 ppm2 4.052 CV 1
ASSI { 2142}
(( segid " " and resid 395 and name HE21))
(( segid " " and resid 395 and name HG2 ))
2.500 0.800 0.800 peak 2142 spectrum 1 weight 0.10000E+01 volume 0.42815E-02 ppm1 7.773 ppm2 2.332 CV 1
ASSI { 2008}
(( segid " " and resid 243 and name H ))
(( segid " " and resid 243 and name HB2 ))
2.700 0.900 0.900 peak 2008 spectrum 1 weight 0.10000E+01 volume 0.12745E-02 ppm1 7.865 ppm2 1.803 CV 1
ASSI { 2740}
(( segid " " and resid 220 and name H ))
(( segid " " and resid 220 and name HB ))
3.100 1.200 1.200 peak 2740 spectrum 1 weight 0.10000E+01 volume 0.11204E-02 ppm1 8.678 ppm2 2.257 CV 1
ASSI { 3180}
(( segid " " and resid 365 and name HE22))
( segid " " and resid 364 and name HG2%)
3.600 1.600 1.600 peak 3180 spectrum 1 weight 0.10000E+01 volume 0.36962E-02 ppm1 7.587 ppm2 0.912 CV 1
ASSI { 1153}
(( segid " " and resid 283 and name H ))
( segid " " and resid 283 and name HD2%)
2.600 0.800 0.800 peak 1153 spectrum 1 weight 0.10000E+01 volume 0.13900E-02 ppm1 7.318 ppm2 0.907 CV 1
ASSI { 2632}
(( segid " " and resid 360 and name H ))
(( segid " " and resid 360 and name HA ))
3.000 1.100 1.100 peak 2632 spectrum 1 weight 0.10000E+01 volume 0.14477E-02 ppm1 7.278 ppm2 4.261 CV 1
ASSI { 2954}
(( segid " " and resid 396 and name H ))
(( segid " " and resid 396 and name HA ))
2.900 1.100 1.100 peak 2954 spectrum 1 weight 0.10000E+01 volume 0.28492E-02 ppm1 8.690 ppm2 4.010 CV 1
ASSI { 2290}
(( segid " " and resid 194 and name H ))
(( segid " " and resid 193 and name HG3 ))
5.300 3.500 0.700 peak 2290 spectrum 1 weight 0.10000E+01 volume 0.48515E-03 ppm1 9.124 ppm2 1.840 CV 1
ASSI { 1707}
(( segid " " and resid 309 and name H ))
(( segid " " and resid 307 and name H ))
3.900 1.900 1.900 peak 1707 spectrum 1 weight 0.10000E+01 volume 0.63147E-03 ppm1 7.492 ppm2 8.734 CV 1
ASSI { 2573}
(( segid " " and resid 351 and name HE22))
(( segid " " and resid 351 and name HE21))
1.200 0.200 1.000 peak 2573 spectrum 1 weight 0.10000E+01 volume 0.84603E-01 ppm1 7.561 ppm2 6.760 CV 1
ASSI { 1499}
(( segid " " and resid 325 and name H ))
(( segid " " and resid 213 and name HZ ))
3.100 3.100 2.900 peak 1499 spectrum 1 weight 0.10000E+01 volume 0.37156E-03 ppm1 8.508 ppm2 6.332 CV 1
ASSI { 140}
(( segid " " and resid 345 and name H ))
( segid " " and resid 342 and name HG2%)
5.200 3.300 0.800 peak 140 spectrum 1 weight 0.10000E+01 volume 0.28300E-03 ppm1 6.996 ppm2 0.536 CV 1
ASSI { 1075}
(( segid " " and resid 270 and name H ))
(( segid " " and resid 270 and name HB3 ))
2.900 1.100 1.100 peak 1075 spectrum 1 weight 0.10000E+01 volume 0.97605E-03 ppm1 8.540 ppm2 2.627 CV 1
ASSI { 1315}
(( segid " " and resid 272 and name H ))
( segid " " and resid 271 and name HD2%)
3.600 1.600 1.600 peak 1315 spectrum 1 weight 0.10000E+01 volume 0.22159E-02 ppm1 8.504 ppm2 0.738 CV 1
ASSI { 2576}
(( segid " " and resid 440 and name H ))
(( segid " " and resid 440 and name HB2 ))
2.700 0.900 0.900 peak 2576 spectrum 1 weight 0.10000E+01 volume 0.21639E-02 ppm1 8.443 ppm2 1.826 CV 1
OR { 2576}
(( segid " " and resid 440 and name H ))
(( segid " " and resid 440 and name HB3 ))
ASSI { 583}
(( segid " " and resid 230 and name H ))
( segid " " and resid 231 and name HD% )
6.000 5.600 0.000 peak 583 spectrum 1 weight 0.10000E+01 volume 0.30225E-03 ppm1 7.115 ppm2 6.782 CV 1
OR { 583}
(( segid " " and resid 230 and name H ))
( segid " " and resid 231 and name HE% )
ASSI { 1345}
(( segid " " and resid 296 and name H ))
(( segid " " and resid 296 and name HA ))
3.300 1.400 1.400 peak 1345 spectrum 1 weight 0.10000E+01 volume 0.44662E-03 ppm1 8.925 ppm2 3.769 CV 1
ASSI { 3197}
(( segid " " and resid 422 and name H ))
(( segid " " and resid 422 and name HB2 ))
2.700 0.900 0.900 peak 3197 spectrum 1 weight 0.10000E+01 volume 0.29743E-02 ppm1 8.203 ppm2 2.424 CV 1
ASSI { 996}
(( segid " " and resid 361 and name H ))
( segid " " and resid 322 and name HD1%)
4.700 2.800 1.300 peak 996 spectrum 1 weight 0.10000E+01 volume 0.63721E-03 ppm1 8.405 ppm2 -0.158 CV 1
ASSI { 1745}
(( segid " " and resid 375 and name HE22))
(( segid " " and resid 375 and name HG3 ))
3.200 1.300 1.300 peak 1745 spectrum 1 weight 0.10000E+01 volume 0.82146E-02 ppm1 7.505 ppm2 2.291 CV 1
OR { 1745}
(( segid " " and resid 375 and name HE22))
(( segid " " and resid 375 and name HG2 ))
ASSI { 2646}
(( segid " " and resid 212 and name H ))
(( segid " " and resid 212 and name HA ))
3.500 1.500 1.500 peak 2646 spectrum 1 weight 0.10000E+01 volume 0.52171E-03 ppm1 9.085 ppm2 3.237 CV 1
ASSI { 1268}
(( segid " " and resid 425 and name H ))
(( segid " " and resid 422 and name HB2 ))
4.000 2.000 2.000 peak 1268 spectrum 1 weight 0.10000E+01 volume 0.52171E-03 ppm1 7.759 ppm2 2.419 CV 1
ASSI { 2721}
(( segid " " and resid 265 and name H ))
( segid " " and resid 263 and name HG2%)
2.600 2.600 3.400 peak 2721 spectrum 1 weight 0.10000E+01 volume 0.10973E-02 ppm1 7.757 ppm2 0.806 CV 1
ASSI { 590}
(( segid " " and resid 395 and name HE21))
(( segid " " and resid 395 and name HB2 ))
3.700 1.700 1.700 peak 590 spectrum 1 weight 0.10000E+01 volume 0.13187E-02 ppm1 7.771 ppm2 2.035 CV 1
OR { 590}
(( segid " " and resid 395 and name HE21))
(( segid " " and resid 395 and name HB3 ))
ASSI { 1421}
(( segid " " and resid 308 and name H ))
(( segid " " and resid 305 and name HA ))
3.500 1.500 1.500 peak 1421 spectrum 1 weight 0.10000E+01 volume 0.14439E-02 ppm1 7.100 ppm2 3.819 CV 1
ASSI { 2974}
(( segid " " and resid 323 and name H ))
(( segid " " and resid 322 and name HG13))
5.300 3.500 0.700 peak 2974 spectrum 1 weight 0.10000E+01 volume 0.30417E-03 ppm1 7.782 ppm2 0.233 CV 1
ASSI { 2495}
(( segid " " and resid 433 and name HE22))
( segid " " and resid 432 and name HG1%)
3.100 1.200 1.200 peak 2495 spectrum 1 weight 0.10000E+01 volume 0.35809E-03 ppm1 6.708 ppm2 1.107 CV 1
OR { 2495}
(( segid " " and resid 433 and name HE22))
( segid " " and resid 432 and name HG2%)
ASSI { 1164}
(( segid " " and resid 273 and name H ))
(( segid " " and resid 272 and name HD2 ))
3.100 3.100 2.900 peak 1164 spectrum 1 weight 0.10000E+01 volume 0.40622E-03 ppm1 7.709 ppm2 3.239 CV 1
OR { 1164}
(( segid " " and resid 273 and name H ))
(( segid " " and resid 272 and name HD3 ))
ASSI { 1775}
(( segid " " and resid 286 and name H ))
( segid " " and resid 306 and name HD2%)
5.000 3.100 1.000 peak 1775 spectrum 1 weight 0.10000E+01 volume 0.67765E-03 ppm1 7.445 ppm2 -0.347 CV 1
ASSI { 806}
(( segid " " and resid 265 and name H ))
(( segid " " and resid 263 and name HA ))
4.200 2.200 1.800 peak 806 spectrum 1 weight 0.10000E+01 volume 0.44662E-03 ppm1 7.752 ppm2 3.149 CV 1
ASSI { 2907}
(( segid " " and resid 245 and name H ))
(( segid " " and resid 244 and name HD2 ))
2.300 2.300 3.700 peak 2907 spectrum 1 weight 0.10000E+01 volume 0.21080E-02 ppm1 7.531 ppm2 0.978 CV 1
ASSI { 2442}
(( segid " " and resid 227 and name H ))
(( segid " " and resid 226 and name H ))
2.500 0.800 0.800 peak 2442 spectrum 1 weight 0.10000E+01 volume 0.39811E-02 ppm1 7.130 ppm2 7.432 CV 1
ASSI { 1699}
(( segid " " and resid 410 and name HD22))
(( segid " " and resid 410 and name H ))
4.000 2.000 2.000 peak 1699 spectrum 1 weight 0.10000E+01 volume 0.10993E-02 ppm1 7.493 ppm2 7.893 CV 1
ASSI { 2164}
(( segid " " and resid 391 and name H ))
(( segid " " and resid 391 and name HA ))
2.900 1.000 1.000 peak 2164 spectrum 1 weight 0.10000E+01 volume 0.12417E-02 ppm1 8.202 ppm2 4.388 CV 1
ASSI { 1820}
(( segid " " and resid 371 and name H ))
(( segid " " and resid 371 and name HB ))
2.100 0.500 0.500 peak 1820 spectrum 1 weight 0.10000E+01 volume 0.48283E-02 ppm1 7.539 ppm2 1.935 CV 1
ASSI { 689}
(( segid " " and resid 248 and name H ))
( segid " " and resid 190 and name HE% )
4.000 2.000 2.000 peak 689 spectrum 1 weight 0.10000E+01 volume 0.36384E-03 ppm1 8.880 ppm2 7.148 CV 1
ASSI { 1620}
(( segid " " and resid 425 and name H ))
(( segid " " and resid 425 and name HB3 ))
3.700 1.700 1.700 peak 1620 spectrum 1 weight 0.10000E+01 volume 0.18020E-02 ppm1 7.758 ppm2 1.855 CV 1
ASSI { 2814}
(( segid " " and resid 341 and name HD22))
(( segid " " and resid 338 and name H ))
3.700 1.700 1.700 peak 2814 spectrum 1 weight 0.10000E+01 volume 0.10376E-02 ppm1 7.338 ppm2 7.710 CV 1
ASSI { 1010}
(( segid " " and resid 204 and name H ))
( segid " " and resid 204 and name HD% )
2.900 1.100 1.100 peak 1010 spectrum 1 weight 0.10000E+01 volume 0.16575E-02 ppm1 8.144 ppm2 6.878 CV 1
ASSI { 2005}
(( segid " " and resid 406 and name H ))
(( segid " " and resid 406 and name HG2 ))
4.200 2.200 1.800 peak 2005 spectrum 1 weight 0.10000E+01 volume 0.93177E-03 ppm1 9.263 ppm2 2.587 CV 1
ASSI { 2886}
(( segid " " and resid 439 and name H ))
(( segid " " and resid 438 and name HA ))
3.900 1.900 1.900 peak 2886 spectrum 1 weight 0.10000E+01 volume 0.71231E-03 ppm1 8.769 ppm2 4.092 CV 1
ASSI { 934}
(( segid " " and resid 226 and name H ))
(( segid " " and resid 334 and name HG3 ))
4.900 2.900 1.100 peak 934 spectrum 1 weight 0.10000E+01 volume 0.51209E-03 ppm1 7.430 ppm2 2.179 CV 1
OR { 934}
(( segid " " and resid 226 and name H ))
(( segid " " and resid 334 and name HG2 ))
ASSI { 592}
(( segid " " and resid 376 and name H ))
(( segid " " and resid 218 and name HA ))
5.000 3.200 1.000 peak 592 spectrum 1 weight 0.10000E+01 volume 0.40237E-03 ppm1 9.516 ppm2 4.056 CV 1
ASSI { 2363}
(( segid " " and resid 190 and name H ))
(( segid " " and resid 190 and name HB3 ))
5.200 3.400 0.800 peak 2363 spectrum 1 weight 0.10000E+01 volume 0.32343E-03 ppm1 10.649 ppm2 3.082 CV 1
ASSI { 2686}
(( segid " " and resid 376 and name H ))
(( segid " " and resid 375 and name HG3 ))
4.400 2.500 1.600 peak 2686 spectrum 1 weight 0.10000E+01 volume 0.89712E-03 ppm1 9.516 ppm2 2.293 CV 1
OR { 2686}
(( segid " " and resid 376 and name H ))
(( segid " " and resid 375 and name HG2 ))
ASSI { 2020}
(( segid " " and resid 200 and name H ))
( segid " " and resid 201 and name HG2%)
4.500 2.500 1.500 peak 2020 spectrum 1 weight 0.10000E+01 volume 0.77390E-03 ppm1 7.612 ppm2 1.305 CV 1
ASSI { 1573}
(( segid " " and resid 320 and name H ))
(( segid " " and resid 319 and name HG ))
4.100 2.100 1.900 peak 1573 spectrum 1 weight 0.10000E+01 volume 0.63337E-03 ppm1 8.420 ppm2 4.082 CV 1
ASSI { 1522}
(( segid " " and resid 388 and name H ))
(( segid " " and resid 382 and name HH2 ))
5.200 3.400 0.800 peak 1522 spectrum 1 weight 0.10000E+01 volume 0.33690E-03 ppm1 8.229 ppm2 7.185 CV 1
ASSI { 2246}
(( segid " " and resid 284 and name H ))
(( segid " " and resid 281 and name HA ))
3.100 1.200 1.200 peak 2246 spectrum 1 weight 0.10000E+01 volume 0.12167E-02 ppm1 8.116 ppm2 3.997 CV 1
ASSI { 728}
(( segid " " and resid 428 and name H ))
( segid " " and resid 423 and name HD1%)
4.800 2.900 1.200 peak 728 spectrum 1 weight 0.10000E+01 volume 0.84899E-03 ppm1 7.733 ppm2 0.858 CV 1
OR { 728}
(( segid " " and resid 428 and name H ))
( segid " " and resid 423 and name HD2%)
ASSI { 1574}
(( segid " " and resid 300 and name H ))
(( segid " " and resid 300 and name HB ))
3.300 1.300 1.300 peak 1574 spectrum 1 weight 0.10000E+01 volume 0.32265E-02 ppm1 7.920 ppm2 1.748 CV 1
ASSI { 2068}
(( segid " " and resid 425 and name H ))
(( segid " " and resid 425 and name HG2 ))
2.300 0.700 0.700 peak 2068 spectrum 1 weight 0.10000E+01 volume 0.20099E-02 ppm1 7.760 ppm2 1.477 CV 1
ASSI { 1359}
(( segid " " and resid 395 and name HE21))
(( segid " " and resid 395 and name HE22))
1.500 0.300 0.700 peak 1359 spectrum 1 weight 0.10000E+01 volume 0.23837E-01 ppm1 7.773 ppm2 6.977 CV 1
ASSI { 1379}
(( segid " " and resid 338 and name HD21))
(( segid " " and resid 340 and name H ))
4.400 2.400 1.600 peak 1379 spectrum 1 weight 0.10000E+01 volume 0.23102E-03 ppm1 6.618 ppm2 8.166 CV 1
ASSI { 2408}
(( segid " " and resid 307 and name H ))
(( segid " " and resid 306 and name HA ))
3.500 1.500 1.500 peak 2408 spectrum 1 weight 0.10000E+01 volume 0.45624E-03 ppm1 8.737 ppm2 3.661 CV 1
ASSI { 3111}
(( segid " " and resid 412 and name H ))
(( segid " " and resid 411 and name HB3 ))
3.400 1.500 1.500 peak 3111 spectrum 1 weight 0.10000E+01 volume 0.71615E-03 ppm1 8.446 ppm2 2.996 CV 1
ASSI { 1131}
(( segid " " and resid 303 and name H ))
(( segid " " and resid 302 and name HB3 ))
2.600 0.800 0.800 peak 1131 spectrum 1 weight 0.10000E+01 volume 0.19983E-02 ppm1 8.739 ppm2 2.095 CV 1
OR { 1131}
(( segid " " and resid 303 and name H ))
(( segid " " and resid 302 and name HG3 ))
ASSI { 2463}
(( segid " " and resid 332 and name H ))
(( segid " " and resid 331 and name HA ))
3.000 1.100 1.100 peak 2463 spectrum 1 weight 0.10000E+01 volume 0.13842E-02 ppm1 7.440 ppm2 4.556 CV 1
ASSI { 1410}
(( segid " " and resid 227 and name H ))
( segid " " and resid 230 and name HD1%)
4.500 2.500 1.500 peak 1410 spectrum 1 weight 0.10000E+01 volume 0.10222E-02 ppm1 7.129 ppm2 0.664 CV 1
ASSI { 2326}
(( segid " " and resid 341 and name HD21))
(( segid " " and resid 337 and name HB3 ))
3.800 1.800 1.800 peak 2326 spectrum 1 weight 0.10000E+01 volume 0.41584E-03 ppm1 6.993 ppm2 1.535 CV 1
ASSI { 968}
(( segid " " and resid 274 and name H ))
(( segid " " and resid 273 and name HA ))
3.200 1.200 1.200 peak 968 spectrum 1 weight 0.10000E+01 volume 0.19636E-02 ppm1 7.027 ppm2 4.441 CV 1
ASSI { 1022}
(( segid " " and resid 414 and name H ))
(( segid " " and resid 414 and name HB3 ))
2.800 1.000 1.000 peak 1022 spectrum 1 weight 0.10000E+01 volume 0.27626E-02 ppm1 7.672 ppm2 2.062 CV 1
ASSI { 2846}
(( segid " " and resid 206 and name H ))
(( segid " " and resid 206 and name HA2 ))
2.500 0.800 0.800 peak 2846 spectrum 1 weight 0.10000E+01 volume 0.26914E-02 ppm1 7.663 ppm2 3.589 CV 1
ASSI { 1664}
(( segid " " and resid 304 and name HE22))
( segid " " and resid 367 and name HD1%)
4.300 2.300 1.700 peak 1664 spectrum 1 weight 0.10000E+01 volume 0.17461E-02 ppm1 7.012 ppm2 0.684 CV 1
ASSI { 203}
(( segid " " and resid 365 and name HE22))
(( segid " " and resid 364 and name HA ))
5.900 4.400 0.100 peak 203 spectrum 1 weight 0.10000E+01 volume 0.35615E-03 ppm1 7.581 ppm2 3.627 CV 1
ASSI { 1830}
(( segid " " and resid 295 and name H ))
(( segid " " and resid 297 and name H ))
4.800 2.800 1.200 peak 1830 spectrum 1 weight 0.10000E+01 volume 0.60643E-03 ppm1 7.396 ppm2 8.066 CV 1
ASSI { 2140}
(( segid " " and resid 368 and name H ))
(( segid " " and resid 364 and name HA ))
3.900 1.900 1.900 peak 2140 spectrum 1 weight 0.10000E+01 volume 0.64109E-03 ppm1 8.216 ppm2 3.646 CV 1
ASSI { 2105}
(( segid " " and resid 239 and name H ))
(( segid " " and resid 238 and name HA ))
3.600 1.600 1.600 peak 2105 spectrum 1 weight 0.10000E+01 volume 0.89712E-03 ppm1 7.097 ppm2 4.140 CV 1
ASSI { 2061}
(( segid " " and resid 254 and name HD21))
(( segid " " and resid 254 and name HB2 ))
2.600 0.900 0.900 peak 2061 spectrum 1 weight 0.10000E+01 volume 0.42025E-02 ppm1 7.496 ppm2 2.627 CV 1
ASSI { 1060}
(( segid " " and resid 198 and name H ))
(( segid " " and resid 201 and name H ))
4.500 2.500 1.500 peak 1060 spectrum 1 weight 0.10000E+01 volume 0.45050E-03 ppm1 8.603 ppm2 7.524 CV 1
ASSI { 2872}
(( segid " " and resid 353 and name H ))
(( segid " " and resid 352 and name HG12))
4.300 2.300 1.700 peak 2872 spectrum 1 weight 0.10000E+01 volume 0.88171E-03 ppm1 8.953 ppm2 1.755 CV 1
ASSI { 2227}
(( segid " " and resid 398 and name H ))
(( segid " " and resid 398 and name HG13))
2.500 0.800 0.800 peak 2227 spectrum 1 weight 0.10000E+01 volume 0.18655E-02 ppm1 8.686 ppm2 1.634 CV 1
ASSI { 1069}
(( segid " " and resid 424 and name H ))
(( segid " " and resid 423 and name H ))
2.900 1.000 1.000 peak 1069 spectrum 1 weight 0.10000E+01 volume 0.16499E-02 ppm1 8.280 ppm2 8.683 CV 1
ASSI { 2073}
(( segid " " and resid 265 and name H ))
(( segid " " and resid 265 and name HB3 ))
2.900 1.000 1.000 peak 2073 spectrum 1 weight 0.10000E+01 volume 0.22178E-02 ppm1 7.750 ppm2 3.955 CV 1
OR { 2073}
(( segid " " and resid 265 and name H ))
(( segid " " and resid 265 and name HB2 ))
ASSI { 3106}
(( segid " " and resid 425 and name H ))
(( segid " " and resid 424 and name HG ))
4.700 2.800 1.300 peak 3106 spectrum 1 weight 0.10000E+01 volume 0.40622E-03 ppm1 7.759 ppm2 3.724 CV 1
ASSI { 2855}
(( segid " " and resid 318 and name H ))
(( segid " " and resid 317 and name HB3 ))
2.700 0.900 0.900 peak 2855 spectrum 1 weight 0.10000E+01 volume 0.84705E-03 ppm1 8.047 ppm2 1.161 CV 1
ASSI { 1317}
(( segid " " and resid 338 and name HD22))
(( segid " " and resid 338 and name HB2 ))
4.200 2.300 1.800 peak 1317 spectrum 1 weight 0.10000E+01 volume 0.14323E-02 ppm1 7.444 ppm2 2.826 CV 1
ASSI { 2701}
(( segid " " and resid 276 and name H ))
(( segid " " and resid 275 and name HB2 ))
2.900 1.100 1.100 peak 2701 spectrum 1 weight 0.10000E+01 volume 0.28415E-02 ppm1 6.947 ppm2 2.029 CV 1
ASSI { 1525}
(( segid " " and resid 380 and name H ))
(( segid " " and resid 379 and name HB2 ))
4.000 2.000 2.000 peak 1525 spectrum 1 weight 0.10000E+01 volume 0.43699E-03 ppm1 9.047 ppm2 1.958 CV 1
ASSI { 2310}
(( segid " " and resid 270 and name H ))
(( segid " " and resid 269 and name HB2 ))
3.700 1.700 1.700 peak 2310 spectrum 1 weight 0.10000E+01 volume 0.97027E-03 ppm1 8.535 ppm2 2.221 CV 1
ASSI { 1570}
(( segid " " and resid 317 and name H ))
(( segid " " and resid 317 and name HB3 ))
2.900 1.000 1.000 peak 1570 spectrum 1 weight 0.10000E+01 volume 0.16575E-02 ppm1 7.530 ppm2 1.165 CV 1
ASSI { 1632}
(( segid " " and resid 375 and name H ))
(( segid " " and resid 375 and name HB3 ))
2.700 0.900 0.900 peak 1632 spectrum 1 weight 0.10000E+01 volume 0.50997E-02 ppm1 8.483 ppm2 1.865 CV 1
OR { 1632}
(( segid " " and resid 375 and name H ))
(( segid " " and resid 375 and name HB2 ))
ASSI { 751}
(( segid " " and resid 371 and name H ))
(( segid " " and resid 319 and name HB3 ))
6.000 4.400 0.000 peak 751 spectrum 1 weight 0.10000E+01 volume 0.29840E-03 ppm1 7.539 ppm2 3.070 CV 1
ASSI { 1798}
(( segid " " and resid 407 and name H ))
(( segid " " and resid 407 and name HA ))
2.700 0.900 0.900 peak 1798 spectrum 1 weight 0.10000E+01 volume 0.17018E-02 ppm1 7.798 ppm2 4.315 CV 1
ASSI { 18}
(( segid " " and resid 351 and name HE21))
(( segid " " and resid 351 and name HG3 ))
2.500 0.800 0.800 peak 18 spectrum 1 weight 0.10000E+01 volume 0.48339E-02 ppm1 6.759 ppm2 2.115 CV 1
OR { 18}
(( segid " " and resid 351 and name HE21))
(( segid " " and resid 351 and name HB3 ))
OR { 18}
(( segid " " and resid 351 and name HE21))
(( segid " " and resid 351 and name HG2 ))
ASSI { 3080}
(( segid " " and resid 288 and name H ))
(( segid " " and resid 288 and name HA ))
2.800 1.000 1.000 peak 3080 spectrum 1 weight 0.10000E+01 volume 0.25913E-02 ppm1 7.477 ppm2 3.865 CV 1
ASSI { 1935}
(( segid " " and resid 423 and name H ))
(( segid " " and resid 422 and name HB2 ))
4.700 2.700 1.300 peak 1935 spectrum 1 weight 0.10000E+01 volume 0.75849E-03 ppm1 8.689 ppm2 2.417 CV 1
ASSI { 1411}
(( segid " " and resid 340 and name HE21))
(( segid " " and resid 340 and name HB2 ))
4.600 2.600 1.400 peak 1411 spectrum 1 weight 0.10000E+01 volume 0.54290E-03 ppm1 6.786 ppm2 1.934 CV 1
ASSI { 2248}
(( segid " " and resid 338 and name HD22))
(( segid " " and resid 339 and name H ))
4.000 2.000 2.000 peak 2248 spectrum 1 weight 0.10000E+01 volume 0.34653E-03 ppm1 7.453 ppm2 8.363 CV 1
ASSI { 1329}
(( segid " " and resid 332 and name H ))
(( segid " " and resid 335 and name H ))
4.700 2.700 1.300 peak 1329 spectrum 1 weight 0.10000E+01 volume 0.32343E-03 ppm1 7.434 ppm2 8.894 CV 1
ASSI { 1256}
(( segid " " and resid 354 and name HD22))
(( segid " " and resid 344 and name HG12))
3.600 1.600 1.600 peak 1256 spectrum 1 weight 0.10000E+01 volume 0.58140E-03 ppm1 6.452 ppm2 1.690 CV 1
ASSI { 1867}
(( segid " " and resid 320 and name HE1 ))
( segid " " and resid 373 and name HD1%)
3.900 1.900 1.900 peak 1867 spectrum 1 weight 0.10000E+01 volume 0.86630E-03 ppm1 10.126 ppm2 -0.191 CV 1
ASSI { 828}
(( segid " " and resid 369 and name H ))
(( segid " " and resid 371 and name HA ))
5.100 3.300 0.900 peak 828 spectrum 1 weight 0.10000E+01 volume 0.47359E-03 ppm1 7.757 ppm2 3.656 CV 1
ASSI { 1795}
(( segid " " and resid 387 and name H ))
( segid " " and resid 387 and name HG2%)
3.900 1.900 1.900 peak 1795 spectrum 1 weight 0.10000E+01 volume 0.24700E-02 ppm1 7.974 ppm2 1.114 CV 1
ASSI { 2178}
(( segid " " and resid 291 and name H ))
(( segid " " and resid 291 and name HB2 ))
2.700 0.900 0.900 peak 2178 spectrum 1 weight 0.10000E+01 volume 0.27587E-02 ppm1 7.364 ppm2 2.757 CV 1
ASSI { 2742}
(( segid " " and resid 293 and name H ))
(( segid " " and resid 294 and name H ))
4.300 2.300 1.700 peak 2742 spectrum 1 weight 0.10000E+01 volume 0.10761E-02 ppm1 7.005 ppm2 8.529 CV 1
ASSI { 1580}
(( segid " " and resid 230 and name H ))
( segid " " and resid 230 and name HG2%)
2.500 0.800 0.800 peak 1580 spectrum 1 weight 0.10000E+01 volume 0.39811E-02 ppm1 7.111 ppm2 0.958 CV 1
OR { 1580}
(( segid " " and resid 230 and name H ))
(( segid " " and resid 230 and name HG13))
ASSI { 1124}
(( segid " " and resid 353 and name H ))
(( segid " " and resid 353 and name HB2 ))
2.900 1.100 1.100 peak 1124 spectrum 1 weight 0.10000E+01 volume 0.15651E-02 ppm1 8.950 ppm2 3.988 CV 1
OR { 1124}
(( segid " " and resid 353 and name H ))
(( segid " " and resid 353 and name HB3 ))
ASSI { 743}
(( segid " " and resid 250 and name H ))
(( segid " " and resid 248 and name HB2 ))
3.000 3.000 3.000 peak 743 spectrum 1 weight 0.10000E+01 volume 0.49090E-03 ppm1 8.064 ppm2 2.531 CV 1
ASSI { 40}
(( segid " " and resid 393 and name H ))
(( segid " " and resid 394 and name HA ))
5.400 3.600 0.600 peak 40 spectrum 1 weight 0.10000E+01 volume 0.39659E-03 ppm1 8.264 ppm2 4.612 CV 1
OR { 40}
(( segid " " and resid 393 and name H ))
(( segid " " and resid 394 and name HB ))
ASSI { 2620}
(( segid " " and resid 388 and name H ))
(( segid " " and resid 382 and name HE1 ))
3.800 1.800 1.800 peak 2620 spectrum 1 weight 0.10000E+01 volume 0.61218E-03 ppm1 8.234 ppm2 9.605 CV 1
ASSI { 2113}
(( segid " " and resid 363 and name H ))
( segid " " and resid 359 and name HG1%)
2.800 2.800 3.200 peak 2113 spectrum 1 weight 0.10000E+01 volume 0.77390E-03 ppm1 7.268 ppm2 0.908 CV 1
ASSI { 8}
(( segid " " and resid 433 and name HE22))
(( segid " " and resid 429 and name HG ))
3.400 1.500 1.500 peak 8 spectrum 1 weight 0.10000E+01 volume 0.12918E-02 ppm1 6.709 ppm2 1.405 CV 1
OR { 8}
(( segid " " and resid 433 and name HE22))
(( segid " " and resid 429 and name HB2 ))
ASSI { 2812}
(( segid " " and resid 262 and name H ))
(( segid " " and resid 262 and name HA ))
3.600 1.600 1.600 peak 2812 spectrum 1 weight 0.10000E+01 volume 0.59871E-03 ppm1 7.891 ppm2 3.627 CV 1
ASSI { 615}
(( segid " " and resid 247 and name H ))
( segid " " and resid 190 and name HE% )
4.700 2.800 1.300 peak 615 spectrum 1 weight 0.10000E+01 volume 0.54096E-03 ppm1 8.434 ppm2 7.151 CV 1
ASSI { 2120}
(( segid " " and resid 325 and name H ))
(( segid " " and resid 325 and name HB3 ))
4.000 2.000 2.000 peak 2120 spectrum 1 weight 0.10000E+01 volume 0.44856E-03 ppm1 8.503 ppm2 1.399 CV 1
ASSI { 1342}
(( segid " " and resid 211 and name H ))
(( segid " " and resid 211 and name HA ))
3.200 1.300 1.300 peak 1342 spectrum 1 weight 0.10000E+01 volume 0.66224E-03 ppm1 7.468 ppm2 3.847 CV 1
ASSI { 3196}
(( segid " " and resid 433 and name HE21))
(( segid " " and resid 433 and name HB2 ))
3.800 1.800 1.800 peak 3196 spectrum 1 weight 0.10000E+01 volume 0.11455E-02 ppm1 6.976 ppm2 1.973 CV 1
ASSI { 1024}
(( segid " " and resid 374 and name H ))
(( segid " " and resid 374 and name HB3 ))
3.800 1.800 1.800 peak 1024 spectrum 1 weight 0.10000E+01 volume 0.15786E-02 ppm1 6.330 ppm2 1.795 CV 1
ASSI { 1777}
(( segid " " and resid 412 and name H ))
(( segid " " and resid 412 and name HB2 ))
2.800 1.000 1.000 peak 1777 spectrum 1 weight 0.10000E+01 volume 0.12128E-02 ppm1 8.447 ppm2 1.758 CV 1
ASSI { 2343}
(( segid " " and resid 367 and name H ))
(( segid " " and resid 367 and name HB3 ))
4.200 2.200 1.800 peak 2343 spectrum 1 weight 0.10000E+01 volume 0.83165E-03 ppm1 7.864 ppm2 0.028 CV 1
ASSI { 1739}
(( segid " " and resid 301 and name H ))
( segid " " and resid 300 and name HG2%)
2.600 0.900 0.900 peak 1739 spectrum 1 weight 0.10000E+01 volume 0.19848E-02 ppm1 8.074 ppm2 0.545 CV 1
ASSI { 2037}
(( segid " " and resid 314 and name HD21))
(( segid " " and resid 314 and name HD22))
2.200 0.600 0.600 peak 2037 spectrum 1 weight 0.10000E+01 volume 0.14034E-02 ppm1 7.378 ppm2 8.326 CV 1
ASSI { 2487}
(( segid " " and resid 222 and name H ))
(( segid " " and resid 223 and name H ))
2.700 0.900 0.900 peak 2487 spectrum 1 weight 0.10000E+01 volume 0.16248E-02 ppm1 7.249 ppm2 8.424 CV 1
ASSI { 2437}
(( segid " " and resid 435 and name H ))
(( segid " " and resid 432 and name HA ))
4.000 2.000 2.000 peak 2437 spectrum 1 weight 0.10000E+01 volume 0.37156E-03 ppm1 8.199 ppm2 3.615 CV 1
ASSI { 1449}
(( segid " " and resid 212 and name H ))
( segid " " and resid 212 and name HG1%)
3.100 1.200 1.200 peak 1449 spectrum 1 weight 0.10000E+01 volume 0.14804E-02 ppm1 9.090 ppm2 -0.328 CV 1
ASSI { 1011}
(( segid " " and resid 287 and name H ))
(( segid " " and resid 287 and name HB2 ))
2.700 0.900 0.900 peak 1011 spectrum 1 weight 0.10000E+01 volume 0.14130E-02 ppm1 8.014 ppm2 3.046 CV 1
ASSI { 2880}
(( segid " " and resid 291 and name H ))
(( segid " " and resid 292 and name HA3 ))
4.600 2.600 1.400 peak 2880 spectrum 1 weight 0.10000E+01 volume 0.12360E-02 ppm1 7.367 ppm2 4.201 CV 1
ASSI { 2972}
(( segid " " and resid 227 and name H ))
(( segid " " and resid 227 and name HA ))
2.900 1.000 1.000 peak 2972 spectrum 1 weight 0.10000E+01 volume 0.26548E-02 ppm1 7.129 ppm2 4.218 CV 1
ASSI { 2287}
(( segid " " and resid 346 and name H ))
(( segid " " and resid 346 and name HB3 ))
3.200 1.300 1.300 peak 2287 spectrum 1 weight 0.10000E+01 volume 0.10627E-02 ppm1 8.995 ppm2 1.495 CV 1
ASSI { 1610}
(( segid " " and resid 277 and name H ))
(( segid " " and resid 277 and name HB2 ))
3.200 1.300 1.300 peak 1610 spectrum 1 weight 0.10000E+01 volume 0.40428E-03 ppm1 8.687 ppm2 2.686 CV 1
ASSI { 1544}
(( segid " " and resid 236 and name H ))
(( segid " " and resid 236 and name HG12))
3.700 1.700 1.700 peak 1544 spectrum 1 weight 0.10000E+01 volume 0.19887E-02 ppm1 7.804 ppm2 1.103 CV 1
ASSI { 3003}
(( segid " " and resid 215 and name H ))
(( segid " " and resid 215 and name HG3 ))
3.600 1.600 1.600 peak 3003 spectrum 1 weight 0.10000E+01 volume 0.94334E-03 ppm1 8.890 ppm2 2.632 CV 1
ASSI { 164}
(( segid " " and resid 375 and name HE21))
(( segid " " and resid 222 and name HG2 ))
4.200 2.300 1.800 peak 164 spectrum 1 weight 0.10000E+01 volume 0.35615E-03 ppm1 6.676 ppm2 0.415 CV 1
ASSI { 2243}
(( segid " " and resid 369 and name H ))
( segid " " and resid 323 and name HG2%)
4.300 2.300 1.700 peak 2243 spectrum 1 weight 0.10000E+01 volume 0.34845E-03 ppm1 7.760 ppm2 0.430 CV 1
ASSI { 20}
(( segid " " and resid 423 and name H ))
(( segid " " and resid 424 and name HA ))
5.100 3.200 0.900 peak 20 spectrum 1 weight 0.10000E+01 volume 0.43125E-03 ppm1 8.688 ppm2 4.275 CV 1
ASSI { 1594}
(( segid " " and resid 338 and name H ))
(( segid " " and resid 337 and name HA ))
2.700 0.900 0.900 peak 1594 spectrum 1 weight 0.10000E+01 volume 0.19964E-02 ppm1 7.710 ppm2 4.997 CV 1
ASSI { 2341}
(( segid " " and resid 269 and name HE22))
(( segid " " and resid 269 and name HG3 ))
3.700 1.700 1.700 peak 2341 spectrum 1 weight 0.10000E+01 volume 0.27087E-02 ppm1 6.865 ppm2 2.505 CV 1
OR { 2341}
(( segid " " and resid 269 and name HE22))
(( segid " " and resid 269 and name HG2 ))
ASSI { 1218}
(( segid " " and resid 251 and name H ))
(( segid " " and resid 252 and name H ))
4.000 2.000 2.000 peak 1218 spectrum 1 weight 0.10000E+01 volume 0.10300E-02 ppm1 7.886 ppm2 8.425 CV 1
ASSI { 3152}
(( segid " " and resid 332 and name H ))
(( segid " " and resid 329 and name HA ))
3.500 1.500 1.500 peak 3152 spectrum 1 weight 0.10000E+01 volume 0.48706E-03 ppm1 7.437 ppm2 3.871 CV 1
ASSI { 3056}
(( segid " " and resid 238 and name H ))
(( segid " " and resid 238 and name HA ))
2.900 1.100 1.100 peak 3056 spectrum 1 weight 0.10000E+01 volume 0.16980E-02 ppm1 8.663 ppm2 4.149 CV 1
ASSI { 3023}
(( segid " " and resid 337 and name H ))
( segid " " and resid 230 and name HG2%)
4.600 2.600 1.400 peak 3023 spectrum 1 weight 0.10000E+01 volume 0.61218E-03 ppm1 7.309 ppm2 0.945 CV 1
ASSI { 1298}
(( segid " " and resid 212 and name H ))
( segid " " and resid 247 and name HD% )
4.700 2.800 1.300 peak 1298 spectrum 1 weight 0.10000E+01 volume 0.28107E-03 ppm1 9.089 ppm2 7.350 CV 1
ASSI { 2497}
(( segid " " and resid 320 and name HE1 ))
(( segid " " and resid 320 and name H ))
4.800 2.900 1.200 peak 2497 spectrum 1 weight 0.10000E+01 volume 0.98374E-03 ppm1 10.128 ppm2 8.418 CV 1
ASSI { 1344}
(( segid " " and resid 301 and name H ))
(( segid " " and resid 300 and name HB ))
3.000 1.100 1.100 peak 1344 spectrum 1 weight 0.10000E+01 volume 0.48706E-02 ppm1 8.077 ppm2 1.772 CV 1
ASSI { 2847}
(( segid " " and resid 254 and name HD22))
(( segid " " and resid 254 and name HA ))
4.300 2.300 1.700 peak 2847 spectrum 1 weight 0.10000E+01 volume 0.88943E-03 ppm1 6.861 ppm2 4.870 CV 1
ASSI { 878}
(( segid " " and resid 239 and name H ))
( segid " " and resid 258 and name HE% )
5.700 4.000 0.300 peak 878 spectrum 1 weight 0.10000E+01 volume 0.42931E-03 ppm1 7.099 ppm2 6.654 CV 1
ASSI { 221}
(( segid " " and resid 257 and name H ))
( segid " " and resid 219 and name HE% )
5.000 3.100 1.000 peak 221 spectrum 1 weight 0.10000E+01 volume 0.36578E-03 ppm1 7.432 ppm2 6.403 CV 1
ASSI { 2160}
(( segid " " and resid 291 and name H ))
(( segid " " and resid 293 and name H ))
4.000 2.000 2.000 peak 2160 spectrum 1 weight 0.10000E+01 volume 0.10954E-02 ppm1 7.358 ppm2 7.032 CV 1
ASSI { 2515}
(( segid " " and resid 366 and name H ))
(( segid " " and resid 366 and name HG3 ))
2.900 1.100 1.100 peak 2515 spectrum 1 weight 0.10000E+01 volume 0.27510E-02 ppm1 8.334 ppm2 2.272 CV 1
OR { 2515}
(( segid " " and resid 366 and name H ))
(( segid " " and resid 366 and name HG2 ))
ASSI { 1454}
(( segid " " and resid 246 and name H ))
( segid " " and resid 245 and name HB% )
2.900 1.000 1.000 peak 1454 spectrum 1 weight 0.10000E+01 volume 0.32285E-02 ppm1 7.446 ppm2 1.336 CV 1
ASSI { 2416}
(( segid " " and resid 248 and name H ))
(( segid " " and resid 247 and name HA ))
3.800 1.800 1.800 peak 2416 spectrum 1 weight 0.10000E+01 volume 0.74118E-03 ppm1 8.882 ppm2 4.141 CV 1
ASSI { 1239}
(( segid " " and resid 332 and name H ))
(( segid " " and resid 336 and name H ))
5.200 3.300 0.800 peak 1239 spectrum 1 weight 0.10000E+01 volume 0.46203E-03 ppm1 7.434 ppm2 9.121 CV 1
ASSI { 1423}
(( segid " " and resid 263 and name H ))
( segid " " and resid 262 and name HG2%)
3.700 1.700 1.700 peak 1423 spectrum 1 weight 0.10000E+01 volume 0.11666E-02 ppm1 7.124 ppm2 1.091 CV 1
ASSI { 123}
(( segid " " and resid 256 and name H ))
(( segid " " and resid 254 and name HB3 ))
4.600 2.600 1.400 peak 123 spectrum 1 weight 0.10000E+01 volume 0.51978E-03 ppm1 8.260 ppm2 2.964 CV 1
ASSI { 264}
(( segid " " and resid 218 and name H ))
(( segid " " and resid 217 and name HA ))
3.700 1.700 1.700 peak 264 spectrum 1 weight 0.10000E+01 volume 0.57368E-03 ppm1 7.974 ppm2 2.997 CV 1
ASSI { 1534}
(( segid " " and resid 407 and name H ))
( segid " " and resid 204 and name HD% )
4.900 3.000 1.100 peak 1534 spectrum 1 weight 0.10000E+01 volume 0.45624E-03 ppm1 7.793 ppm2 6.892 CV 1
ASSI { 2137}
(( segid " " and resid 334 and name H ))
(( segid " " and resid 332 and name H ))
4.100 2.100 1.900 peak 2137 spectrum 1 weight 0.10000E+01 volume 0.56984E-03 ppm1 8.131 ppm2 7.426 CV 1
ASSI { 2730}
(( segid " " and resid 196 and name H ))
(( segid " " and resid 199 and name H ))
4.600 2.600 1.400 peak 2730 spectrum 1 weight 0.10000E+01 volume 0.39850E-03 ppm1 7.176 ppm2 7.768 CV 1
ASSI { 2616}
(( segid " " and resid 227 and name H ))
(( segid " " and resid 227 and name HB2 ))
2.900 1.100 1.100 peak 2616 spectrum 1 weight 0.10000E+01 volume 0.21562E-02 ppm1 7.130 ppm2 3.144 CV 1
ASSI { 2868}
(( segid " " and resid 232 and name H ))
( segid " " and resid 230 and name HD1%)
4.900 3.000 1.100 peak 2868 spectrum 1 weight 0.10000E+01 volume 0.62953E-03 ppm1 8.790 ppm2 0.664 CV 1
ASSI { 358}
(( segid " " and resid 263 and name H ))
( segid " " and resid 219 and name HD% )
6.000 4.500 0.000 peak 358 spectrum 1 weight 0.10000E+01 volume 0.27915E-03 ppm1 7.117 ppm2 6.863 CV 1
ASSI { 1778}
(( segid " " and resid 358 and name H ))
( segid " " and resid 358 and name HD% )
4.300 2.300 1.700 peak 1778 spectrum 1 weight 0.10000E+01 volume 0.19733E-02 ppm1 8.560 ppm2 7.033 CV 1
ASSI { 2939}
(( segid " " and resid 331 and name H ))
(( segid " " and resid 331 and name HA ))
2.600 0.800 0.800 peak 2939 spectrum 1 weight 0.10000E+01 volume 0.19983E-02 ppm1 7.179 ppm2 4.551 CV 1
ASSI { 2125}
(( segid " " and resid 363 and name H ))
(( segid " " and resid 363 and name HA ))
2.700 0.900 0.900 peak 2125 spectrum 1 weight 0.10000E+01 volume 0.24604E-02 ppm1 7.266 ppm2 5.123 CV 1
ASSI { 2728}
(( segid " " and resid 371 and name H ))
(( segid " " and resid 370 and name HA ))
3.000 1.100 1.100 peak 2728 spectrum 1 weight 0.10000E+01 volume 0.25219E-02 ppm1 7.540 ppm2 4.723 CV 1
ASSI { 2011}
(( segid " " and resid 341 and name H ))
(( segid " " and resid 340 and name HB2 ))
3.500 1.600 1.600 peak 2011 spectrum 1 weight 0.10000E+01 volume 0.29108E-02 ppm1 8.540 ppm2 1.967 CV 1
ASSI { 1750}
(( segid " " and resid 256 and name H ))
(( segid " " and resid 255 and name HB3 ))
4.300 2.400 1.700 peak 1750 spectrum 1 weight 0.10000E+01 volume 0.49862E-03 ppm1 8.257 ppm2 1.074 CV 1
ASSI { 2756}
(( segid " " and resid 369 and name H ))
(( segid " " and resid 369 and name HA3 ))
2.600 0.800 0.800 peak 2756 spectrum 1 weight 0.10000E+01 volume 0.54463E-02 ppm1 7.755 ppm2 3.996 CV 1
ASSI { 2628}
(( segid " " and resid 274 and name H ))
(( segid " " and resid 274 and name HB2 ))
2.600 0.800 0.800 peak 2628 spectrum 1 weight 0.10000E+01 volume 0.27183E-02 ppm1 7.027 ppm2 1.151 CV 1
ASSI { 2791}
(( segid " " and resid 387 and name H ))
(( segid " " and resid 382 and name HZ2 ))
4.500 2.500 1.500 peak 2791 spectrum 1 weight 0.10000E+01 volume 0.23487E-03 ppm1 7.971 ppm2 7.462 CV 1
ASSI { 1389}
(( segid " " and resid 327 and name H ))
(( segid " " and resid 328 and name H ))
2.400 0.700 0.700 peak 1389 spectrum 1 weight 0.10000E+01 volume 0.29898E-02 ppm1 7.612 ppm2 7.210 CV 1
ASSI { 1304}
(( segid " " and resid 314 and name H ))
(( segid " " and resid 314 and name HA ))
2.800 1.000 1.000 peak 1304 spectrum 1 weight 0.10000E+01 volume 0.19367E-02 ppm1 7.342 ppm2 3.854 CV 1
ASSI { 3147}
(( segid " " and resid 372 and name H ))
(( segid " " and resid 371 and name H ))
4.400 2.400 1.600 peak 3147 spectrum 1 weight 0.10000E+01 volume 0.92215E-03 ppm1 7.923 ppm2 7.534 CV 1
ASSI { 1134}
(( segid " " and resid 370 and name H ))
(( segid " " and resid 370 and name HA ))
2.800 1.000 1.000 peak 1134 spectrum 1 weight 0.10000E+01 volume 0.31958E-02 ppm1 8.418 ppm2 4.717 CV 1
ASSI { 2177}
(( segid " " and resid 293 and name H ))
(( segid " " and resid 293 and name HG2 ))
2.200 0.600 0.600 peak 2177 spectrum 1 weight 0.10000E+01 volume 0.42949E-02 ppm1 7.004 ppm2 1.552 CV 1
ASSI { 2981}
(( segid " " and resid 231 and name H ))
(( segid " " and resid 230 and name HA ))
2.700 0.900 0.900 peak 2981 spectrum 1 weight 0.10000E+01 volume 0.94718E-03 ppm1 8.441 ppm2 3.898 CV 1
ASSI { 235}
(( segid " " and resid 261 and name H ))
(( segid " " and resid 260 and name HA ))
3.800 1.800 1.800 peak 235 spectrum 1 weight 0.10000E+01 volume 0.48515E-03 ppm1 8.907 ppm2 4.339 CV 1
ASSI { 2429}
(( segid " " and resid 239 and name H ))
(( segid " " and resid 239 and name HE2 ))
4.400 2.400 1.600 peak 2429 spectrum 1 weight 0.10000E+01 volume 0.49284E-03 ppm1 7.099 ppm2 2.948 CV 1
OR { 2429}
(( segid " " and resid 239 and name H ))
(( segid " " and resid 239 and name HE3 ))
ASSI { 2579}
(( segid " " and resid 281 and name H ))
(( segid " " and resid 281 and name HB2 ))
2.800 1.000 1.000 peak 2579 spectrum 1 weight 0.10000E+01 volume 0.24526E-02 ppm1 9.176 ppm2 1.759 CV 1
ASSI { 1862}
(( segid " " and resid 354 and name HD21))
(( segid " " and resid 344 and name HG12))
3.800 1.900 1.900 peak 1862 spectrum 1 weight 0.10000E+01 volume 0.69690E-03 ppm1 7.471 ppm2 1.694 CV 1
ASSI { 838}
(( segid " " and resid 248 and name H ))
(( segid " " and resid 244 and name HA ))
4.200 2.200 1.800 peak 838 spectrum 1 weight 0.10000E+01 volume 0.30610E-03 ppm1 8.872 ppm2 3.299 CV 1
ASSI { 29}
(( segid " " and resid 304 and name HE21))
(( segid " " and resid 304 and name HG3 ))
2.100 0.500 0.500 peak 29 spectrum 1 weight 0.10000E+01 volume 0.51882E-02 ppm1 6.656 ppm2 2.291 CV 1
OR { 29}
(( segid " " and resid 304 and name HE21))
(( segid " " and resid 304 and name HB2 ))
ASSI { 2129}
(( segid " " and resid 288 and name H ))
(( segid " " and resid 290 and name H ))
4.500 2.600 1.500 peak 2129 spectrum 1 weight 0.10000E+01 volume 0.53902E-03 ppm1 7.479 ppm2 7.813 CV 1
ASSI { 1462}
(( segid " " and resid 410 and name HD22))
(( segid " " and resid 407 and name HB2 ))
5.800 4.100 0.200 peak 1462 spectrum 1 weight 0.10000E+01 volume 0.32728E-03 ppm1 7.494 ppm2 3.250 CV 1
ASSI { 3173}
(( segid " " and resid 270 and name H ))
(( segid " " and resid 269 and name HG3 ))
4.700 2.700 1.300 peak 3173 spectrum 1 weight 0.10000E+01 volume 0.51787E-03 ppm1 8.541 ppm2 2.461 CV 1
ASSI { 754}
(( segid " " and resid 410 and name H ))
( segid " " and resid 432 and name HG2%)
4.900 3.000 1.100 peak 754 spectrum 1 weight 0.10000E+01 volume 0.64299E-03 ppm1 7.902 ppm2 1.087 CV 1
OR { 754}
(( segid " " and resid 410 and name H ))
( segid " " and resid 432 and name HG1%)
ASSI { 2673}
(( segid " " and resid 287 and name H ))
(( segid " " and resid 287 and name HB3 ))
3.900 1.900 1.900 peak 2673 spectrum 1 weight 0.10000E+01 volume 0.10146E-02 ppm1 8.019 ppm2 2.454 CV 1
ASSI { 1506}
(( segid " " and resid 284 and name H ))
(( segid " " and resid 285 and name HD2 ))
2.500 0.800 0.800 peak 1506 spectrum 1 weight 0.10000E+01 volume 0.15209E-02 ppm1 8.115 ppm2 3.572 CV 1
ASSI { 2191}
(( segid " " and resid 417 and name HE21))
(( segid " " and resid 417 and name HB2 ))
3.600 1.600 1.600 peak 2191 spectrum 1 weight 0.10000E+01 volume 0.18327E-02 ppm1 7.362 ppm2 2.054 CV 1
OR { 2191}
(( segid " " and resid 417 and name HE21))
(( segid " " and resid 417 and name HB3 ))
ASSI { 218}
(( segid " " and resid 250 and name H ))
(( segid " " and resid 248 and name HA ))
4.300 2.300 1.700 peak 218 spectrum 1 weight 0.10000E+01 volume 0.39659E-03 ppm1 8.052 ppm2 4.884 CV 1
ASSI { 1693}
(( segid " " and resid 263 and name H ))
( segid " " and resid 263 and name HG1%)
2.700 0.900 0.900 peak 1693 spectrum 1 weight 0.10000E+01 volume 0.24314E-02 ppm1 7.124 ppm2 0.077 CV 1
ASSI { 1769}
(( segid " " and resid 301 and name HE21))
(( segid " " and resid 301 and name HG2 ))
2.200 0.600 0.600 peak 1769 spectrum 1 weight 0.10000E+01 volume 0.36172E-02 ppm1 6.702 ppm2 2.495 CV 1
ASSI { 2380}
(( segid " " and resid 438 and name H ))
(( segid " " and resid 437 and name HB ))
2.700 0.900 0.900 peak 2380 spectrum 1 weight 0.10000E+01 volume 0.18116E-02 ppm1 7.571 ppm2 4.233 CV 1
ASSI { 2746}
(( segid " " and resid 396 and name H ))
( segid " " and resid 396 and name HB% )
2.400 0.700 0.700 peak 2746 spectrum 1 weight 0.10000E+01 volume 0.79625E-02 ppm1 8.690 ppm2 1.355 CV 1
ASSI { 608}
(( segid " " and resid 375 and name HE21))
( segid " " and resid 376 and name HG2%)
4.300 2.400 1.700 peak 608 spectrum 1 weight 0.10000E+01 volume 0.55253E-03 ppm1 6.674 ppm2 0.952 CV 1
OR { 608}
(( segid " " and resid 375 and name HE21))
( segid " " and resid 376 and name HG1%)
ASSI { 2911}
(( segid " " and resid 253 and name H ))
(( segid " " and resid 254 and name H ))
4.200 2.200 1.800 peak 2911 spectrum 1 weight 0.10000E+01 volume 0.75465E-03 ppm1 8.259 ppm2 8.692 CV 1
ASSI { 2344}
(( segid " " and resid 282 and name H ))
(( segid " " and resid 281 and name H ))
2.400 0.700 0.700 peak 2344 spectrum 1 weight 0.10000E+01 volume 0.18847E-02 ppm1 8.701 ppm2 9.177 CV 1
ASSI { 1142}
(( segid " " and resid 365 and name HE22))
( segid " " and resid 364 and name HG1%)
3.600 1.600 1.600 peak 1142 spectrum 1 weight 0.10000E+01 volume 0.10511E-02 ppm1 7.587 ppm2 1.073 CV 1
ASSI { 3004}
(( segid " " and resid 254 and name HD22))
(( segid " " and resid 254 and name HB2 ))
3.200 1.300 1.300 peak 3004 spectrum 1 weight 0.10000E+01 volume 0.40794E-02 ppm1 6.859 ppm2 2.624 CV 1
ASSI { 475}
(( segid " " and resid 248 and name H ))
(( segid " " and resid 249 and name HG2 ))
4.700 2.800 1.300 peak 475 spectrum 1 weight 0.10000E+01 volume 0.43893E-03 ppm1 8.877 ppm2 1.520 CV 1
ASSI { 1819}
(( segid " " and resid 198 and name H ))
( segid " " and resid 197 and name HB% )
3.000 1.100 1.100 peak 1819 spectrum 1 weight 0.10000E+01 volume 0.14670E-02 ppm1 8.612 ppm2 1.460 CV 1
ASSI { 3127}
(( segid " " and resid 194 and name H ))
(( segid " " and resid 193 and name HA ))
2.700 0.900 0.900 peak 3127 spectrum 1 weight 0.10000E+01 volume 0.12494E-02 ppm1 9.118 ppm2 4.120 CV 1
ASSI { 2052}
(( segid " " and resid 445 and name H ))
( segid " " and resid 446 and name HB% )
4.900 3.000 1.100 peak 2052 spectrum 1 weight 0.10000E+01 volume 0.92021E-03 ppm1 7.905 ppm2 1.270 CV 1
ASSI { 1066}
(( segid " " and resid 393 and name H ))
(( segid " " and resid 392 and name HD3 ))
3.300 3.300 2.700 peak 1066 spectrum 1 weight 0.10000E+01 volume 0.27144E-03 ppm1 8.271 ppm2 3.573 CV 1
ASSI { 1929}
(( segid " " and resid 277 and name H ))
(( segid " " and resid 276 and name HG3 ))
4.200 2.200 1.800 peak 1929 spectrum 1 weight 0.10000E+01 volume 0.37540E-03 ppm1 8.688 ppm2 2.215 CV 1
ASSI { 3097}
(( segid " " and resid 284 and name H ))
( segid " " and resid 283 and name HD1%)
4.700 2.800 1.300 peak 3097 spectrum 1 weight 0.10000E+01 volume 0.58909E-03 ppm1 8.117 ppm2 0.720 CV 1
ASSI { 3022}
(( segid " " and resid 442 and name H ))
(( segid " " and resid 439 and name HA ))
3.100 1.200 1.200 peak 3022 spectrum 1 weight 0.10000E+01 volume 0.14997E-02 ppm1 7.555 ppm2 3.800 CV 1
ASSI { 1139}
(( segid " " and resid 209 and name H ))
( segid " " and resid 209 and name HD1%)
5.200 3.400 0.800 peak 1139 spectrum 1 weight 0.10000E+01 volume 0.40237E-03 ppm1 7.836 ppm2 0.186 CV 1
ASSI { 1757}
(( segid " " and resid 423 and name H ))
(( segid " " and resid 423 and name HA ))
3.100 1.200 1.200 peak 1757 spectrum 1 weight 0.10000E+01 volume 0.13880E-02 ppm1 8.689 ppm2 4.022 CV 1
ASSI { 1383}
(( segid " " and resid 284 and name H ))
(( segid " " and resid 285 and name HD3 ))
3.200 1.300 1.300 peak 1383 spectrum 1 weight 0.10000E+01 volume 0.16017E-02 ppm1 8.115 ppm2 3.694 CV 1
ASSI { 3027}
(( segid " " and resid 197 and name H ))
(( segid " " and resid 199 and name H ))
4.100 2.100 1.900 peak 3027 spectrum 1 weight 0.10000E+01 volume 0.59871E-03 ppm1 8.047 ppm2 7.755 CV 1
ASSI { 2295}
(( segid " " and resid 298 and name H ))
(( segid " " and resid 297 and name H ))
2.600 0.800 0.800 peak 2295 spectrum 1 weight 0.10000E+01 volume 0.19251E-02 ppm1 7.337 ppm2 8.072 CV 1
ASSI { 3044}
(( segid " " and resid 264 and name H ))
( segid " " and resid 263 and name HG2%)
2.800 1.000 1.000 peak 3044 spectrum 1 weight 0.10000E+01 volume 0.17461E-02 ppm1 8.510 ppm2 0.813 CV 1
ASSI { 1478}
(( segid " " and resid 213 and name H ))
(( segid " " and resid 213 and name HB2 ))
3.300 1.400 1.400 peak 1478 spectrum 1 weight 0.10000E+01 volume 0.40812E-03 ppm1 5.891 ppm2 2.290 CV 1
ASSI { 559}
(( segid " " and resid 219 and name H ))
(( segid " " and resid 255 and name HB2 ))
4.400 2.500 1.600 peak 559 spectrum 1 weight 0.10000E+01 volume 0.41390E-03 ppm1 7.703 ppm2 1.652 CV 1
OR { 559}
(( segid " " and resid 219 and name H ))
(( segid " " and resid 255 and name HG ))
ASSI { 1512}
(( segid " " and resid 360 and name H ))
(( segid " " and resid 357 and name HA ))
3.900 1.900 1.900 peak 1512 spectrum 1 weight 0.10000E+01 volume 0.64299E-03 ppm1 7.274 ppm2 3.858 CV 1
ASSI { 1655}
(( segid " " and resid 332 and name H ))
(( segid " " and resid 332 and name HA ))
2.600 0.800 0.800 peak 1655 spectrum 1 weight 0.10000E+01 volume 0.22120E-02 ppm1 7.439 ppm2 4.168 CV 1
ASSI { 3145}
(( segid " " and resid 391 and name H ))
(( segid " " and resid 392 and name HD2 ))
4.700 2.800 1.300 peak 3145 spectrum 1 weight 0.10000E+01 volume 0.82396E-03 ppm1 8.205 ppm2 3.169 CV 1
ASSI { 2577}
(( segid " " and resid 438 and name H ))
(( segid " " and resid 438 and name HA ))
2.900 1.100 1.100 peak 2577 spectrum 1 weight 0.10000E+01 volume 0.23198E-02 ppm1 7.570 ppm2 4.094 CV 1
ASSI { 1392}
(( segid " " and resid 433 and name HE21))
(( segid " " and resid 429 and name HB3 ))
4.000 2.000 2.000 peak 1392 spectrum 1 weight 0.10000E+01 volume 0.42162E-03 ppm1 6.968 ppm2 1.798 CV 1
ASSI { 1661}
(( segid " " and resid 227 and name H ))
(( segid " " and resid 224 and name HA2 ))
4.000 2.000 2.000 peak 1661 spectrum 1 weight 0.10000E+01 volume 0.43125E-03 ppm1 7.131 ppm2 4.560 CV 1
ASSI { 2203}
(( segid " " and resid 377 and name H ))
(( segid " " and resid 377 and name HA ))
3.200 1.200 1.200 peak 2203 spectrum 1 weight 0.10000E+01 volume 0.11840E-02 ppm1 8.238 ppm2 4.688 CV 1
ASSI { 2960}
(( segid " " and resid 398 and name H ))
(( segid " " and resid 398 and name HA ))
3.500 1.600 1.600 peak 2960 spectrum 1 weight 0.10000E+01 volume 0.51978E-03 ppm1 8.687 ppm2 3.437 CV 1
ASSI { 1173}
(( segid " " and resid 337 and name H ))
(( segid " " and resid 337 and name HB3 ))
4.100 2.100 1.900 peak 1173 spectrum 1 weight 0.10000E+01 volume 0.90868E-03 ppm1 7.310 ppm2 1.529 CV 1
ASSI { 1529}
(( segid " " and resid 280 and name H ))
( segid " " and resid 280 and name HG2%)
2.900 1.100 1.100 peak 1529 spectrum 1 weight 0.10000E+01 volume 0.21023E-02 ppm1 7.656 ppm2 1.138 CV 1
ASSI { 1726}
(( segid " " and resid 349 and name H ))
(( segid " " and resid 348 and name HA ))
3.400 1.400 1.400 peak 1726 spectrum 1 weight 0.10000E+01 volume 0.12032E-02 ppm1 7.113 ppm2 4.545 CV 1
ASSI { 789}
(( segid " " and resid 418 and name H ))
(( segid " " and resid 418 and name HA3 ))
2.600 0.900 0.900 peak 789 spectrum 1 weight 0.10000E+01 volume 0.45201E-02 ppm1 8.185 ppm2 3.939 CV 1
OR { 789}
(( segid " " and resid 418 and name H ))
(( segid " " and resid 418 and name HA2 ))
ASSI { 1732}
(( segid " " and resid 424 and name H ))
(( segid " " and resid 424 and name HA ))
2.700 0.900 0.900 peak 1732 spectrum 1 weight 0.10000E+01 volume 0.33305E-02 ppm1 8.281 ppm2 4.251 CV 1
ASSI { 2524}
(( segid " " and resid 187 and name H ))
(( segid " " and resid 187 and name HB2 ))
2.800 1.000 1.000 peak 2524 spectrum 1 weight 0.10000E+01 volume 0.68671E-02 ppm1 8.524 ppm2 1.702 CV 1
OR { 2524}
(( segid " " and resid 187 and name H ))
(( segid " " and resid 187 and name HB3 ))
ASSI { 15}
(( segid " " and resid 353 and name H ))
( segid " " and resid 352 and name HD1%)
5.500 3.800 0.500 peak 15 spectrum 1 weight 0.10000E+01 volume 0.74118E-03 ppm1 8.948 ppm2 0.631 CV 1
ASSI { 1036}
(( segid " " and resid 327 and name H ))
(( segid " " and resid 326 and name HB2 ))
4.100 2.100 1.900 peak 1036 spectrum 1 weight 0.10000E+01 volume 0.14150E-02 ppm1 7.613 ppm2 2.858 CV 1
ASSI { 936}
(( segid " " and resid 216 and name H ))
( segid " " and resid 247 and name HE% )
5.800 4.200 0.200 peak 936 spectrum 1 weight 0.10000E+01 volume 0.23294E-03 ppm1 7.641 ppm2 6.476 CV 1
ASSI { 1917}
(( segid " " and resid 318 and name H ))
(( segid " " and resid 315 and name H ))
4.500 2.500 1.500 peak 1917 spectrum 1 weight 0.10000E+01 volume 0.29840E-03 ppm1 8.044 ppm2 8.332 CV 1
ASSI { 1468}
(( segid " " and resid 346 and name H ))
(( segid " " and resid 345 and name HB ))
3.700 1.700 1.700 peak 1468 spectrum 1 weight 0.10000E+01 volume 0.14496E-02 ppm1 8.993 ppm2 2.140 CV 1
ASSI { 1107}
(( segid " " and resid 305 and name H ))
(( segid " " and resid 305 and name HD2 ))
4.500 2.500 1.500 peak 1107 spectrum 1 weight 0.10000E+01 volume 0.94718E-03 ppm1 7.505 ppm2 3.139 CV 1
ASSI { 3072}
(( segid " " and resid 357 and name H ))
( segid " " and resid 356 and name HG2%)
4.200 2.200 1.800 peak 3072 spectrum 1 weight 0.10000E+01 volume 0.11705E-02 ppm1 8.144 ppm2 0.384 CV 1
ASSI { 1737}
(( segid " " and resid 318 and name H ))
(( segid " " and resid 318 and name HG12))
4.600 2.600 1.400 peak 1737 spectrum 1 weight 0.10000E+01 volume 0.11878E-02 ppm1 8.048 ppm2 0.996 CV 1
ASSI { 2682}
(( segid " " and resid 370 and name H ))
(( segid " " and resid 370 and name HB2 ))
2.800 1.000 1.000 peak 2682 spectrum 1 weight 0.10000E+01 volume 0.43026E-02 ppm1 8.417 ppm2 2.769 CV 1
OR { 2682}
(( segid " " and resid 370 and name H ))
(( segid " " and resid 370 and name HB3 ))
ASSI { 2071}
(( segid " " and resid 327 and name H ))
(( segid " " and resid 327 and name HB2 ))
2.800 1.000 1.000 peak 2071 spectrum 1 weight 0.10000E+01 volume 0.21542E-02 ppm1 7.613 ppm2 3.139 CV 1
OR { 2071}
(( segid " " and resid 327 and name H ))
(( segid " " and resid 327 and name HB3 ))
ASSI { 1835}
(( segid " " and resid 420 and name H ))
(( segid " " and resid 419 and name HA2 ))
2.800 1.000 1.000 peak 1835 spectrum 1 weight 0.10000E+01 volume 0.40756E-02 ppm1 7.494 ppm2 3.792 CV 1
ASSI { 1385}
(( segid " " and resid 287 and name H ))
( segid " " and resid 287 and name HD% )
2.900 1.100 1.100 peak 1385 spectrum 1 weight 0.10000E+01 volume 0.15651E-02 ppm1 8.017 ppm2 6.347 CV 1
ASSI { 1915}
(( segid " " and resid 387 and name H ))
(( segid " " and resid 385 and name HB3 ))
3.000 3.000 3.000 peak 1915 spectrum 1 weight 0.10000E+01 volume 0.48900E-03 ppm1 7.980 ppm2 2.817 CV 1
ASSI { 2733}
(( segid " " and resid 374 and name H ))
(( segid " " and resid 373 and name HA ))
2.400 0.700 0.700 peak 2733 spectrum 1 weight 0.10000E+01 volume 0.20368E-02 ppm1 6.330 ppm2 2.346 CV 1
ASSI { 1905}
(( segid " " and resid 356 and name H ))
( segid " " and resid 360 and name HD% )
5.300 3.500 0.700 peak 1905 spectrum 1 weight 0.10000E+01 volume 0.61028E-03 ppm1 7.364 ppm2 7.061 CV 1
OR { 1905}
(( segid " " and resid 356 and name H ))
( segid " " and resid 360 and name HE% )
ASSI { 941}
(( segid " " and resid 218 and name H ))
(( segid " " and resid 219 and name HB2 ))
5.500 3.700 0.500 peak 941 spectrum 1 weight 0.10000E+01 volume 0.32343E-03 ppm1 7.974 ppm2 3.162 CV 1
OR { 941}
(( segid " " and resid 218 and name H ))
(( segid " " and resid 219 and name HB3 ))
ASSI { 1058}
(( segid " " and resid 391 and name H ))
(( segid " " and resid 391 and name HG ))
2.200 0.600 0.600 peak 1058 spectrum 1 weight 0.10000E+01 volume 0.28358E-02 ppm1 8.203 ppm2 1.666 CV 1
ASSI { 1519}
(( segid " " and resid 427 and name H ))
(( segid " " and resid 430 and name HE1 ))
5.800 4.200 0.200 peak 1519 spectrum 1 weight 0.10000E+01 volume 0.22139E-03 ppm1 8.054 ppm2 10.048 CV 1
ASSI { 2141}
(( segid " " and resid 194 and name H ))
( segid " " and resid 194 and name HD1%)
4.400 2.400 1.600 peak 2141 spectrum 1 weight 0.10000E+01 volume 0.14015E-02 ppm1 9.117 ppm2 0.716 CV 1
ASSI { 1734}
(( segid " " and resid 225 and name H ))
( segid " " and resid 220 and name HG2%)
4.300 2.300 1.700 peak 1734 spectrum 1 weight 0.10000E+01 volume 0.63531E-03 ppm1 7.794 ppm2 1.128 CV 1
OR { 1734}
(( segid " " and resid 225 and name H ))
( segid " " and resid 220 and name HG1%)
ASSI { 1326}
(( segid " " and resid 187 and name H ))
(( segid " " and resid 186 and name H ))
3.400 1.500 1.500 peak 1326 spectrum 1 weight 0.10000E+01 volume 0.30071E-02 ppm1 8.526 ppm2 8.050 CV 1
ASSI { 1590}
(( segid " " and resid 359 and name H ))
(( segid " " and resid 359 and name HB ))
2.600 0.800 0.800 peak 1590 spectrum 1 weight 0.10000E+01 volume 0.31207E-02 ppm1 7.197 ppm2 1.601 CV 1
ASSI { 474}
(( segid " " and resid 314 and name HD21))
(( segid " " and resid 314 and name HB2 ))
3.800 1.800 1.800 peak 474 spectrum 1 weight 0.10000E+01 volume 0.88171E-03 ppm1 7.383 ppm2 2.836 CV 1
ASSI { 570}
(( segid " " and resid 360 and name H ))
( segid " " and resid 303 and name HE% )
4.400 2.400 1.600 peak 570 spectrum 1 weight 0.10000E+01 volume 0.58524E-03 ppm1 7.275 ppm2 6.798 CV 1
ASSI { 2852}
(( segid " " and resid 354 and name HD21))
(( segid " " and resid 354 and name H ))
5.000 3.100 1.000 peak 2852 spectrum 1 weight 0.10000E+01 volume 0.42737E-03 ppm1 7.471 ppm2 8.928 CV 1
ASSI { 1253}
(( segid " " and resid 264 and name H ))
( segid " " and resid 264 and name HB% )
2.500 0.800 0.800 peak 1253 spectrum 1 weight 0.10000E+01 volume 0.40985E-02 ppm1 8.515 ppm2 0.957 CV 1
ASSI { 1609}
(( segid " " and resid 278 and name H ))
(( segid " " and resid 278 and name HG ))
3.000 1.100 1.100 peak 1609 spectrum 1 weight 0.10000E+01 volume 0.11146E-02 ppm1 10.076 ppm2 1.738 CV 1
ASSI { 1184}
(( segid " " and resid 213 and name H ))
( segid " " and resid 213 and name HD% )
5.200 3.300 0.800 peak 1184 spectrum 1 weight 0.10000E+01 volume 0.46203E-03 ppm1 5.888 ppm2 6.695 CV 1
ASSI { 1742}
(( segid " " and resid 219 and name H ))
(( segid " " and resid 219 and name HB3 ))
2.700 0.900 0.900 peak 1742 spectrum 1 weight 0.10000E+01 volume 0.20349E-02 ppm1 7.701 ppm2 3.166 CV 1
OR { 1742}
(( segid " " and resid 219 and name H ))
(( segid " " and resid 219 and name HB2 ))
ASSI { 2147}
(( segid " " and resid 333 and name H ))
(( segid " " and resid 336 and name H ))
4.800 2.900 1.200 peak 2147 spectrum 1 weight 0.10000E+01 volume 0.36000E-03 ppm1 8.640 ppm2 9.137 CV 1
ASSI { 893}
(( segid " " and resid 236 and name H ))
(( segid " " and resid 239 and name HG2 ))
4.800 2.900 1.200 peak 893 spectrum 1 weight 0.10000E+01 volume 0.33305E-03 ppm1 7.800 ppm2 1.434 CV 1
ASSI { 1824}
(( segid " " and resid 309 and name H ))
(( segid " " and resid 309 and name HA ))
2.700 0.900 0.900 peak 1824 spectrum 1 weight 0.10000E+01 volume 0.37558E-02 ppm1 7.491 ppm2 4.191 CV 1
ASSI { 105}
(( segid " " and resid 230 and name H ))
(( segid " " and resid 227 and name HB2 ))
5.300 3.600 0.700 peak 105 spectrum 1 weight 0.10000E+01 volume 0.62953E-03 ppm1 7.109 ppm2 3.153 CV 1
ASSI { 1649}
(( segid " " and resid 286 and name H ))
(( segid " " and resid 283 and name HA ))
3.400 1.400 1.400 peak 1649 spectrum 1 weight 0.10000E+01 volume 0.82012E-03 ppm1 7.448 ppm2 4.515 CV 1
ASSI { 1967}
(( segid " " and resid 284 and name H ))
( segid " " and resid 279 and name HD2%)
4.800 2.900 1.200 peak 1967 spectrum 1 weight 0.10000E+01 volume 0.71809E-03 ppm1 8.115 ppm2 0.386 CV 1
ASSI { 1783}
(( segid " " and resid 381 and name H ))
(( segid " " and resid 381 and name HA ))
3.700 1.800 1.800 peak 1783 spectrum 1 weight 0.10000E+01 volume 0.56793E-03 ppm1 8.204 ppm2 4.632 CV 1
ASSI { 2345}
(( segid " " and resid 338 and name HD21))
(( segid " " and resid 341 and name H ))
5.500 3.800 0.500 peak 2345 spectrum 1 weight 0.10000E+01 volume 0.21754E-03 ppm1 6.618 ppm2 8.529 CV 1
ASSI { 2776}
(( segid " " and resid 356 and name H ))
(( segid " " and resid 355 and name HB2 ))
3.100 1.200 1.200 peak 2776 spectrum 1 weight 0.10000E+01 volume 0.17615E-02 ppm1 7.365 ppm2 1.815 CV 1
OR { 2776}
(( segid " " and resid 356 and name H ))
(( segid " " and resid 355 and name HB3 ))
ASSI { 2472}
(( segid " " and resid 185 and name HD22))
(( segid " " and resid 186 and name H ))
4.500 2.600 1.500 peak 2472 spectrum 1 weight 0.10000E+01 volume 0.33498E-03 ppm1 7.564 ppm2 8.079 CV 1
ASSI { 2601}
(( segid " " and resid 308 and name H ))
(( segid " " and resid 307 and name HA ))
2.900 1.100 1.100 peak 2601 spectrum 1 weight 0.10000E+01 volume 0.12321E-02 ppm1 7.099 ppm2 4.161 CV 1
ASSI { 1122}
(( segid " " and resid 344 and name H ))
( segid " " and resid 344 and name HD1%)
3.600 1.600 1.600 peak 1122 spectrum 1 weight 0.10000E+01 volume 0.41700E-02 ppm1 7.704 ppm2 0.876 CV 1
OR { 1122}
(( segid " " and resid 344 and name H ))
( segid " " and resid 344 and name HG2%)
ASSI { 2999}
(( segid " " and resid 261 and name HD21))
(( segid " " and resid 261 and name HB3 ))
3.200 1.300 1.300 peak 2999 spectrum 1 weight 0.10000E+01 volume 0.13072E-02 ppm1 7.524 ppm2 3.055 CV 1
ASSI { 2402}
(( segid " " and resid 433 and name HE22))
(( segid " " and resid 429 and name HB3 ))
4.000 2.000 2.000 peak 2402 spectrum 1 weight 0.10000E+01 volume 0.34268E-03 ppm1 6.711 ppm2 1.809 CV 1
ASSI { 2566}
(( segid " " and resid 395 and name HE22))
(( segid " " and resid 395 and name HG2 ))
3.300 1.400 1.400 peak 2566 spectrum 1 weight 0.10000E+01 volume 0.41334E-02 ppm1 6.980 ppm2 2.332 CV 1
ASSI { 2611}
(( segid " " and resid 345 and name H ))
(( segid " " and resid 345 and name HB ))
3.400 1.500 1.500 peak 2611 spectrum 1 weight 0.10000E+01 volume 0.24276E-02 ppm1 6.994 ppm2 2.145 CV 1
ASSI { 2890}
(( segid " " and resid 238 and name H ))
(( segid " " and resid 237 and name HB3 ))
3.300 1.400 1.400 peak 2890 spectrum 1 weight 0.10000E+01 volume 0.12552E-02 ppm1 8.663 ppm2 1.801 CV 1
ASSI { 1642}
(( segid " " and resid 291 and name H ))
( segid " " and resid 306 and name HD2%)
5.200 3.300 0.800 peak 1642 spectrum 1 weight 0.10000E+01 volume 0.28300E-03 ppm1 7.359 ppm2 -0.339 CV 1
ASSI { 910}
(( segid " " and resid 422 and name H ))
(( segid " " and resid 426 and name HG3 ))
3.700 1.700 1.700 peak 910 spectrum 1 weight 0.10000E+01 volume 0.41968E-03 ppm1 8.210 ppm2 1.998 CV 1
ASSI { 2594}
(( segid " " and resid 325 and name H ))
(( segid " " and resid 325 and name HB2 ))
2.400 0.700 0.700 peak 2594 spectrum 1 weight 0.10000E+01 volume 0.89327E-03 ppm1 8.510 ppm2 1.696 CV 1
ASSI { 1194}
(( segid " " and resid 334 and name H ))
(( segid " " and resid 336 and name H ))
4.300 2.300 1.700 peak 1194 spectrum 1 weight 0.10000E+01 volume 0.68921E-03 ppm1 8.129 ppm2 9.122 CV 1
ASSI { 2018}
(( segid " " and resid 354 and name H ))
(( segid " " and resid 354 and name HB3 ))
3.500 1.500 1.500 peak 2018 spectrum 1 weight 0.10000E+01 volume 0.64493E-03 ppm1 8.910 ppm2 2.719 CV 1
OR { 2018}
(( segid " " and resid 354 and name H ))
(( segid " " and resid 354 and name HB2 ))
ASSI { 1858}
(( segid " " and resid 196 and name H ))
(( segid " " and resid 193 and name HD3 ))
5.300 3.500 0.700 peak 1858 spectrum 1 weight 0.10000E+01 volume 0.49478E-03 ppm1 7.178 ppm2 3.658 CV 1
ASSI { 1886}
(( segid " " and resid 292 and name H ))
(( segid " " and resid 291 and name H ))
2.800 1.000 1.000 peak 1886 spectrum 1 weight 0.10000E+01 volume 0.22948E-02 ppm1 7.809 ppm2 7.364 CV 1
ASSI { 1158}
(( segid " " and resid 433 and name H ))
(( segid " " and resid 433 and name HA ))
3.200 1.300 1.300 peak 1158 spectrum 1 weight 0.10000E+01 volume 0.91637E-03 ppm1 8.322 ppm2 4.027 CV 1
ASSI { 1563}
(( segid " " and resid 334 and name H ))
( segid " " and resid 333 and name HD1%)
2.600 2.600 3.400 peak 1563 spectrum 1 weight 0.10000E+01 volume 0.11436E-02 ppm1 8.130 ppm2 0.864 CV 1
OR { 1563}
(( segid " " and resid 334 and name H ))
( segid " " and resid 333 and name HD2%)
ASSI { 2299}
(( segid " " and resid 288 and name H ))
( segid " " and resid 306 and name HD2%)
4.600 2.600 1.400 peak 2299 spectrum 1 weight 0.10000E+01 volume 0.64299E-03 ppm1 7.466 ppm2 -0.353 CV 1
ASSI { 1639}
(( segid " " and resid 326 and name H ))
(( segid " " and resid 325 and name HB2 ))
3.500 1.600 1.600 peak 1639 spectrum 1 weight 0.10000E+01 volume 0.77778E-03 ppm1 8.929 ppm2 1.706 CV 1
ASSI { 1720}
(( segid " " and resid 207 and name H ))
(( segid " " and resid 207 and name HG12))
2.300 0.600 0.600 peak 1720 spectrum 1 weight 0.10000E+01 volume 0.14631E-02 ppm1 6.897 ppm2 1.297 CV 1
ASSI { 1431}
(( segid " " and resid 263 and name H ))
(( segid " " and resid 263 and name HB ))
3.700 1.700 1.700 peak 1431 spectrum 1 weight 0.10000E+01 volume 0.13437E-02 ppm1 7.123 ppm2 1.558 CV 1
ASSI { 1078}
(( segid " " and resid 185 and name HD22))
(( segid " " and resid 189 and name H ))
5.500 3.700 0.500 peak 1078 spectrum 1 weight 0.10000E+01 volume 0.26182E-03 ppm1 7.564 ppm2 8.879 CV 1
ASSI { 1085}
(( segid " " and resid 391 and name H ))
(( segid " " and resid 390 and name HA ))
2.800 1.000 1.000 peak 1085 spectrum 1 weight 0.10000E+01 volume 0.80182E-02 ppm1 8.203 ppm2 3.869 CV 1
OR { 1085}
(( segid " " and resid 391 and name H ))
(( segid " " and resid 390 and name HB ))
ASSI { 1553}
(( segid " " and resid 375 and name H ))
( segid " " and resid 217 and name HG2%)
4.200 2.200 1.800 peak 1553 spectrum 1 weight 0.10000E+01 volume 0.30610E-03 ppm1 8.482 ppm2 0.465 CV 1
ASSI { 1864}
(( segid " " and resid 206 and name H ))
( segid " " and resid 207 and name HD1%)
6.000 4.700 0.000 peak 1864 spectrum 1 weight 0.10000E+01 volume 0.36962E-03 ppm1 7.671 ppm2 0.894 CV 1
ASSI { 2384}
(( segid " " and resid 421 and name H ))
(( segid " " and resid 421 and name HA ))
2.600 0.800 0.800 peak 2384 spectrum 1 weight 0.10000E+01 volume 0.32958E-02 ppm1 8.385 ppm2 4.304 CV 1
ASSI { 1852}
(( segid " " and resid 416 and name H ))
(( segid " " and resid 416 and name HB3 ))
3.200 1.300 1.300 peak 1852 spectrum 1 weight 0.10000E+01 volume 0.26914E-02 ppm1 7.937 ppm2 1.642 CV 1
OR { 1852}
(( segid " " and resid 416 and name H ))
(( segid " " and resid 416 and name HG ))
ASSI { 2304}
(( segid " " and resid 259 and name H ))
(( segid " " and resid 259 and name HA ))
3.100 1.200 1.200 peak 2304 spectrum 1 weight 0.10000E+01 volume 0.11339E-02 ppm1 8.459 ppm2 4.786 CV 1
ASSI { 2202}
(( segid " " and resid 233 and name H ))
(( segid " " and resid 233 and name HA ))
2.800 1.000 1.000 peak 2202 spectrum 1 weight 0.10000E+01 volume 0.20426E-02 ppm1 7.997 ppm2 3.833 CV 1
ASSI { 1889}
(( segid " " and resid 340 and name H ))
(( segid " " and resid 338 and name HB2 ))
4.400 2.400 1.600 peak 1889 spectrum 1 weight 0.10000E+01 volume 0.13803E-02 ppm1 8.161 ppm2 2.807 CV 1
ASSI { 2124}
(( segid " " and resid 288 and name H ))
( segid " " and resid 287 and name HD% )
4.300 2.300 1.700 peak 2124 spectrum 1 weight 0.10000E+01 volume 0.99530E-03 ppm1 7.478 ppm2 6.346 CV 1
ASSI { 1261}
(( segid " " and resid 278 and name H ))
(( segid " " and resid 278 and name HB3 ))
3.800 1.800 1.800 peak 1261 spectrum 1 weight 0.10000E+01 volume 0.87981E-03 ppm1 10.072 ppm2 1.530 CV 1
ASSI { 644}
(( segid " " and resid 273 and name H ))
(( segid " " and resid 274 and name HG ))
4.200 2.200 1.800 peak 644 spectrum 1 weight 0.10000E+01 volume 0.60256E-03 ppm1 7.705 ppm2 1.512 CV 1
ASSI { 3161}
(( segid " " and resid 428 and name H ))
(( segid " " and resid 428 and name HA ))
3.300 1.400 1.400 peak 3161 spectrum 1 weight 0.10000E+01 volume 0.85862E-03 ppm1 7.736 ppm2 4.151 CV 1
ASSI { 2172}
(( segid " " and resid 249 and name H ))
(( segid " " and resid 249 and name HB2 ))
2.800 1.000 1.000 peak 2172 spectrum 1 weight 0.10000E+01 volume 0.16441E-02 ppm1 7.300 ppm2 1.919 CV 1
ASSI { 1808}
(( segid " " and resid 201 and name H ))
(( segid " " and resid 198 and name HA ))
3.600 1.600 1.600 peak 1808 spectrum 1 weight 0.10000E+01 volume 0.54481E-03 ppm1 7.501 ppm2 2.906 CV 1
ASSI { 3183}
(( segid " " and resid 335 and name H ))
(( segid " " and resid 335 and name HA ))
3.300 1.400 1.400 peak 3183 spectrum 1 weight 0.10000E+01 volume 0.11416E-02 ppm1 8.875 ppm2 4.189 CV 1
OR { 3183}
(( segid " " and resid 335 and name H ))
(( segid " " and resid 335 and name HB ))
ASSI { 381}
(( segid " " and resid 203 and name H ))
(( segid " " and resid 202 and name HB2 ))
5.300 3.600 0.700 peak 381 spectrum 1 weight 0.10000E+01 volume 0.41200E-03 ppm1 8.266 ppm2 2.062 CV 1
ASSI { 478}
(( segid " " and resid 377 and name H ))
(( segid " " and resid 377 and name HG3 ))
3.500 1.500 1.500 peak 478 spectrum 1 weight 0.10000E+01 volume 0.21677E-02 ppm1 8.237 ppm2 2.424 CV 1
ASSI { 1073}
(( segid " " and resid 357 and name H ))
(( segid " " and resid 356 and name HA ))
3.800 1.800 1.800 peak 1073 spectrum 1 weight 0.10000E+01 volume 0.41775E-03 ppm1 8.140 ppm2 3.626 CV 1
ASSI { 2693}
(( segid " " and resid 387 and name H ))
(( segid " " and resid 382 and name HE1 ))
3.700 1.700 1.700 peak 2693 spectrum 1 weight 0.10000E+01 volume 0.48128E-03 ppm1 7.974 ppm2 9.598 CV 1
ASSI { 1937}
(( segid " " and resid 264 and name H ))
(( segid " " and resid 262 and name HA ))
4.600 2.600 1.400 peak 1937 spectrum 1 weight 0.10000E+01 volume 0.31765E-03 ppm1 8.509 ppm2 3.612 CV 1
ASSI { 1848}
(( segid " " and resid 276 and name H ))
(( segid " " and resid 276 and name HG2 ))
4.300 2.300 1.700 peak 1848 spectrum 1 weight 0.10000E+01 volume 0.16614E-02 ppm1 6.948 ppm2 2.371 CV 1
ASSI { 1307}
(( segid " " and resid 233 and name H ))
(( segid " " and resid 233 and name HB ))
2.900 1.100 1.100 peak 1307 spectrum 1 weight 0.10000E+01 volume 0.31399E-02 ppm1 7.997 ppm2 1.780 CV 1
ASSI { 1370}
(( segid " " and resid 351 and name HE21))
(( segid " " and resid 351 and name HA ))
3.900 1.900 1.900 peak 1370 spectrum 1 weight 0.10000E+01 volume 0.11974E-02 ppm1 6.759 ppm2 3.836 CV 1
ASSI { 3166}
(( segid " " and resid 257 and name H ))
(( segid " " and resid 257 and name HA ))
2.800 1.000 1.000 peak 3166 spectrum 1 weight 0.10000E+01 volume 0.39137E-02 ppm1 7.441 ppm2 4.411 CV 1
ASSI { 1675}
(( segid " " and resid 286 and name H ))
(( segid " " and resid 286 and name HG2 ))
2.700 0.900 0.900 peak 1675 spectrum 1 weight 0.10000E+01 volume 0.30591E-02 ppm1 7.442 ppm2 1.718 CV 1
OR { 1675}
(( segid " " and resid 286 and name H ))
(( segid " " and resid 286 and name HG3 ))
ASSI { 2683}
(( segid " " and resid 222 and name H ))
(( segid " " and resid 221 and name HB2 ))
3.600 1.700 1.700 peak 2683 spectrum 1 weight 0.10000E+01 volume 0.16595E-02 ppm1 7.251 ppm2 2.099 CV 1
OR { 2683}
(( segid " " and resid 222 and name H ))
(( segid " " and resid 221 and name HG2 ))
ASSI { 24}
(( segid " " and resid 345 and name H ))
(( segid " " and resid 344 and name HG13))
4.400 2.400 1.600 peak 24 spectrum 1 weight 0.10000E+01 volume 0.64299E-03 ppm1 6.996 ppm2 1.228 CV 1
ASSI { 1509}
(( segid " " and resid 416 and name H ))
(( segid " " and resid 416 and name HA ))
2.800 1.000 1.000 peak 1509 spectrum 1 weight 0.10000E+01 volume 0.18712E-02 ppm1 7.935 ppm2 4.268 CV 1
ASSI { 2336}
(( segid " " and resid 231 and name H ))
( segid " " and resid 231 and name HD% )
4.300 2.300 1.700 peak 2336 spectrum 1 weight 0.10000E+01 volume 0.72962E-03 ppm1 8.444 ppm2 6.774 CV 1
ASSI { 513}
(( segid " " and resid 333 and name H ))
(( segid " " and resid 333 and name HB2 ))
2.200 0.600 0.600 peak 513 spectrum 1 weight 0.10000E+01 volume 0.71943E-02 ppm1 8.641 ppm2 1.609 CV 1
OR { 513}
(( segid " " and resid 333 and name H ))
(( segid " " and resid 333 and name HG ))
ASSI { 1930}
(( segid " " and resid 425 and name H ))
(( segid " " and resid 422 and name HB3 ))
3.500 1.500 1.500 peak 1930 spectrum 1 weight 0.10000E+01 volume 0.60643E-03 ppm1 7.762 ppm2 2.665 CV 1
ASSI { 1004}
(( segid " " and resid 394 and name H ))
( segid " " and resid 394 and name HG2%)
2.500 0.800 0.800 peak 1004 spectrum 1 weight 0.10000E+01 volume 0.59755E-02 ppm1 7.545 ppm2 1.239 CV 1
ASSI { 1147}
(( segid " " and resid 362 and name H ))
(( segid " " and resid 362 and name HB ))
4.300 2.300 1.700 peak 1147 spectrum 1 weight 0.10000E+01 volume 0.84705E-03 ppm1 7.797 ppm2 3.802 CV 1
ASSI { 2268}
(( segid " " and resid 263 and name H ))
(( segid " " and resid 262 and name HB ))
2.800 1.000 1.000 peak 2268 spectrum 1 weight 0.10000E+01 volume 0.10819E-02 ppm1 7.124 ppm2 4.523 CV 1
ASSI { 2}
(( segid " " and resid 395 and name HE21))
(( segid " " and resid 444 and name HD3 ))
5.100 3.200 0.900 peak 2 spectrum 1 weight 0.10000E+01 volume 0.37540E-03 ppm1 7.773 ppm2 3.163 CV 1
OR { 2}
(( segid " " and resid 395 and name HE21))
(( segid " " and resid 444 and name HD2 ))
ASSI { 630}
(( segid " " and resid 294 and name H ))
(( segid " " and resid 293 and name HD3 ))
3.800 1.800 1.800 peak 630 spectrum 1 weight 0.10000E+01 volume 0.15459E-02 ppm1 8.530 ppm2 3.150 CV 1
ASSI { 347}
(( segid " " and resid 264 and name H ))
( segid " " and resid 219 and name HE% )
3.100 3.100 2.900 peak 347 spectrum 1 weight 0.10000E+01 volume 0.40237E-03 ppm1 8.514 ppm2 6.408 CV 1
ASSI { 1657}
(( segid " " and resid 225 and name H ))
(( segid " " and resid 225 and name HG3 ))
3.600 1.600 1.600 peak 1657 spectrum 1 weight 0.10000E+01 volume 0.17269E-02 ppm1 7.796 ppm2 2.688 CV 1
ASSI { 3146}
(( segid " " and resid 362 and name H ))
(( segid " " and resid 362 and name HA ))
3.300 1.400 1.400 peak 3146 spectrum 1 weight 0.10000E+01 volume 0.96449E-03 ppm1 7.793 ppm2 4.123 CV 1
ASSI { 2789}
(( segid " " and resid 304 and name HE21))
( segid " " and resid 300 and name HG1%)
4.900 3.000 1.100 peak 2789 spectrum 1 weight 0.10000E+01 volume 0.60834E-03 ppm1 6.658 ppm2 0.079 CV 1
ASSI { 2504}
(( segid " " and resid 201 and name H ))
(( segid " " and resid 201 and name HA ))
3.200 1.300 1.300 peak 2504 spectrum 1 weight 0.10000E+01 volume 0.11647E-02 ppm1 7.502 ppm2 4.947 CV 1
ASSI { 1014}
(( segid " " and resid 382 and name HE1 ))
( segid " " and resid 385 and name HE% )
4.500 2.500 1.500 peak 1014 spectrum 1 weight 0.10000E+01 volume 0.43125E-03 ppm1 9.611 ppm2 1.939 CV 1
ASSI { 3136}
(( segid " " and resid 293 and name H ))
(( segid " " and resid 299 and name HE2 ))
3.200 1.300 1.300 peak 3136 spectrum 1 weight 0.10000E+01 volume 0.52171E-03 ppm1 7.001 ppm2 2.878 CV 1
ASSI { 2375}
(( segid " " and resid 316 and name H ))
(( segid " " and resid 315 and name HB2 ))
4.000 2.000 2.000 peak 2375 spectrum 1 weight 0.10000E+01 volume 0.14458E-02 ppm1 8.714 ppm2 3.157 CV 1
ASSI { 1885}
(( segid " " and resid 344 and name H ))
(( segid " " and resid 344 and name HG13))
2.400 0.700 0.700 peak 1885 spectrum 1 weight 0.10000E+01 volume 0.19213E-02 ppm1 7.704 ppm2 1.232 CV 1
ASSI { 2121}
(( segid " " and resid 305 and name H ))
(( segid " " and resid 304 and name H ))
2.600 0.900 0.900 peak 2121 spectrum 1 weight 0.10000E+01 volume 0.22582E-02 ppm1 7.497 ppm2 8.697 CV 1
ASSI { 1918}
(( segid " " and resid 416 and name H ))
(( segid " " and resid 415 and name HA ))
3.600 1.600 1.600 peak 1918 spectrum 1 weight 0.10000E+01 volume 0.10300E-02 ppm1 7.936 ppm2 4.417 CV 1
ASSI { 1061}
(( segid " " and resid 239 and name H ))
(( segid " " and resid 239 and name HB3 ))
3.300 1.300 1.300 peak 1061 spectrum 1 weight 0.10000E+01 volume 0.18058E-02 ppm1 7.096 ppm2 1.769 CV 1
ASSI { 2796}
(( segid " " and resid 290 and name H ))
(( segid " " and resid 289 and name HG3 ))
3.800 1.800 1.800 peak 2796 spectrum 1 weight 0.10000E+01 volume 0.15170E-02 ppm1 7.822 ppm2 2.211 CV 1
ASSI { 1780}
(( segid " " and resid 207 and name H ))
(( segid " " and resid 206 and name HA2 ))
3.200 1.300 1.300 peak 1780 spectrum 1 weight 0.10000E+01 volume 0.76043E-03 ppm1 6.902 ppm2 3.585 CV 1
ASSI { 2115}
(( segid " " and resid 195 and name H ))
( segid " " and resid 194 and name HD2%)
4.100 2.100 1.900 peak 2115 spectrum 1 weight 0.10000E+01 volume 0.16133E-02 ppm1 8.992 ppm2 0.594 CV 1
ASSI { 1089}
(( segid " " and resid 334 and name H ))
(( segid " " and resid 334 and name HA ))
2.900 1.000 1.000 peak 1089 spectrum 1 weight 0.10000E+01 volume 0.25489E-02 ppm1 8.128 ppm2 4.429 CV 1
ASSI { 796}
(( segid " " and resid 338 and name HD21))
(( segid " " and resid 340 and name HB2 ))
4.400 2.400 1.600 peak 796 spectrum 1 weight 0.10000E+01 volume 0.35230E-03 ppm1 6.617 ppm2 1.989 CV 1
OR { 796}
(( segid " " and resid 338 and name HD21))
(( segid " " and resid 340 and name HB3 ))
ASSI { 294}
(( segid " " and resid 200 and name H ))
(( segid " " and resid 202 and name HG3 ))
4.300 2.300 1.700 peak 294 spectrum 1 weight 0.10000E+01 volume 0.54096E-03 ppm1 7.614 ppm2 2.762 CV 1
ASSI { 1031}
(( segid " " and resid 309 and name H ))
(( segid " " and resid 308 and name HA ))
3.100 1.200 1.200 peak 1031 spectrum 1 weight 0.10000E+01 volume 0.16614E-02 ppm1 7.491 ppm2 3.973 CV 1
ASSI { 2403}
(( segid " " and resid 200 and name H ))
(( segid " " and resid 199 and name HB2 ))
3.100 1.200 1.200 peak 2403 spectrum 1 weight 0.10000E+01 volume 0.10511E-02 ppm1 7.609 ppm2 1.894 CV 1
ASSI { 1794}
(( segid " " and resid 284 and name H ))
(( segid " " and resid 283 and name HA ))
3.100 1.200 1.200 peak 1794 spectrum 1 weight 0.10000E+01 volume 0.91446E-03 ppm1 8.117 ppm2 4.519 CV 1
ASSI { 1149}
(( segid " " and resid 295 and name H ))
(( segid " " and resid 296 and name H ))
4.400 2.400 1.600 peak 1149 spectrum 1 weight 0.10000E+01 volume 0.54481E-03 ppm1 7.400 ppm2 8.935 CV 1
ASSI { 2839}
(( segid " " and resid 433 and name HE21))
(( segid " " and resid 433 and name H ))
4.100 2.100 1.900 peak 2839 spectrum 1 weight 0.10000E+01 volume 0.42162E-03 ppm1 6.971 ppm2 8.315 CV 1
ASSI { 471}
(( segid " " and resid 427 and name H ))
(( segid " " and resid 424 and name HA ))
3.300 1.400 1.400 peak 471 spectrum 1 weight 0.10000E+01 volume 0.13437E-02 ppm1 8.069 ppm2 4.226 CV 1
ASSI { 1123}
(( segid " " and resid 403 and name H ))
(( segid " " and resid 403 and name HD2 ))
5.100 3.300 0.900 peak 1123 spectrum 1 weight 0.10000E+01 volume 0.70846E-03 ppm1 7.566 ppm2 3.264 CV 1
OR { 1123}
(( segid " " and resid 403 and name H ))
(( segid " " and resid 403 and name HD3 ))
ASSI { 1500}
(( segid " " and resid 293 and name H ))
(( segid " " and resid 292 and name HA2 ))
2.600 0.900 0.900 peak 1500 spectrum 1 weight 0.10000E+01 volume 0.23371E-02 ppm1 7.005 ppm2 3.735 CV 1
ASSI { 510}
(( segid " " and resid 249 and name H ))
( segid " " and resid 246 and name HB% )
4.500 2.500 1.500 peak 510 spectrum 1 weight 0.10000E+01 volume 0.71037E-03 ppm1 7.300 ppm2 1.192 CV 1
ASSI { 1495}
(( segid " " and resid 291 and name H ))
(( segid " " and resid 289 and name H ))
3.800 1.800 1.800 peak 1495 spectrum 1 weight 0.10000E+01 volume 0.66996E-03 ppm1 7.366 ppm2 7.997 CV 1
ASSI { 684}
(( segid " " and resid 363 and name H ))
(( segid " " and resid 364 and name HA ))
4.900 3.000 1.100 peak 684 spectrum 1 weight 0.10000E+01 volume 0.53134E-03 ppm1 7.264 ppm2 3.639 CV 1
ASSI { 3069}
(( segid " " and resid 393 and name H ))
(( segid " " and resid 392 and name HD2 ))
5.600 4.000 0.400 peak 3069 spectrum 1 weight 0.10000E+01 volume 0.22717E-03 ppm1 8.275 ppm2 3.170 CV 1
ASSI { 1924}
(( segid " " and resid 356 and name H ))
(( segid " " and resid 356 and name HA ))
3.100 1.200 1.200 peak 1924 spectrum 1 weight 0.10000E+01 volume 0.92983E-03 ppm1 7.362 ppm2 3.635 CV 1
ASSI { 2877}
(( segid " " and resid 209 and name H ))
(( segid " " and resid 209 and name HB3 ))
3.600 1.600 1.600 peak 2877 spectrum 1 weight 0.10000E+01 volume 0.86246E-03 ppm1 7.821 ppm2 1.876 CV 1
ASSI { 1033}
(( segid " " and resid 351 and name H ))
( segid " " and resid 350 and name HG2%)
3.200 1.300 1.300 peak 1033 spectrum 1 weight 0.10000E+01 volume 0.27453E-02 ppm1 7.885 ppm2 0.735 CV 1
OR { 1033}
(( segid " " and resid 351 and name H ))
( segid " " and resid 350 and name HG1%)
ASSI { 2263}
(( segid " " and resid 222 and name H ))
(( segid " " and resid 222 and name HB3 ))
3.400 1.500 1.500 peak 2263 spectrum 1 weight 0.10000E+01 volume 0.28319E-02 ppm1 7.249 ppm2 0.820 CV 1
ASSI { 1540}
(( segid " " and resid 245 and name H ))
(( segid " " and resid 244 and name HG3 ))
4.000 2.000 2.000 peak 1540 spectrum 1 weight 0.10000E+01 volume 0.68149E-03 ppm1 7.530 ppm2 -0.529 CV 1
ASSI { 377}
(( segid " " and resid 333 and name H ))
(( segid " " and resid 331 and name HA ))
3.900 1.900 1.900 peak 377 spectrum 1 weight 0.10000E+01 volume 0.67187E-03 ppm1 8.644 ppm2 4.546 CV 1
ASSI { 2401}
(( segid " " and resid 277 and name HD22))
(( segid " " and resid 277 and name HD21))
2.100 0.500 0.500 peak 2401 spectrum 1 weight 0.10000E+01 volume 0.14824E-02 ppm1 6.130 ppm2 7.672 CV 1
ASSI { 1943}
(( segid " " and resid 239 and name H ))
(( segid " " and resid 239 and name HG2 ))
2.700 0.900 0.900 peak 1943 spectrum 1 weight 0.10000E+01 volume 0.13380E-02 ppm1 7.096 ppm2 1.426 CV 1
ASSI { 1362}
(( segid " " and resid 216 and name H ))
( segid " " and resid 267 and name HD2%)
3.700 1.800 1.800 peak 1362 spectrum 1 weight 0.10000E+01 volume 0.15401E-02 ppm1 7.637 ppm2 0.923 CV 1
OR { 1362}
(( segid " " and resid 216 and name H ))
( segid " " and resid 267 and name HD1%)
ASSI { 1063}
(( segid " " and resid 207 and name H ))
(( segid " " and resid 208 and name H ))
3.700 1.700 1.700 peak 1063 spectrum 1 weight 0.10000E+01 volume 0.39271E-03 ppm1 6.896 ppm2 8.272 CV 1
ASSI { 1451}
(( segid " " and resid 424 and name H ))
(( segid " " and resid 425 and name H ))
2.600 0.800 0.800 peak 1451 spectrum 1 weight 0.10000E+01 volume 0.25566E-02 ppm1 8.281 ppm2 7.756 CV 1
ASSI { 2509}
(( segid " " and resid 368 and name H ))
(( segid " " and resid 368 and name HB2 ))
2.900 1.100 1.100 peak 2509 spectrum 1 weight 0.10000E+01 volume 0.78352E-03 ppm1 8.217 ppm2 3.269 CV 1
ASSI { 2456}
(( segid " " and resid 324 and name H ))
(( segid " " and resid 213 and name HZ ))
4.700 2.700 1.300 peak 2456 spectrum 1 weight 0.10000E+01 volume 0.37540E-03 ppm1 8.497 ppm2 6.327 CV 1
ASSI { 1405}
(( segid " " and resid 326 and name H ))
(( segid " " and resid 326 and name HA ))
2.900 1.000 1.000 peak 1405 spectrum 1 weight 0.10000E+01 volume 0.13476E-02 ppm1 8.929 ppm2 4.429 CV 1
ASSI { 1887}
(( segid " " and resid 187 and name H ))
(( segid " " and resid 187 and name HA ))
2.300 0.600 0.600 peak 1887 spectrum 1 weight 0.10000E+01 volume 0.37808E-02 ppm1 8.524 ppm2 4.630 CV 1
ASSI { 879}
(( segid " " and resid 333 and name H ))
(( segid " " and resid 334 and name HA ))
5.200 3.300 0.800 peak 879 spectrum 1 weight 0.10000E+01 volume 0.47165E-03 ppm1 8.641 ppm2 4.450 CV 1
ASSI { 420}
(( segid " " and resid 231 and name H ))
(( segid " " and resid 231 and name HA ))
3.000 1.200 1.200 peak 420 spectrum 1 weight 0.10000E+01 volume 0.63337E-03 ppm1 8.444 ppm2 3.555 CV 1
ASSI { 533}
(( segid " " and resid 293 and name H ))
(( segid " " and resid 293 and name HD3 ))
3.700 1.800 1.800 peak 533 spectrum 1 weight 0.10000E+01 volume 0.18443E-02 ppm1 7.004 ppm2 3.123 CV 1
OR { 533}
(( segid " " and resid 293 and name H ))
(( segid " " and resid 293 and name HD2 ))
ASSI { 2232}
(( segid " " and resid 442 and name H ))
(( segid " " and resid 442 and name HG3 ))
2.700 0.900 0.900 peak 2232 spectrum 1 weight 0.10000E+01 volume 0.15209E-02 ppm1 7.549 ppm2 1.450 CV 1
ASSI { 2530}
(( segid " " and resid 308 and name H ))
( segid " " and resid 315 and name HE% )
4.800 2.900 1.200 peak 2530 spectrum 1 weight 0.10000E+01 volume 0.46203E-03 ppm1 7.101 ppm2 6.825 CV 1
ASSI { 2659}
(( segid " " and resid 341 and name HD22))
(( segid " " and resid 337 and name HG2 ))
3.900 1.900 1.900 peak 2659 spectrum 1 weight 0.10000E+01 volume 0.55253E-03 ppm1 7.333 ppm2 1.786 CV 1
ASSI { 1206}
(( segid " " and resid 247 and name H ))
( segid " " and resid 247 and name HE% )
5.200 3.400 0.800 peak 1206 spectrum 1 weight 0.10000E+01 volume 0.46012E-03 ppm1 8.430 ppm2 6.482 CV 1
ASSI { 1235}
(( segid " " and resid 353 and name H ))
(( segid " " and resid 356 and name H ))
5.400 3.700 0.600 peak 1235 spectrum 1 weight 0.10000E+01 volume 0.25989E-03 ppm1 8.934 ppm2 7.360 CV 1
ASSI { 1296}
(( segid " " and resid 387 and name H ))
( segid " " and resid 386 and name HB% )
2.800 1.000 1.000 peak 1296 spectrum 1 weight 0.10000E+01 volume 0.47687E-02 ppm1 7.974 ppm2 1.461 CV 1
ASSI { 2417}
(( segid " " and resid 419 and name H ))
(( segid " " and resid 420 and name HG12))
6.000 4.500 0.000 peak 2417 spectrum 1 weight 0.10000E+01 volume 0.39659E-03 ppm1 7.959 ppm2 1.114 CV 1
ASSI { 1680}
(( segid " " and resid 357 and name H ))
(( segid " " and resid 354 and name HA ))
3.600 1.600 1.600 peak 1680 spectrum 1 weight 0.10000E+01 volume 0.10049E-02 ppm1 8.143 ppm2 4.185 CV 1
ASSI { 2957}
(( segid " " and resid 350 and name H ))
( segid " " and resid 350 and name HG2%)
2.400 0.700 0.700 peak 2957 spectrum 1 weight 0.10000E+01 volume 0.35383E-02 ppm1 7.626 ppm2 0.735 CV 1
OR { 2957}
(( segid " " and resid 350 and name H ))
( segid " " and resid 350 and name HG1%)
ASSI { 718}
(( segid " " and resid 309 and name H ))
( segid " " and resid 283 and name HD2%)
4.300 2.300 1.700 peak 718 spectrum 1 weight 0.10000E+01 volume 0.14111E-02 ppm1 7.492 ppm2 0.909 CV 1
ASSI { 854}
(( segid " " and resid 301 and name HE21))
(( segid " " and resid 297 and name HA ))
4.500 2.600 1.500 peak 854 spectrum 1 weight 0.10000E+01 volume 0.33883E-03 ppm1 6.704 ppm2 3.749 CV 1
ASSI { 2935}
(( segid " " and resid 257 and name H ))
( segid " " and resid 258 and name HE% )
4.500 2.500 1.500 peak 2935 spectrum 1 weight 0.10000E+01 volume 0.12995E-02 ppm1 7.441 ppm2 6.651 CV 1
ASSI { 1708}
(( segid " " and resid 369 and name H ))
( segid " " and resid 368 and name HD% )
4.300 2.300 1.700 peak 1708 spectrum 1 weight 0.10000E+01 volume 0.96065E-03 ppm1 7.754 ppm2 7.161 CV 1
ASSI { 222}
(( segid " " and resid 408 and name H ))
(( segid " " and resid 407 and name HB3 ))
4.000 2.000 2.000 peak 222 spectrum 1 weight 0.10000E+01 volume 0.75659E-03 ppm1 7.477 ppm2 3.339 CV 1
ASSI { 3108}
(( segid " " and resid 261 and name H ))
(( segid " " and resid 262 and name H ))
2.700 0.900 0.900 peak 3108 spectrum 1 weight 0.10000E+01 volume 0.18250E-02 ppm1 8.908 ppm2 7.883 CV 1
ASSI { 1490}
(( segid " " and resid 196 and name H ))
( segid " " and resid 192 and name HG2%)
2.700 2.700 3.300 peak 1490 spectrum 1 weight 0.10000E+01 volume 0.93177E-03 ppm1 7.182 ppm2 0.690 CV 1
ASSI { 2023}
(( segid " " and resid 244 and name H ))
(( segid " " and resid 243 and name HB3 ))
3.500 1.600 1.600 peak 2023 spectrum 1 weight 0.10000E+01 volume 0.12494E-02 ppm1 8.559 ppm2 1.200 CV 1
ASSI { 1601}
(( segid " " and resid 435 and name H ))
( segid " " and resid 435 and name HD1%)
4.200 2.300 1.800 peak 1601 spectrum 1 weight 0.10000E+01 volume 0.14439E-02 ppm1 8.204 ppm2 0.896 CV 1
OR { 1601}
(( segid " " and resid 435 and name H ))
( segid " " and resid 435 and name HG2%)
ASSI { 2640}
(( segid " " and resid 338 and name HD21))
(( segid " " and resid 338 and name HA ))
4.300 2.400 1.700 peak 2640 spectrum 1 weight 0.10000E+01 volume 0.56406E-03 ppm1 6.625 ppm2 4.643 CV 1
ASSI { 1088}
(( segid " " and resid 444 and name H ))
( segid " " and resid 443 and name HD2%)
3.300 1.300 1.300 peak 1088 spectrum 1 weight 0.10000E+01 volume 0.31380E-02 ppm1 7.769 ppm2 0.817 CV 1
ASSI { 967}
(( segid " " and resid 249 and name H ))
(( segid " " and resid 251 and name HG2 ))
3.800 1.800 1.800 peak 967 spectrum 1 weight 0.10000E+01 volume 0.11724E-02 ppm1 7.299 ppm2 2.133 CV 1
OR { 967}
(( segid " " and resid 249 and name H ))
(( segid " " and resid 251 and name HG3 ))
ASSI { 2700}
(( segid " " and resid 232 and name H ))
(( segid " " and resid 230 and name H ))
4.600 2.700 1.400 peak 2700 spectrum 1 weight 0.10000E+01 volume 0.18096E-03 ppm1 8.786 ppm2 7.107 CV 1
ASSI { 2898}
(( segid " " and resid 376 and name H ))
(( segid " " and resid 376 and name HA ))
3.300 1.400 1.400 peak 2898 spectrum 1 weight 0.10000E+01 volume 0.81240E-03 ppm1 9.516 ppm2 3.884 CV 1
ASSI { 2598}
(( segid " " and resid 225 and name H ))
(( segid " " and resid 225 and name HA ))
2.900 1.000 1.000 peak 2598 spectrum 1 weight 0.10000E+01 volume 0.22813E-02 ppm1 7.796 ppm2 4.359 CV 1
ASSI { 1163}
(( segid " " and resid 198 and name H ))
(( segid " " and resid 196 and name HA ))
3.800 1.900 1.900 peak 1163 spectrum 1 weight 0.10000E+01 volume 0.94718E-03 ppm1 8.617 ppm2 4.398 CV 1
ASSI { 1902}
(( segid " " and resid 422 and name H ))
(( segid " " and resid 421 and name HA ))
1.900 0.500 0.500 peak 1902 spectrum 1 weight 0.10000E+01 volume 0.11239E-01 ppm1 8.204 ppm2 4.304 CV 1
ASSI { 376}
(( segid " " and resid 357 and name H ))
(( segid " " and resid 352 and name HB ))
4.800 2.900 1.200 peak 376 spectrum 1 weight 0.10000E+01 volume 0.31188E-03 ppm1 8.140 ppm2 1.158 CV 1
ASSI { 895}
(( segid " " and resid 251 and name H ))
(( segid " " and resid 252 and name HA ))
3.800 1.800 1.800 peak 895 spectrum 1 weight 0.10000E+01 volume 0.75659E-03 ppm1 7.892 ppm2 4.376 CV 1
ASSI { 1456}
(( segid " " and resid 315 and name H ))
(( segid " " and resid 315 and name HB2 ))
2.800 1.000 1.000 peak 1456 spectrum 1 weight 0.10000E+01 volume 0.14631E-02 ppm1 8.317 ppm2 3.157 CV 1
ASSI { 1232}
(( segid " " and resid 423 and name H ))
(( segid " " and resid 422 and name HB3 ))
4.100 2.100 1.900 peak 1232 spectrum 1 weight 0.10000E+01 volume 0.66803E-03 ppm1 8.688 ppm2 2.667 CV 1
ASSI { 2926}
(( segid " " and resid 364 and name H ))
( segid " " and resid 323 and name HG2%)
5.900 4.400 0.100 peak 2926 spectrum 1 weight 0.10000E+01 volume 0.56793E-03 ppm1 7.566 ppm2 0.417 CV 1
ASSI { 2270}
(( segid " " and resid 248 and name H ))
( segid " " and resid 246 and name HB% )
4.600 2.700 1.400 peak 2270 spectrum 1 weight 0.10000E+01 volume 0.84131E-03 ppm1 8.882 ppm2 1.192 CV 1
ASSI { 195}
(( segid " " and resid 310 and name H ))
(( segid " " and resid 306 and name HA ))
4.500 2.500 1.500 peak 195 spectrum 1 weight 0.10000E+01 volume 0.41200E-03 ppm1 7.065 ppm2 3.655 CV 1
ASSI { 611}
(( segid " " and resid 375 and name HE21))
(( segid " " and resid 222 and name HD2 ))
3.800 1.800 1.800 peak 611 spectrum 1 weight 0.10000E+01 volume 0.42353E-03 ppm1 6.674 ppm2 1.298 CV 1
ASSI { 1758}
(( segid " " and resid 246 and name H ))
( segid " " and resid 247 and name HE% )
5.800 4.200 0.200 peak 1758 spectrum 1 weight 0.10000E+01 volume 0.28300E-03 ppm1 7.457 ppm2 6.485 CV 1
ASSI { 1698}
(( segid " " and resid 427 and name H ))
(( segid " " and resid 427 and name HG3 ))
2.400 0.700 0.700 peak 1698 spectrum 1 weight 0.10000E+01 volume 0.16383E-02 ppm1 8.058 ppm2 2.366 CV 1
ASSI { 2153}
(( segid " " and resid 236 and name H ))
(( segid " " and resid 235 and name HA2 ))
3.500 1.500 1.500 peak 2153 spectrum 1 weight 0.10000E+01 volume 0.82396E-03 ppm1 7.799 ppm2 3.628 CV 1
ASSI { 111}
(( segid " " and resid 247 and name H ))
(( segid " " and resid 244 and name HA ))
4.000 2.000 2.000 peak 111 spectrum 1 weight 0.10000E+01 volume 0.36384E-03 ppm1 8.423 ppm2 3.307 CV 1
ASSI { 3125}
(( segid " " and resid 253 and name H ))
( segid " " and resid 243 and name HD2%)
5.500 3.800 0.500 peak 3125 spectrum 1 weight 0.10000E+01 volume 0.33690E-03 ppm1 8.252 ppm2 0.183 CV 1
ASSI { 1668}
(( segid " " and resid 293 and name H ))
(( segid " " and resid 293 and name HA ))
2.500 0.800 0.800 peak 1668 spectrum 1 weight 0.10000E+01 volume 0.31842E-02 ppm1 7.005 ppm2 4.279 CV 1
ASSI { 1303}
(( segid " " and resid 325 and name H ))
(( segid " " and resid 361 and name HZ ))
6.000 4.800 0.000 peak 1303 spectrum 1 weight 0.10000E+01 volume 0.44662E-03 ppm1 8.508 ppm2 6.636 CV 1
ASSI { 725}
(( segid " " and resid 276 and name H ))
(( segid " " and resid 193 and name HA ))
3.500 1.500 1.500 peak 725 spectrum 1 weight 0.10000E+01 volume 0.10993E-02 ppm1 6.947 ppm2 4.134 CV 1
ASSI { 1095}
(( segid " " and resid 404 and name H ))
(( segid " " and resid 402 and name H ))
4.300 2.300 1.700 peak 1095 spectrum 1 weight 0.10000E+01 volume 0.41775E-03 ppm1 7.640 ppm2 8.719 CV 1
ASSI { 1027}
(( segid " " and resid 256 and name H ))
(( segid " " and resid 254 and name HA ))
3.600 1.600 1.600 peak 1027 spectrum 1 weight 0.10000E+01 volume 0.88943E-03 ppm1 8.257 ppm2 4.871 CV 1
ASSI { 1790}
(( segid " " and resid 387 and name H ))
(( segid " " and resid 385 and name HG3 ))
3.300 1.400 1.400 peak 1790 spectrum 1 weight 0.10000E+01 volume 0.25989E-03 ppm1 7.972 ppm2 2.479 CV 1
ASSI { 3051}
(( segid " " and resid 341 and name H ))
(( segid " " and resid 337 and name HA ))
5.100 3.200 0.900 peak 3051 spectrum 1 weight 0.10000E+01 volume 0.45050E-03 ppm1 8.540 ppm2 4.993 CV 1
ASSI { 3110}
(( segid " " and resid 187 and name H ))
(( segid " " and resid 186 and name HB2 ))
3.100 1.200 1.200 peak 3110 spectrum 1 weight 0.10000E+01 volume 0.51131E-02 ppm1 8.525 ppm2 1.526 CV 1
OR { 3110}
(( segid " " and resid 187 and name H ))
(( segid " " and resid 186 and name HB3 ))
ASSI { 641}
(( segid " " and resid 242 and name H ))
( segid " " and resid 243 and name HD1%)
5.800 4.100 0.200 peak 641 spectrum 1 weight 0.10000E+01 volume 0.30417E-03 ppm1 7.543 ppm2 0.026 CV 1
ASSI { 1171}
(( segid " " and resid 297 and name H ))
(( segid " " and resid 296 and name H ))
3.500 1.500 1.500 peak 1171 spectrum 1 weight 0.10000E+01 volume 0.73734E-03 ppm1 8.074 ppm2 8.925 CV 1
ASSI { 1754}
(( segid " " and resid 293 and name H ))
(( segid " " and resid 299 and name HG2 ))
2.700 0.900 0.900 peak 1754 spectrum 1 weight 0.10000E+01 volume 0.12302E-02 ppm1 7.004 ppm2 1.401 CV 1
OR { 1754}
(( segid " " and resid 293 and name H ))
(( segid " " and resid 299 and name HG3 ))
OR { 1754}
(( segid " " and resid 293 and name H ))
(( segid " " and resid 299 and name HB2 ))
ASSI { 2612}
(( segid " " and resid 278 and name H ))
( segid " " and resid 279 and name HD2%)
4.400 2.400 1.600 peak 2612 spectrum 1 weight 0.10000E+01 volume 0.44472E-03 ppm1 10.077 ppm2 0.368 CV 1
ASSI { 587}
(( segid " " and resid 234 and name H ))
(( segid " " and resid 233 and name HB ))
3.900 1.900 1.900 peak 587 spectrum 1 weight 0.10000E+01 volume 0.74312E-03 ppm1 8.666 ppm2 1.788 CV 1
ASSI { 2126}
(( segid " " and resid 364 and name H ))
(( segid " " and resid 364 and name HA ))
2.800 1.000 1.000 peak 2126 spectrum 1 weight 0.10000E+01 volume 0.17673E-02 ppm1 7.564 ppm2 3.648 CV 1
ASSI { 847}
(( segid " " and resid 301 and name H ))
( segid " " and resid 297 and name HG2%)
4.700 2.700 1.300 peak 847 spectrum 1 weight 0.10000E+01 volume 0.71999E-03 ppm1 8.071 ppm2 1.127 CV 1
ASSI { 1530}
(( segid " " and resid 433 and name HE21))
(( segid " " and resid 430 and name HA ))
3.800 1.800 1.800 peak 1530 spectrum 1 weight 0.10000E+01 volume 0.63721E-03 ppm1 6.968 ppm2 4.406 CV 1
ASSI { 144}
(( segid " " and resid 444 and name H ))
(( segid " " and resid 395 and name HE22))
3.900 1.900 1.900 peak 144 spectrum 1 weight 0.10000E+01 volume 0.96449E-03 ppm1 7.765 ppm2 6.981 CV 1
ASSI { 2874}
(( segid " " and resid 218 and name H ))
( segid " " and resid 217 and name HG2%)
3.200 1.300 1.300 peak 2874 spectrum 1 weight 0.10000E+01 volume 0.19598E-02 ppm1 7.978 ppm2 0.484 CV 1
OR { 2874}
(( segid " " and resid 218 and name H ))
(( segid " " and resid 217 and name HG13))
OR { 2874}
(( segid " " and resid 218 and name H ))
(( segid " " and resid 217 and name HG12))
ASSI { 1251}
(( segid " " and resid 388 and name H ))
(( segid " " and resid 387 and name H ))
3.300 1.400 1.400 peak 1251 spectrum 1 weight 0.10000E+01 volume 0.11974E-02 ppm1 8.234 ppm2 7.965 CV 1
ASSI { 676}
(( segid " " and resid 312 and name H ))
(( segid " " and resid 313 and name HB3 ))
5.500 3.800 0.500 peak 676 spectrum 1 weight 0.10000E+01 volume 0.33113E-03 ppm1 8.791 ppm2 2.919 CV 1
ASSI { 1621}
(( segid " " and resid 303 and name H ))
( segid " " and resid 306 and name HD2%)
4.800 2.800 1.200 peak 1621 spectrum 1 weight 0.10000E+01 volume 0.33498E-03 ppm1 8.745 ppm2 -0.358 CV 1
ASSI { 2622}
(( segid " " and resid 343 and name H ))
(( segid " " and resid 343 and name HG ))
3.200 1.200 1.200 peak 2622 spectrum 1 weight 0.10000E+01 volume 0.18462E-02 ppm1 8.202 ppm2 4.808 CV 1
ASSI { 1665}
(( segid " " and resid 341 and name H ))
(( segid " " and resid 338 and name HA ))
5.100 3.300 0.900 peak 1665 spectrum 1 weight 0.10000E+01 volume 0.24449E-03 ppm1 8.541 ppm2 4.670 CV 1
ASSI { 2585}
(( segid " " and resid 261 and name H ))
(( segid " " and resid 261 and name HD21))
3.200 1.300 1.300 peak 2585 spectrum 1 weight 0.10000E+01 volume 0.12552E-02 ppm1 8.907 ppm2 7.526 CV 1
ASSI { 541}
(( segid " " and resid 378 and name H ))
(( segid " " and resid 379 and name HG3 ))
4.200 2.200 1.800 peak 541 spectrum 1 weight 0.10000E+01 volume 0.16190E-02 ppm1 8.585 ppm2 1.838 CV 1
OR { 541}
(( segid " " and resid 378 and name H ))
(( segid " " and resid 379 and name HG2 ))
ASSI { 757}
(( segid " " and resid 331 and name H ))
(( segid " " and resid 331 and name HE3 ))
4.800 2.800 1.200 peak 757 spectrum 1 weight 0.10000E+01 volume 0.41968E-03 ppm1 7.184 ppm2 2.874 CV 1
OR { 757}
(( segid " " and resid 331 and name H ))
(( segid " " and resid 331 and name HE2 ))
ASSI { 2760}
(( segid " " and resid 407 and name H ))
( segid " " and resid 407 and name HD% )
3.400 1.500 1.500 peak 2760 spectrum 1 weight 0.10000E+01 volume 0.17095E-02 ppm1 7.796 ppm2 7.309 CV 1
ASSI { 159}
(( segid " " and resid 279 and name H ))
(( segid " " and resid 277 and name HB2 ))
4.400 2.400 1.600 peak 159 spectrum 1 weight 0.10000E+01 volume 0.34268E-03 ppm1 9.032 ppm2 2.704 CV 1
ASSI { 2436}
(( segid " " and resid 371 and name H ))
(( segid " " and resid 369 and name H ))
3.000 1.100 1.100 peak 2436 spectrum 1 weight 0.10000E+01 volume 0.55059E-03 ppm1 7.539 ppm2 7.736 CV 1
ASSI { 3149}
(( segid " " and resid 249 and name H ))
(( segid " " and resid 249 and name HG3 ))
2.900 1.000 1.000 peak 3149 spectrum 1 weight 0.10000E+01 volume 0.35383E-02 ppm1 7.300 ppm2 1.737 CV 1
OR { 3149}
(( segid " " and resid 249 and name H ))
(( segid " " and resid 249 and name HB3 ))
ASSI { 82}
(( segid " " and resid 375 and name HE22))
(( segid " " and resid 222 and name HD2 ))
3.100 1.200 1.200 peak 82 spectrum 1 weight 0.10000E+01 volume 0.64684E-03 ppm1 7.508 ppm2 1.325 CV 1
OR { 82}
(( segid " " and resid 375 and name HE22))
(( segid " " and resid 222 and name HD3 ))
ASSI { 3155}
(( segid " " and resid 206 and name H ))
(( segid " " and resid 205 and name HB3 ))
4.200 2.200 1.800 peak 3155 spectrum 1 weight 0.10000E+01 volume 0.61028E-03 ppm1 7.661 ppm2 1.683 CV 1
ASSI { 921}
(( segid " " and resid 265 and name H ))
(( segid " " and resid 216 and name HB2 ))
4.700 2.800 1.300 peak 921 spectrum 1 weight 0.10000E+01 volume 0.54481E-03 ppm1 7.761 ppm2 2.353 CV 1
ASSI { 1041}
(( segid " " and resid 194 and name H ))
(( segid " " and resid 193 and name HG2 ))
6.000 4.700 0.000 peak 1041 spectrum 1 weight 0.10000E+01 volume 0.30802E-03 ppm1 9.126 ppm2 2.109 CV 1
ASSI { 2471}
(( segid " " and resid 373 and name H ))
(( segid " " and resid 373 and name HB3 ))
3.800 1.800 1.800 peak 2471 spectrum 1 weight 0.10000E+01 volume 0.14188E-02 ppm1 8.242 ppm2 1.355 CV 1
ASSI { 1125}
(( segid " " and resid 277 and name HD22))
(( segid " " and resid 277 and name HB2 ))
4.500 2.500 1.500 peak 1125 spectrum 1 weight 0.10000E+01 volume 0.47553E-03 ppm1 6.128 ppm2 2.693 CV 1
ASSI { 1297}
(( segid " " and resid 326 and name H ))
(( segid " " and resid 326 and name HB3 ))
2.800 1.000 1.000 peak 1297 spectrum 1 weight 0.10000E+01 volume 0.19636E-02 ppm1 8.924 ppm2 2.677 CV 1
ASSI { 991}
(( segid " " and resid 241 and name H ))
( segid " " and resid 240 and name HG2%)
3.800 1.800 1.800 peak 991 spectrum 1 weight 0.10000E+01 volume 0.33055E-02 ppm1 8.372 ppm2 0.769 CV 1
ASSI { 1254}
(( segid " " and resid 295 and name H ))
(( segid " " and resid 299 and name HE3 ))
4.100 2.100 1.900 peak 1254 spectrum 1 weight 0.10000E+01 volume 0.45050E-03 ppm1 7.394 ppm2 2.569 CV 1
ASSI { 2856}
(( segid " " and resid 416 and name H ))
(( segid " " and resid 417 and name H ))
2.700 0.900 0.900 peak 2856 spectrum 1 weight 0.10000E+01 volume 0.18039E-02 ppm1 7.933 ppm2 7.753 CV 1
ASSI { 1037}
(( segid " " and resid 309 and name H ))
(( segid " " and resid 308 and name HG2 ))
3.600 1.600 1.600 peak 1037 spectrum 1 weight 0.10000E+01 volume 0.15536E-02 ppm1 7.488 ppm2 1.559 CV 1
OR { 1037}
(( segid " " and resid 309 and name H ))
(( segid " " and resid 308 and name HD2 ))
ASSI { 1104}
(( segid " " and resid 406 and name H ))
(( segid " " and resid 406 and name HB2 ))
2.900 1.000 1.000 peak 1104 spectrum 1 weight 0.10000E+01 volume 0.19579E-02 ppm1 9.259 ppm2 1.931 CV 1
OR { 1104}
(( segid " " and resid 406 and name H ))
(( segid " " and resid 406 and name HB3 ))
ASSI { 284}
(( segid " " and resid 269 and name HE21))
(( segid " " and resid 269 and name HG3 ))
2.900 1.100 1.100 peak 284 spectrum 1 weight 0.10000E+01 volume 0.23314E-02 ppm1 8.090 ppm2 2.502 CV 1
OR { 284}
(( segid " " and resid 269 and name HE21))
(( segid " " and resid 269 and name HG2 ))
ASSI { 1401}
(( segid " " and resid 191 and name H ))
(( segid " " and resid 191 and name HA2 ))
3.200 1.300 1.300 peak 1401 spectrum 1 weight 0.10000E+01 volume 0.67187E-03 ppm1 9.248 ppm2 4.122 CV 1
ASSI { 1587}
(( segid " " and resid 430 and name HE1 ))
( segid " " and resid 429 and name HD2%)
3.500 1.500 1.500 peak 1587 spectrum 1 weight 0.10000E+01 volume 0.18270E-02 ppm1 10.081 ppm2 0.668 CV 1
ASSI { 1878}
(( segid " " and resid 374 and name H ))
( segid " " and resid 373 and name HD1%)
4.500 2.500 1.500 peak 1878 spectrum 1 weight 0.10000E+01 volume 0.92983E-03 ppm1 6.330 ppm2 -0.191 CV 1
ASSI { 488}
(( segid " " and resid 390 and name H ))
(( segid " " and resid 388 and name HB3 ))
2.600 2.600 3.400 peak 488 spectrum 1 weight 0.10000E+01 volume 0.10973E-02 ppm1 8.063 ppm2 1.322 CV 1
ASSI { 2861}
(( segid " " and resid 360 and name H ))
( segid " " and resid 359 and name HG2%)
3.900 1.900 1.900 peak 2861 spectrum 1 weight 0.10000E+01 volume 0.11801E-02 ppm1 7.280 ppm2 -0.457 CV 1
ASSI { 2878}
(( segid " " and resid 190 and name H ))
(( segid " " and resid 190 and name HA ))
3.900 1.900 1.900 peak 2878 spectrum 1 weight 0.10000E+01 volume 0.30802E-03 ppm1 10.631 ppm2 3.697 CV 1
ASSI { 2256}
(( segid " " and resid 390 and name H ))
(( segid " " and resid 391 and name H ))
2.200 0.600 0.600 peak 2256 spectrum 1 weight 0.10000E+01 volume 0.12013E-02 ppm1 8.062 ppm2 8.221 CV 1
ASSI { 217}
(( segid " " and resid 265 and name H ))
(( segid " " and resid 269 and name HB2 ))
4.700 2.800 1.300 peak 217 spectrum 1 weight 0.10000E+01 volume 0.45624E-03 ppm1 7.752 ppm2 2.197 CV 1
ASSI { 2009}
(( segid " " and resid 335 and name H ))
(( segid " " and resid 333 and name HB3 ))
4.600 2.700 1.400 peak 2009 spectrum 1 weight 0.10000E+01 volume 0.54481E-03 ppm1 8.876 ppm2 1.539 CV 1
ASSI { 2798}
(( segid " " and resid 186 and name H ))
(( segid " " and resid 186 and name HB3 ))
1.900 0.500 0.500 peak 2798 spectrum 1 weight 0.10000E+01 volume 0.20905E-01 ppm1 8.055 ppm2 1.529 CV 1
OR { 2798}
(( segid " " and resid 186 and name H ))
(( segid " " and resid 186 and name HB2 ))
ASSI { 1579}
(( segid " " and resid 237 and name H ))
(( segid " " and resid 237 and name HB3 ))
3.400 1.400 1.400 peak 1579 spectrum 1 weight 0.10000E+01 volume 0.10338E-02 ppm1 8.769 ppm2 1.798 CV 1
ASSI { 1987}
(( segid " " and resid 272 and name H ))
(( segid " " and resid 269 and name HA ))
3.200 1.300 1.300 peak 1987 spectrum 1 weight 0.10000E+01 volume 0.12128E-02 ppm1 8.503 ppm2 3.814 CV 1
ASSI { 1599}
(( segid " " and resid 393 and name H ))
(( segid " " and resid 393 and name HB3 ))
3.800 1.800 1.800 peak 1599 spectrum 1 weight 0.10000E+01 volume 0.22678E-02 ppm1 8.270 ppm2 1.856 CV 1
ASSI { 1285}
(( segid " " and resid 194 and name H ))
(( segid " " and resid 193 and name HB2 ))
4.200 2.200 1.800 peak 1285 spectrum 1 weight 0.10000E+01 volume 0.42353E-03 ppm1 9.114 ppm2 2.340 CV 1
ASSI { 1716}
(( segid " " and resid 237 and name H ))
(( segid " " and resid 237 and name HG3 ))
3.800 1.800 1.800 peak 1716 spectrum 1 weight 0.10000E+01 volume 0.65646E-03 ppm1 8.771 ppm2 1.370 CV 1
ASSI { 1170}
(( segid " " and resid 235 and name H ))
(( segid " " and resid 235 and name HA2 ))
4.000 2.000 2.000 peak 1170 spectrum 1 weight 0.10000E+01 volume 0.62184E-03 ppm1 7.894 ppm2 3.624 CV 1
ASSI { 266}
(( segid " " and resid 297 and name H ))
(( segid " " and resid 299 and name HB2 ))
4.500 2.500 1.500 peak 266 spectrum 1 weight 0.10000E+01 volume 0.40237E-03 ppm1 8.073 ppm2 1.466 CV 1
ASSI { 3153}
(( segid " " and resid 417 and name HE22))
(( segid " " and resid 417 and name HE21))
1.100 0.200 1.100 peak 3153 spectrum 1 weight 0.10000E+01 volume 0.83828E-01 ppm1 6.741 ppm2 7.358 CV 1
ASSI { 1946}
(( segid " " and resid 333 and name H ))
(( segid " " and resid 332 and name HB2 ))
2.900 1.100 1.100 peak 1946 spectrum 1 weight 0.10000E+01 volume 0.14285E-02 ppm1 8.640 ppm2 1.828 CV 1
ASSI { 1806}
(( segid " " and resid 355 and name H ))
(( segid " " and resid 354 and name HB2 ))
3.200 1.300 1.300 peak 1806 spectrum 1 weight 0.10000E+01 volume 0.16325E-02 ppm1 8.079 ppm2 2.720 CV 1
OR { 1806}
(( segid " " and resid 355 and name H ))
(( segid " " and resid 354 and name HB3 ))
ASSI { 2385}
(( segid " " and resid 341 and name H ))
(( segid " " and resid 340 and name H ))
2.600 0.800 0.800 peak 2385 spectrum 1 weight 0.10000E+01 volume 0.29782E-02 ppm1 8.541 ppm2 8.167 CV 1
ASSI { 190}
(( segid " " and resid 395 and name HE21))
(( segid " " and resid 399 and name HE3 ))
4.700 2.800 1.300 peak 190 spectrum 1 weight 0.10000E+01 volume 0.25989E-03 ppm1 7.768 ppm2 2.878 CV 1
OR { 190}
(( segid " " and resid 395 and name HE21))
(( segid " " and resid 399 and name HE2 ))
ASSI { 2918}
(( segid " " and resid 300 and name H ))
(( segid " " and resid 298 and name HA ))
3.900 1.900 1.900 peak 2918 spectrum 1 weight 0.10000E+01 volume 0.75849E-03 ppm1 7.920 ppm2 3.958 CV 1
ASSI { 2254}
(( segid " " and resid 280 and name H ))
(( segid " " and resid 278 and name HA ))
4.100 2.100 1.900 peak 2254 spectrum 1 weight 0.10000E+01 volume 0.32920E-03 ppm1 7.651 ppm2 3.822 CV 1
ASSI { 927}
(( segid " " and resid 424 and name H ))
(( segid " " and resid 425 and name HG3 ))
6.000 4.800 0.000 peak 927 spectrum 1 weight 0.10000E+01 volume 0.34845E-03 ppm1 8.281 ppm2 1.263 CV 1
ASSI { 2212}
(( segid " " and resid 354 and name HD22))
(( segid " " and resid 344 and name HG13))
3.600 1.600 1.600 peak 2212 spectrum 1 weight 0.10000E+01 volume 0.41775E-03 ppm1 6.456 ppm2 1.222 CV 1
ASSI { 1743}
(( segid " " and resid 290 and name H ))
(( segid " " and resid 289 and name H ))
2.600 0.800 0.800 peak 1743 spectrum 1 weight 0.10000E+01 volume 0.29570E-02 ppm1 7.820 ppm2 7.996 CV 1
ASSI { 2851}
(( segid " " and resid 378 and name H ))
(( segid " " and resid 378 and name HA ))
3.200 1.300 1.300 peak 2851 spectrum 1 weight 0.10000E+01 volume 0.10761E-02 ppm1 8.585 ppm2 4.448 CV 1
ASSI { 1981}
(( segid " " and resid 192 and name H ))
( segid " " and resid 192 and name HD1%)
4.600 2.700 1.400 peak 1981 spectrum 1 weight 0.10000E+01 volume 0.12032E-02 ppm1 6.707 ppm2 0.884 CV 1
ASSI { 2040}
(( segid " " and resid 205 and name H ))
(( segid " " and resid 205 and name HB3 ))
3.600 1.600 1.600 peak 2040 spectrum 1 weight 0.10000E+01 volume 0.11012E-02 ppm1 6.381 ppm2 1.725 CV 1
ASSI { 2617}
(( segid " " and resid 191 and name H ))
(( segid " " and resid 191 and name HA3 ))
4.200 2.200 1.800 peak 2617 spectrum 1 weight 0.10000E+01 volume 0.45818E-03 ppm1 9.257 ppm2 4.236 CV 1
ASSI { 2548}
(( segid " " and resid 223 and name H ))
(( segid " " and resid 222 and name HB3 ))
3.400 1.500 1.500 peak 2548 spectrum 1 weight 0.10000E+01 volume 0.87209E-03 ppm1 8.424 ppm2 0.822 CV 1
ASSI { 1054}
(( segid " " and resid 410 and name H ))
(( segid " " and resid 409 and name HG ))
3.900 1.900 1.900 peak 1054 spectrum 1 weight 0.10000E+01 volume 0.81240E-03 ppm1 7.897 ppm2 1.403 CV 1
ASSI { 1691}
(( segid " " and resid 207 and name H ))
(( segid " " and resid 207 and name HB ))
3.800 1.800 1.800 peak 1691 spectrum 1 weight 0.10000E+01 volume 0.17480E-02 ppm1 6.898 ppm2 1.626 CV 1
ASSI { 1508}
(( segid " " and resid 292 and name H ))
(( segid " " and resid 289 and name H ))
3.200 3.200 2.800 peak 1508 spectrum 1 weight 0.10000E+01 volume 0.31573E-03 ppm1 7.810 ppm2 7.987 CV 1
ASSI { 2687}
(( segid " " and resid 242 and name H ))
( segid " " and resid 243 and name HD2%)
5.800 4.200 0.200 peak 2687 spectrum 1 weight 0.10000E+01 volume 0.44856E-03 ppm1 7.552 ppm2 0.169 CV 1
ASSI { 2149}
(( segid " " and resid 341 and name HD22))
(( segid " " and resid 337 and name HA ))
3.400 1.400 1.400 peak 2149 spectrum 1 weight 0.10000E+01 volume 0.13630E-02 ppm1 7.337 ppm2 4.995 CV 1
ASSI { 2470}
(( segid " " and resid 351 and name HE22))
(( segid " " and resid 351 and name HA ))
2.500 2.500 3.500 peak 2470 spectrum 1 weight 0.10000E+01 volume 0.14747E-02 ppm1 7.564 ppm2 3.839 CV 1
ASSI { 1187}
(( segid " " and resid 324 and name H ))
( segid " " and resid 323 and name HG1%)
3.500 1.600 1.600 peak 1187 spectrum 1 weight 0.10000E+01 volume 0.13611E-02 ppm1 8.503 ppm2 0.784 CV 1
ASSI { 693}
(( segid " " and resid 185 and name HD21))
(( segid " " and resid 188 and name HB3 ))
4.000 2.000 2.000 peak 693 spectrum 1 weight 0.10000E+01 volume 0.68534E-03 ppm1 6.790 ppm2 2.184 CV 1
OR { 693}
(( segid " " and resid 185 and name HD21))
(( segid " " and resid 188 and name HB2 ))
ASSI { 792}
(( segid " " and resid 257 and name H ))
( segid " " and resid 255 and name HD1%)
4.900 3.000 1.100 peak 792 spectrum 1 weight 0.10000E+01 volume 0.68534E-03 ppm1 7.442 ppm2 0.613 CV 1
ASSI { 1689}
(( segid " " and resid 256 and name H ))
(( segid " " and resid 256 and name HA ))
2.800 1.000 1.000 peak 1689 spectrum 1 weight 0.10000E+01 volume 0.18135E-02 ppm1 8.259 ppm2 4.129 CV 1
ASSI { 1770}
(( segid " " and resid 328 and name H ))
( segid " " and resid 329 and name HD1%)
5.700 4.100 0.300 peak 1770 spectrum 1 weight 0.10000E+01 volume 0.22524E-03 ppm1 7.191 ppm2 0.108 CV 1
ASSI { 3019}
(( segid " " and resid 410 and name H ))
(( segid " " and resid 410 and name HB3 ))
2.600 0.800 0.800 peak 3019 spectrum 1 weight 0.10000E+01 volume 0.20156E-02 ppm1 7.900 ppm2 2.727 CV 1
ASSI { 2239}
(( segid " " and resid 417 and name HE22))
(( segid " " and resid 417 and name H ))
4.000 2.000 2.000 peak 2239 spectrum 1 weight 0.10000E+01 volume 0.42547E-03 ppm1 6.740 ppm2 7.761 CV 1
ASSI { 1679}
(( segid " " and resid 418 and name H ))
(( segid " " and resid 419 and name H ))
3.500 1.500 1.500 peak 1679 spectrum 1 weight 0.10000E+01 volume 0.10646E-02 ppm1 8.186 ppm2 7.954 CV 1
ASSI { 1357}
(( segid " " and resid 239 and name H ))
(( segid " " and resid 236 and name H ))
5.200 3.400 0.800 peak 1357 spectrum 1 weight 0.10000E+01 volume 0.28877E-03 ppm1 7.093 ppm2 7.813 CV 1
ASSI { 2685}
(( segid " " and resid 253 and name H ))
(( segid " " and resid 252 and name HB2 ))
3.500 1.500 1.500 peak 2685 spectrum 1 weight 0.10000E+01 volume 0.40255E-02 ppm1 8.257 ppm2 3.716 CV 1
OR { 2685}
(( segid " " and resid 253 and name H ))
(( segid " " and resid 252 and name HB3 ))
ASSI { 2525}
(( segid " " and resid 319 and name H ))
(( segid " " and resid 322 and name HG13))
4.600 2.700 1.400 peak 2525 spectrum 1 weight 0.10000E+01 volume 0.38309E-03 ppm1 7.856 ppm2 0.185 CV 1
ASSI { 2464}
(( segid " " and resid 264 and name H ))
(( segid " " and resid 266 and name H ))
4.500 2.600 1.500 peak 2464 spectrum 1 weight 0.10000E+01 volume 0.35038E-03 ppm1 8.507 ppm2 8.221 CV 1
ASSI { 1466}
(( segid " " and resid 256 and name H ))
( segid " " and resid 258 and name HD% )
5.000 3.100 1.000 peak 1466 spectrum 1 weight 0.10000E+01 volume 0.41968E-03 ppm1 8.258 ppm2 7.092 CV 1
ASSI { 2352}
(( segid " " and resid 235 and name H ))
(( segid " " and resid 234 and name HB3 ))
3.600 1.600 1.600 peak 2352 spectrum 1 weight 0.10000E+01 volume 0.11358E-02 ppm1 7.893 ppm2 3.903 CV 1
ASSI { 2443}
(( segid " " and resid 196 and name H ))
(( segid " " and resid 195 and name HA ))
3.600 1.600 1.600 peak 2443 spectrum 1 weight 0.10000E+01 volume 0.16114E-02 ppm1 7.181 ppm2 3.896 CV 1
ASSI { 2151}
(( segid " " and resid 288 and name H ))
(( segid " " and resid 285 and name HA ))
3.000 1.100 1.100 peak 2151 spectrum 1 weight 0.10000E+01 volume 0.18539E-02 ppm1 7.478 ppm2 4.352 CV 1
ASSI { 1448}
(( segid " " and resid 433 and name HE22))
(( segid " " and resid 433 and name H ))
5.600 3.900 0.400 peak 1448 spectrum 1 weight 0.10000E+01 volume 0.31958E-03 ppm1 6.710 ppm2 8.302 CV 1
ASSI { 368}
(( segid " " and resid 417 and name HE22))
( segid " " and resid 416 and name HD2%)
4.900 3.000 1.100 peak 368 spectrum 1 weight 0.10000E+01 volume 0.28877E-03 ppm1 6.739 ppm2 0.661 CV 1
ASSI { 2848}
(( segid " " and resid 421 and name H ))
(( segid " " and resid 420 and name HA ))
1.900 0.500 0.500 peak 2848 spectrum 1 weight 0.10000E+01 volume 0.14198E-01 ppm1 8.385 ppm2 3.987 CV 1
ASSI { 2373}
(( segid " " and resid 340 and name HE22))
(( segid " " and resid 344 and name HG12))
5.300 3.500 0.700 peak 2373 spectrum 1 weight 0.10000E+01 volume 0.59871E-03 ppm1 7.417 ppm2 1.684 CV 1
ASSI { 3107}
(( segid " " and resid 421 and name H ))
(( segid " " and resid 421 and name HE3 ))
6.000 4.500 0.000 peak 3107 spectrum 1 weight 0.10000E+01 volume 0.41584E-03 ppm1 8.385 ppm2 2.905 CV 1
OR { 3107}
(( segid " " and resid 421 and name H ))
(( segid " " and resid 421 and name HE2 ))
ASSI { 2006}
(( segid " " and resid 345 and name H ))
(( segid " " and resid 344 and name HB ))
2.800 1.000 1.000 peak 2006 spectrum 1 weight 0.10000E+01 volume 0.13900E-02 ppm1 6.995 ppm2 1.901 CV 1
ASSI { 1432}
(( segid " " and resid 341 and name HD21))
(( segid " " and resid 341 and name HA ))
4.300 2.300 1.700 peak 1432 spectrum 1 weight 0.10000E+01 volume 0.59103E-03 ppm1 6.994 ppm2 4.417 CV 1
ASSI { 546}
(( segid " " and resid 375 and name HE22))
(( segid " " and resid 222 and name HG2 ))
3.300 1.400 1.400 peak 546 spectrum 1 weight 0.10000E+01 volume 0.56600E-03 ppm1 7.504 ppm2 0.415 CV 1
ASSI { 1244}
(( segid " " and resid 424 and name H ))
(( segid " " and resid 422 and name HB3 ))
3.800 1.800 1.800 peak 1244 spectrum 1 weight 0.10000E+01 volume 0.48515E-03 ppm1 8.282 ppm2 2.671 CV 1
ASSI { 2430}
(( segid " " and resid 443 and name H ))
(( segid " " and resid 443 and name HB2 ))
2.200 0.600 0.600 peak 2430 spectrum 1 weight 0.10000E+01 volume 0.80877E-02 ppm1 7.650 ppm2 1.660 CV 1
OR { 2430}
(( segid " " and resid 443 and name H ))
(( segid " " and resid 443 and name HB3 ))
OR { 2430}
(( segid " " and resid 443 and name H ))
(( segid " " and resid 443 and name HG ))
ASSI { 1484}
(( segid " " and resid 422 and name H ))
(( segid " " and resid 421 and name HB3 ))
3.500 1.500 1.500 peak 1484 spectrum 1 weight 0.10000E+01 volume 0.44873E-02 ppm1 8.204 ppm2 1.652 CV 1
OR { 1484}
(( segid " " and resid 422 and name H ))
(( segid " " and resid 421 and name HB2 ))
ASSI { 2130}
(( segid " " and resid 232 and name H ))
(( segid " " and resid 232 and name HD2 ))
5.300 3.500 0.700 peak 2130 spectrum 1 weight 0.10000E+01 volume 0.37925E-03 ppm1 8.795 ppm2 3.183 CV 1
ASSI { 2292}
(( segid " " and resid 295 and name H ))
(( segid " " and resid 293 and name H ))
4.700 2.700 1.300 peak 2292 spectrum 1 weight 0.10000E+01 volume 0.74118E-03 ppm1 7.394 ppm2 7.013 CV 1
ASSI { 1353}
(( segid " " and resid 313 and name H ))
( segid " " and resid 198 and name HG2%)
4.200 2.200 1.800 peak 1353 spectrum 1 weight 0.10000E+01 volume 0.12263E-02 ppm1 8.624 ppm2 0.614 CV 1
OR { 1353}
(( segid " " and resid 313 and name H ))
( segid " " and resid 198 and name HG1%)
ASSI { 212}
(( segid " " and resid 377 and name H ))
( segid " " and resid 204 and name HE% )
4.000 2.000 2.000 peak 212 spectrum 1 weight 0.10000E+01 volume 0.67765E-03 ppm1 8.239 ppm2 6.883 CV 1
OR { 212}
(( segid " " and resid 377 and name H ))
( segid " " and resid 204 and name HD% )
ASSI { 1963}
(( segid " " and resid 314 and name H ))
(( segid " " and resid 311 and name HB3 ))
4.700 2.800 1.300 peak 1963 spectrum 1 weight 0.10000E+01 volume 0.79509E-03 ppm1 7.344 ppm2 2.499 CV 1
ASSI { 1015}
(( segid " " and resid 205 and name H ))
(( segid " " and resid 203 and name HB2 ))
4.300 2.300 1.700 peak 1015 spectrum 1 weight 0.10000E+01 volume 0.44278E-03 ppm1 6.379 ppm2 2.122 CV 1
ASSI { 2095}
(( segid " " and resid 250 and name H ))
(( segid " " and resid 248 and name H ))
4.400 2.400 1.600 peak 2095 spectrum 1 weight 0.10000E+01 volume 0.49668E-03 ppm1 8.055 ppm2 8.883 CV 1
ASSI { 2775}
(( segid " " and resid 351 and name H ))
(( segid " " and resid 347 and name HG ))
4.700 2.700 1.300 peak 2775 spectrum 1 weight 0.10000E+01 volume 0.26759E-03 ppm1 7.884 ppm2 5.270 CV 1
ASSI { 1208}
(( segid " " and resid 224 and name H ))
(( segid " " and resid 223 and name HB3 ))
5.100 3.300 0.900 peak 1208 spectrum 1 weight 0.10000E+01 volume 0.30802E-03 ppm1 9.044 ppm2 2.918 CV 1
ASSI { 1860}
(( segid " " and resid 264 and name H ))
(( segid " " and resid 263 and name HA ))
3.600 1.700 1.700 peak 1860 spectrum 1 weight 0.10000E+01 volume 0.79315E-03 ppm1 8.514 ppm2 3.175 CV 1
ASSI { 1464}
(( segid " " and resid 306 and name H ))
( segid " " and resid 306 and name HD1%)
2.900 1.100 1.100 peak 1464 spectrum 1 weight 0.10000E+01 volume 0.17730E-02 ppm1 8.018 ppm2 0.383 CV 1
ASSI { 1372}
(( segid " " and resid 312 and name H ))
(( segid " " and resid 312 and name HA ))
2.900 1.000 1.000 peak 1372 spectrum 1 weight 0.10000E+01 volume 0.23371E-02 ppm1 8.788 ppm2 4.050 CV 1
ASSI { 2718}
(( segid " " and resid 233 and name H ))
(( segid " " and resid 232 and name HA ))
3.400 1.500 1.500 peak 2718 spectrum 1 weight 0.10000E+01 volume 0.15363E-02 ppm1 8.001 ppm2 4.455 CV 1
ASSI { 1809}
(( segid " " and resid 340 and name HE22))
(( segid " " and resid 341 and name H ))
5.900 4.300 0.100 peak 1809 spectrum 1 weight 0.10000E+01 volume 0.19444E-03 ppm1 7.411 ppm2 8.538 CV 1
ASSI { 480}
(( segid " " and resid 374 and name H ))
(( segid " " and resid 374 and name HB2 ))
2.800 1.000 1.000 peak 480 spectrum 1 weight 0.10000E+01 volume 0.21177E-02 ppm1 6.330 ppm2 1.627 CV 1
OR { 480}
(( segid " " and resid 374 and name H ))
(( segid " " and resid 374 and name HD2 ))
OR { 480}
(( segid " " and resid 374 and name H ))
(( segid " " and resid 374 and name HD3 ))
ASSI { 2984}
(( segid " " and resid 433 and name H ))
(( segid " " and resid 430 and name HA ))
3.900 1.900 1.900 peak 2984 spectrum 1 weight 0.10000E+01 volume 0.36962E-03 ppm1 8.309 ppm2 4.423 CV 1
ASSI { 2135}
(( segid " " and resid 335 and name H ))
(( segid " " and resid 333 and name HB2 ))
4.500 2.500 1.500 peak 2135 spectrum 1 weight 0.10000E+01 volume 0.54096E-03 ppm1 8.881 ppm2 1.594 CV 1
ASSI { 2090}
(( segid " " and resid 388 and name H ))
(( segid " " and resid 382 and name HD1 ))
3.200 3.200 2.800 peak 2090 spectrum 1 weight 0.10000E+01 volume 0.34460E-03 ppm1 8.230 ppm2 6.935 CV 1
ASSI { 1845}
(( segid " " and resid 277 and name H ))
(( segid " " and resid 276 and name HG2 ))
4.200 2.200 1.800 peak 1845 spectrum 1 weight 0.10000E+01 volume 0.29070E-03 ppm1 8.670 ppm2 2.380 CV 1
ASSI { 2026}
(( segid " " and resid 208 and name H ))
(( segid " " and resid 207 and name HG13))
4.400 2.400 1.600 peak 2026 spectrum 1 weight 0.10000E+01 volume 0.28107E-03 ppm1 8.273 ppm2 1.026 CV 1
ASSI { 2810}
(( segid " " and resid 241 and name H ))
(( segid " " and resid 241 and name HB3 ))
3.200 1.200 1.200 peak 2810 spectrum 1 weight 0.10000E+01 volume 0.28723E-02 ppm1 8.375 ppm2 2.623 CV 1
ASSI { 1681}
(( segid " " and resid 382 and name HE1 ))
(( segid " " and resid 386 and name HA ))
5.300 3.500 0.700 peak 1681 spectrum 1 weight 0.10000E+01 volume 0.27722E-03 ppm1 9.607 ppm2 4.472 CV 1
ASSI { 1228}
(( segid " " and resid 319 and name H ))
(( segid " " and resid 318 and name HB ))
3.700 1.700 1.700 peak 1228 spectrum 1 weight 0.10000E+01 volume 0.14150E-02 ppm1 7.859 ppm2 1.369 CV 1
ASSI { 1493}
(( segid " " and resid 226 and name H ))
(( segid " " and resid 224 and name H ))
4.700 2.700 1.300 peak 1493 spectrum 1 weight 0.10000E+01 volume 0.34075E-03 ppm1 7.440 ppm2 9.046 CV 1
ASSI { 1477}
(( segid " " and resid 192 and name H ))
(( segid " " and resid 191 and name HA2 ))
3.800 1.800 1.800 peak 1477 spectrum 1 weight 0.10000E+01 volume 0.55253E-03 ppm1 6.708 ppm2 4.129 CV 1
ASSI { 494}
(( segid " " and resid 395 and name HE22))
(( segid " " and resid 395 and name HB2 ))
4.400 2.400 1.600 peak 494 spectrum 1 weight 0.10000E+01 volume 0.14227E-02 ppm1 6.979 ppm2 2.040 CV 1
OR { 494}
(( segid " " and resid 395 and name HE22))
(( segid " " and resid 395 and name HB3 ))
ASSI { 1511}
(( segid " " and resid 258 and name H ))
(( segid " " and resid 255 and name HB3 ))
3.900 1.900 1.900 peak 1511 spectrum 1 weight 0.10000E+01 volume 0.94334E-03 ppm1 8.132 ppm2 1.091 CV 1
ASSI { 2869}
(( segid " " and resid 229 and name H ))
(( segid " " and resid 229 and name HA2 ))
3.100 1.200 1.200 peak 2869 spectrum 1 weight 0.10000E+01 volume 0.77390E-03 ppm1 9.625 ppm2 3.827 CV 1
ASSI { 1633}
(( segid " " and resid 336 and name H ))
(( segid " " and resid 335 and name HA ))
3.400 1.400 1.400 peak 1633 spectrum 1 weight 0.10000E+01 volume 0.97605E-03 ppm1 9.131 ppm2 4.187 CV 1
ASSI { 1683}
(( segid " " and resid 341 and name HD22))
(( segid " " and resid 337 and name HG3 ))
3.200 1.300 1.300 peak 1683 spectrum 1 weight 0.10000E+01 volume 0.31573E-03 ppm1 7.337 ppm2 1.972 CV 1
ASSI { 1976}
(( segid " " and resid 332 and name H ))
(( segid " " and resid 332 and name HB3 ))
3.100 1.200 1.200 peak 1976 spectrum 1 weight 0.10000E+01 volume 0.27395E-02 ppm1 7.438 ppm2 2.623 CV 1
ASSI { 460}
(( segid " " and resid 267 and name H ))
(( segid " " and resid 216 and name HB3 ))
4.400 2.400 1.600 peak 460 spectrum 1 weight 0.10000E+01 volume 0.56215E-03 ppm1 8.066 ppm2 2.781 CV 1
OR { 460}
(( segid " " and resid 267 and name H ))
(( segid " " and resid 216 and name HG ))
ASSI { 2736}
(( segid " " and resid 340 and name HE21))
(( segid " " and resid 340 and name HB3 ))
2.700 0.900 0.900 peak 2736 spectrum 1 weight 0.10000E+01 volume 0.48128E-03 ppm1 6.784 ppm2 2.042 CV 1
ASSI { 2963}
(( segid " " and resid 199 and name H ))
(( segid " " and resid 199 and name HA ))
2.700 0.900 0.900 peak 2963 spectrum 1 weight 0.10000E+01 volume 0.32997E-02 ppm1 7.772 ppm2 3.814 CV 1
ASSI { 2842}
(( segid " " and resid 293 and name H ))
( segid " " and resid 294 and name HG2%)
6.000 4.800 0.000 peak 2842 spectrum 1 weight 0.10000E+01 volume 0.41968E-03 ppm1 7.005 ppm2 1.225 CV 1
ASSI { 3191}
(( segid " " and resid 319 and name H ))
(( segid " " and resid 320 and name H ))
2.900 1.000 1.000 peak 3191 spectrum 1 weight 0.10000E+01 volume 0.10126E-02 ppm1 7.859 ppm2 8.420 CV 1
ASSI { 2138}
(( segid " " and resid 396 and name H ))
(( segid " " and resid 395 and name HG3 ))
4.300 2.300 1.700 peak 2138 spectrum 1 weight 0.10000E+01 volume 0.70846E-03 ppm1 8.687 ppm2 2.450 CV 1
ASSI { 3054}
(( segid " " and resid 369 and name H ))
(( segid " " and resid 368 and name HA ))
3.400 1.500 1.500 peak 3054 spectrum 1 weight 0.10000E+01 volume 0.17326E-02 ppm1 7.756 ppm2 5.174 CV 1
ASSI { 1828}
(( segid " " and resid 303 and name H ))
(( segid " " and resid 303 and name HB2 ))
2.500 0.800 0.800 peak 1828 spectrum 1 weight 0.10000E+01 volume 0.12976E-02 ppm1 8.744 ppm2 3.475 CV 1
ASSI { 2194}
(( segid " " and resid 303 and name H ))
(( segid " " and resid 302 and name HA ))
3.700 1.700 1.700 peak 2194 spectrum 1 weight 0.10000E+01 volume 0.68149E-03 ppm1 8.741 ppm2 4.323 CV 1
ASSI { 1870}
(( segid " " and resid 369 and name H ))
( segid " " and resid 371 and name HG2%)
3.900 1.900 1.900 peak 1870 spectrum 1 weight 0.10000E+01 volume 0.14169E-02 ppm1 7.757 ppm2 0.963 CV 1
ASSI { 2702}
(( segid " " and resid 242 and name H ))
(( segid " " and resid 241 and name HB3 ))
3.200 1.300 1.300 peak 2702 spectrum 1 weight 0.10000E+01 volume 0.19617E-02 ppm1 7.546 ppm2 2.614 CV 1
ASSI { 1331}
(( segid " " and resid 282 and name H ))
( segid " " and resid 280 and name HG2%)
4.400 2.400 1.600 peak 1331 spectrum 1 weight 0.10000E+01 volume 0.14958E-02 ppm1 8.701 ppm2 1.132 CV 1
ASSI { 2978}
(( segid " " and resid 353 and name H ))
( segid " " and resid 356 and name HG1%)
5.100 3.200 0.900 peak 2978 spectrum 1 weight 0.10000E+01 volume 0.11801E-02 ppm1 8.951 ppm2 0.798 CV 1
ASSI { 824}
(( segid " " and resid 351 and name HE21))
(( segid " " and resid 272 and name HA ))
4.200 2.200 1.800 peak 824 spectrum 1 weight 0.10000E+01 volume 0.64109E-03 ppm1 6.759 ppm2 4.276 CV 1
ASSI { 1614}
(( segid " " and resid 424 and name H ))
(( segid " " and resid 422 and name HA ))
4.000 2.000 2.000 peak 1614 spectrum 1 weight 0.10000E+01 volume 0.14458E-02 ppm1 8.282 ppm2 4.595 CV 1
ASSI { 1215}
(( segid " " and resid 419 and name H ))
(( segid " " and resid 416 and name HA ))
5.400 3.700 0.600 peak 1215 spectrum 1 weight 0.10000E+01 volume 0.33113E-03 ppm1 7.959 ppm2 4.307 CV 1
ASSI { 1971}
(( segid " " and resid 388 and name H ))
(( segid " " and resid 388 and name HG3 ))
4.000 2.000 2.000 peak 1971 spectrum 1 weight 0.10000E+01 volume 0.13264E-02 ppm1 8.234 ppm2 2.278 CV 1
ASSI { 2801}
(( segid " " and resid 232 and name H ))
(( segid " " and resid 232 and name HB3 ))
3.200 1.300 1.300 peak 2801 spectrum 1 weight 0.10000E+01 volume 0.13803E-02 ppm1 8.794 ppm2 1.933 CV 1
ASSI { 1424}
(( segid " " and resid 300 and name H ))
(( segid " " and resid 298 and name H ))
3.900 1.900 1.900 peak 1424 spectrum 1 weight 0.10000E+01 volume 0.51593E-03 ppm1 7.919 ppm2 7.344 CV 1
ASSI { 3063}
(( segid " " and resid 219 and name H ))
(( segid " " and resid 218 and name HB2 ))
4.100 2.100 1.900 peak 3063 spectrum 1 weight 0.10000E+01 volume 0.14689E-02 ppm1 7.701 ppm2 2.741 CV 1
ASSI { 2060}
(( segid " " and resid 192 and name H ))
(( segid " " and resid 192 and name HG13))
3.200 1.300 1.300 peak 2060 spectrum 1 weight 0.10000E+01 volume 0.10531E-02 ppm1 6.709 ppm2 1.601 CV 1
ASSI { 2451}
(( segid " " and resid 376 and name H ))
(( segid " " and resid 376 and name HB ))
2.900 1.000 1.000 peak 2451 spectrum 1 weight 0.10000E+01 volume 0.19752E-02 ppm1 9.516 ppm2 2.043 CV 1
ASSI { 3043}
(( segid " " and resid 265 and name H ))
(( segid " " and resid 262 and name HA ))
3.600 1.600 1.600 peak 3043 spectrum 1 weight 0.10000E+01 volume 0.67571E-03 ppm1 7.754 ppm2 3.623 CV 1
ASSI { 2575}
(( segid " " and resid 263 and name H ))
(( segid " " and resid 263 and name HA ))
3.200 1.200 1.200 peak 2575 spectrum 1 weight 0.10000E+01 volume 0.94718E-03 ppm1 7.123 ppm2 3.170 CV 1
ASSI { 1152}
(( segid " " and resid 326 and name H ))
( segid " " and resid 329 and name HD1%)
5.300 3.500 0.700 peak 1152 spectrum 1 weight 0.10000E+01 volume 0.48515E-03 ppm1 8.922 ppm2 0.132 CV 1
ASSI { 369}
(( segid " " and resid 235 and name H ))
(( segid " " and resid 261 and name HB2 ))
4.400 2.400 1.600 peak 369 spectrum 1 weight 0.10000E+01 volume 0.32343E-03 ppm1 7.889 ppm2 2.245 CV 1
ASSI { 2584}
(( segid " " and resid 255 and name H ))
(( segid " " and resid 255 and name HB2 ))
2.700 0.900 0.900 peak 2584 spectrum 1 weight 0.10000E+01 volume 0.28839E-02 ppm1 8.608 ppm2 1.694 CV 1
OR { 2584}
(( segid " " and resid 255 and name H ))
(( segid " " and resid 255 and name HG ))
ASSI { 2510}
(( segid " " and resid 209 and name H ))
(( segid " " and resid 208 and name HB2 ))
4.300 2.300 1.700 peak 2510 spectrum 1 weight 0.10000E+01 volume 0.80855E-03 ppm1 7.831 ppm2 1.308 CV 1
ASSI { 1965}
(( segid " " and resid 199 and name H ))
(( segid " " and resid 198 and name HA ))
3.400 1.400 1.400 peak 1965 spectrum 1 weight 0.10000E+01 volume 0.11628E-02 ppm1 7.772 ppm2 2.884 CV 1
ASSI { 1390}
(( segid " " and resid 221 and name H ))
(( segid " " and resid 219 and name HB2 ))
4.300 2.300 1.700 peak 1390 spectrum 1 weight 0.10000E+01 volume 0.40237E-03 ppm1 8.740 ppm2 3.182 CV 1
ASSI { 2368}
(( segid " " and resid 363 and name H ))
( segid " " and resid 300 and name HG1%)
5.000 3.100 1.000 peak 2368 spectrum 1 weight 0.10000E+01 volume 0.36962E-03 ppm1 7.263 ppm2 0.077 CV 1
ASSI { 1556}
(( segid " " and resid 395 and name HE22))
(( segid " " and resid 395 and name H ))
6.000 5.800 0.000 peak 1556 spectrum 1 weight 0.10000E+01 volume 0.21369E-03 ppm1 6.984 ppm2 9.091 CV 1
ASSI { 1425}
(( segid " " and resid 314 and name H ))
(( segid " " and resid 311 and name HB2 ))
2.500 0.800 0.800 peak 1425 spectrum 1 weight 0.10000E+01 volume 0.23083E-02 ppm1 7.344 ppm2 2.089 CV 1
ASSI { 380}
(( segid " " and resid 245 and name H ))
( segid " " and resid 243 and name HD1%)
6.000 4.700 0.000 peak 380 spectrum 1 weight 0.10000E+01 volume 0.30417E-03 ppm1 7.531 ppm2 0.020 CV 1
ASSI { 2626}
(( segid " " and resid 395 and name HE21))
(( segid " " and resid 395 and name HG3 ))
2.900 1.000 1.000 peak 2626 spectrum 1 weight 0.10000E+01 volume 0.28069E-02 ppm1 7.774 ppm2 2.452 CV 1
ASSI { 3021}
(( segid " " and resid 363 and name H ))
(( segid " " and resid 363 and name HB2 ))
3.100 1.200 1.200 peak 3021 spectrum 1 weight 0.10000E+01 volume 0.11339E-02 ppm1 7.266 ppm2 3.206 CV 1
ASSI { 868}
(( segid " " and resid 200 and name H ))
(( segid " " and resid 201 and name HA ))
6.000 4.500 0.000 peak 868 spectrum 1 weight 0.10000E+01 volume 0.23680E-03 ppm1 7.620 ppm2 4.957 CV 1
ASSI { 1453}
(( segid " " and resid 410 and name H ))
(( segid " " and resid 409 and name HA ))
3.500 1.500 1.500 peak 1453 spectrum 1 weight 0.10000E+01 volume 0.99530E-03 ppm1 7.890 ppm2 3.694 CV 1
ASSI { 2179}
(( segid " " and resid 344 and name H ))
(( segid " " and resid 344 and name HG12))
3.500 1.500 1.500 peak 2179 spectrum 1 weight 0.10000E+01 volume 0.27799E-02 ppm1 7.703 ppm2 1.682 CV 1
ASSI { 1966}
(( segid " " and resid 256 and name H ))
(( segid " " and resid 255 and name HA ))
3.700 1.800 1.800 peak 1966 spectrum 1 weight 0.10000E+01 volume 0.42737E-03 ppm1 8.262 ppm2 3.960 CV 1
ASSI { 2977}
(( segid " " and resid 341 and name HD22))
(( segid " " and resid 341 and name HB2 ))
3.600 1.600 1.600 peak 2977 spectrum 1 weight 0.10000E+01 volume 0.24507E-02 ppm1 7.338 ppm2 2.817 CV 1
OR { 2977}
(( segid " " and resid 341 and name HD22))
(( segid " " and resid 341 and name HB3 ))
ASSI { 3032}
(( segid " " and resid 395 and name HE22))
( segid " " and resid 446 and name HB% )
4.100 2.100 1.900 peak 3032 spectrum 1 weight 0.10000E+01 volume 0.46781E-03 ppm1 6.978 ppm2 1.287 CV 1
ASSI { 2286}
(( segid " " and resid 351 and name HE21))
(( segid " " and resid 272 and name HD3 ))
2.900 2.900 3.100 peak 2286 spectrum 1 weight 0.10000E+01 volume 0.57946E-03 ppm1 6.758 ppm2 3.237 CV 1
OR { 2286}
(( segid " " and resid 351 and name HE21))
(( segid " " and resid 272 and name HD2 ))
ASSI { 1174}
(( segid " " and resid 371 and name H ))
(( segid " " and resid 371 and name HA ))
2.600 0.800 0.800 peak 1174 spectrum 1 weight 0.10000E+01 volume 0.30071E-02 ppm1 7.538 ppm2 3.724 CV 1
ASSI { 131}
(( segid " " and resid 378 and name H ))
(( segid " " and resid 378 and name HB3 ))
3.000 1.100 1.100 peak 131 spectrum 1 weight 0.10000E+01 volume 0.27568E-02 ppm1 8.585 ppm2 1.642 CV 1
OR { 131}
(( segid " " and resid 378 and name H ))
(( segid " " and resid 378 and name HB2 ))
OR { 131}
(( segid " " and resid 378 and name H ))
(( segid " " and resid 378 and name HD2 ))
OR { 131}
(( segid " " and resid 378 and name H ))
(( segid " " and resid 378 and name HD3 ))
ASSI { 2550}
(( segid " " and resid 320 and name H ))
(( segid " " and resid 320 and name HA ))
3.100 1.200 1.200 peak 2550 spectrum 1 weight 0.10000E+01 volume 0.10319E-02 ppm1 8.417 ppm2 3.834 CV 1
ASSI { 1805}
(( segid " " and resid 315 and name H ))
(( segid " " and resid 314 and name HB2 ))
2.800 0.900 0.900 peak 1805 spectrum 1 weight 0.10000E+01 volume 0.12648E-02 ppm1 8.320 ppm2 2.835 CV 1
ASSI { 3034}
(( segid " " and resid 216 and name H ))
(( segid " " and resid 216 and name HB3 ))
2.900 1.100 1.100 peak 3034 spectrum 1 weight 0.10000E+01 volume 0.32843E-02 ppm1 7.637 ppm2 2.766 CV 1
OR { 3034}
(( segid " " and resid 216 and name H ))
(( segid " " and resid 216 and name HG ))
ASSI { 2507}
(( segid " " and resid 354 and name HD22))
(( segid " " and resid 354 and name H ))
6.000 4.700 0.000 peak 2507 spectrum 1 weight 0.10000E+01 volume 0.29647E-03 ppm1 6.454 ppm2 8.944 CV 1
ASSI { 2176}
(( segid " " and resid 300 and name H ))
(( segid " " and resid 301 and name H ))
2.600 0.900 0.900 peak 2176 spectrum 1 weight 0.10000E+01 volume 0.15940E-02 ppm1 7.921 ppm2 8.074 CV 1
ASSI { 1926}
(( segid " " and resid 320 and name HE1 ))
(( segid " " and resid 373 and name HA ))
3.900 1.900 1.900 peak 1926 spectrum 1 weight 0.10000E+01 volume 0.59103E-03 ppm1 10.122 ppm2 2.333 CV 1
ASSI { 2087}
(( segid " " and resid 324 and name H ))
( segid " " and resid 217 and name HD1%)
5.000 3.100 1.000 peak 2087 spectrum 1 weight 0.10000E+01 volume 0.57368E-03 ppm1 8.499 ppm2 -0.038 CV 1
ASSI { 1274}
(( segid " " and resid 319 and name H ))
(( segid " " and resid 316 and name HA ))
3.800 1.800 1.800 peak 1274 spectrum 1 weight 0.10000E+01 volume 0.88365E-03 ppm1 7.859 ppm2 3.581 CV 1
ASSI { 1434}
(( segid " " and resid 430 and name HE1 ))
(( segid " " and resid 426 and name HG3 ))
2.400 2.400 3.600 peak 1434 spectrum 1 weight 0.10000E+01 volume 0.16749E-02 ppm1 10.080 ppm2 1.989 CV 1
ASSI { 1755}
(( segid " " and resid 398 and name H ))
(( segid " " and resid 398 and name HG12))
3.700 1.700 1.700 peak 1755 spectrum 1 weight 0.10000E+01 volume 0.17750E-02 ppm1 8.685 ppm2 0.575 CV 1
OR { 1755}
(( segid " " and resid 398 and name H ))
( segid " " and resid 398 and name HD1%)
ASSI { 2112}
(( segid " " and resid 246 and name H ))
( segid " " and resid 253 and name HG2%)
5.100 3.200 0.900 peak 2112 spectrum 1 weight 0.10000E+01 volume 0.54675E-03 ppm1 7.446 ppm2 0.626 CV 1
ASSI { 2016}
(( segid " " and resid 399 and name H ))
(( segid " " and resid 399 and name HG2 ))
3.400 1.400 1.400 peak 2016 spectrum 1 weight 0.10000E+01 volume 0.16499E-02 ppm1 8.334 ppm2 1.356 CV 1
ASSI { 2240}
(( segid " " and resid 300 and name H ))
(( segid " " and resid 299 and name HB2 ))
2.300 0.700 0.700 peak 2240 spectrum 1 weight 0.10000E+01 volume 0.15575E-02 ppm1 7.922 ppm2 1.478 CV 1
ASSI { 100}
(( segid " " and resid 318 and name H ))
(( segid " " and resid 316 and name HA ))
4.800 2.900 1.200 peak 100 spectrum 1 weight 0.10000E+01 volume 0.27144E-03 ppm1 8.044 ppm2 3.574 CV 1
ASSI { 2422}
(( segid " " and resid 262 and name H ))
(( segid " " and resid 264 and name H ))
4.000 2.000 2.000 peak 2422 spectrum 1 weight 0.10000E+01 volume 0.59103E-03 ppm1 7.885 ppm2 8.485 CV 1
ASSI { 2723}
(( segid " " and resid 370 and name HD21))
(( segid " " and resid 370 and name HD22))
1.200 0.200 1.000 peak 2723 spectrum 1 weight 0.10000E+01 volume 0.73283E-01 ppm1 6.836 ppm2 7.518 CV 1
ASSI { 2973}
(( segid " " and resid 341 and name H ))
(( segid " " and resid 341 and name HB3 ))
2.400 0.700 0.700 peak 2973 spectrum 1 weight 0.10000E+01 volume 0.37174E-02 ppm1 8.540 ppm2 2.813 CV 1
OR { 2973}
(( segid " " and resid 341 and name H ))
(( segid " " and resid 341 and name HB2 ))
ASSI { 2992}
(( segid " " and resid 369 and name H ))
(( segid " " and resid 370 and name HD21))
4.700 2.800 1.300 peak 2992 spectrum 1 weight 0.10000E+01 volume 0.36772E-03 ppm1 7.760 ppm2 6.785 CV 1
ASSI { 2198}
(( segid " " and resid 201 and name H ))
(( segid " " and resid 200 and name HA ))
4.100 2.100 1.900 peak 2198 spectrum 1 weight 0.10000E+01 volume 0.48515E-03 ppm1 7.506 ppm2 4.156 CV 1
ASSI { 1849}
(( segid " " and resid 323 and name H ))
(( segid " " and resid 323 and name HB ))
2.400 0.700 0.700 peak 1849 spectrum 1 weight 0.10000E+01 volume 0.20734E-02 ppm1 7.785 ppm2 1.768 CV 1
ASSI { 2432}
(( segid " " and resid 416 and name H ))
(( segid " " and resid 415 and name HB2 ))
3.700 1.700 1.700 peak 2432 spectrum 1 weight 0.10000E+01 volume 0.93562E-03 ppm1 7.932 ppm2 2.764 CV 1
ASSI { 2314}
(( segid " " and resid 195 and name H ))
(( segid " " and resid 198 and name H ))
4.700 2.700 1.300 peak 2314 spectrum 1 weight 0.10000E+01 volume 0.27722E-03 ppm1 8.995 ppm2 8.596 CV 1
ASSI { 3150}
(( segid " " and resid 319 and name H ))
(( segid " " and resid 319 and name HB3 ))
3.700 1.700 1.700 peak 3150 spectrum 1 weight 0.10000E+01 volume 0.13746E-02 ppm1 7.858 ppm2 3.096 CV 1
ASSI { 2486}
(( segid " " and resid 244 and name H ))
(( segid " " and resid 244 and name HG2 ))
4.300 2.300 1.700 peak 2486 spectrum 1 weight 0.10000E+01 volume 0.34653E-03 ppm1 8.559 ppm2 0.410 CV 1
ASSI { 2885}
(( segid " " and resid 270 and name H ))
(( segid " " and resid 268 and name H ))
3.900 1.900 1.900 peak 2885 spectrum 1 weight 0.10000E+01 volume 0.66224E-03 ppm1 8.538 ppm2 7.873 CV 1
ASSI { 1156}
(( segid " " and resid 380 and name H ))
(( segid " " and resid 379 and name HB3 ))
4.400 2.400 1.600 peak 1156 spectrum 1 weight 0.10000E+01 volume 0.52940E-03 ppm1 9.050 ppm2 1.644 CV 1
ASSI { 1523}
(( segid " " and resid 220 and name H ))
( segid " " and resid 219 and name HD% )
3.800 1.800 1.800 peak 1523 spectrum 1 weight 0.10000E+01 volume 0.10049E-02 ppm1 8.676 ppm2 6.898 CV 1
ASSI { 465}
(( segid " " and resid 421 and name H ))
( segid " " and resid 420 and name HG2%)
2.800 0.900 0.900 peak 465 spectrum 1 weight 0.10000E+01 volume 0.49763E-02 ppm1 8.385 ppm2 0.811 CV 1
ASSI { 41}
(( segid " " and resid 295 and name H ))
(( segid " " and resid 298 and name HG2 ))
2.800 1.000 1.000 peak 41 spectrum 1 weight 0.10000E+01 volume 0.22351E-02 ppm1 7.396 ppm2 2.175 CV 1
OR { 41}
(( segid " " and resid 295 and name H ))
(( segid " " and resid 298 and name HG3 ))
ASSI { 2997}
(( segid " " and resid 303 and name H ))
( segid " " and resid 303 and name HE% )
5.100 3.200 0.900 peak 2997 spectrum 1 weight 0.10000E+01 volume 0.70074E-03 ppm1 8.743 ppm2 6.821 CV 1
ASSI { 831}
(( segid " " and resid 351 and name HE22))
(( segid " " and resid 272 and name HA ))
3.600 1.600 1.600 peak 831 spectrum 1 weight 0.10000E+01 volume 0.66803E-03 ppm1 7.560 ppm2 4.275 CV 1
ASSI { 629}
(( segid " " and resid 330 and name H ))
( segid " " and resid 225 and name HE% )
4.900 2.900 1.100 peak 629 spectrum 1 weight 0.10000E+01 volume 0.57368E-03 ppm1 8.627 ppm2 1.885 CV 1
ASSI { 1463}
(( segid " " and resid 320 and name H ))
( segid " " and resid 371 and name HG2%)
5.000 3.200 1.000 peak 1463 spectrum 1 weight 0.10000E+01 volume 0.64878E-03 ppm1 8.420 ppm2 0.950 CV 1
ASSI { 2388}
(( segid " " and resid 274 and name H ))
(( segid " " and resid 273 and name HB2 ))
3.500 1.500 1.500 peak 2388 spectrum 1 weight 0.10000E+01 volume 0.87209E-03 ppm1 7.025 ppm2 2.605 CV 1
ASSI { 1076}
(( segid " " and resid 319 and name H ))
(( segid " " and resid 320 and name HD1 ))
4.600 2.600 1.400 peak 1076 spectrum 1 weight 0.10000E+01 volume 0.70846E-03 ppm1 7.859 ppm2 7.250 CV 1
ASSI { 1246}
(( segid " " and resid 223 and name H ))
(( segid " " and resid 223 and name HA ))
3.300 1.300 1.300 peak 1246 spectrum 1 weight 0.10000E+01 volume 0.91637E-03 ppm1 8.420 ppm2 4.678 CV 1
ASSI { 1549}
(( segid " " and resid 410 and name H ))
(( segid " " and resid 409 and name HB2 ))
3.600 1.600 1.600 peak 1549 spectrum 1 weight 0.10000E+01 volume 0.11974E-02 ppm1 7.896 ppm2 1.599 CV 1
ASSI { 551}
(( segid " " and resid 254 and name HD21))
(( segid " " and resid 256 and name HB3 ))
5.300 3.500 0.700 peak 551 spectrum 1 weight 0.10000E+01 volume 0.16614E-02 ppm1 7.496 ppm2 1.938 CV 1
ASSI { 1230}
(( segid " " and resid 205 and name H ))
(( segid " " and resid 206 and name HA2 ))
5.500 3.800 0.500 peak 1230 spectrum 1 weight 0.10000E+01 volume 0.42547E-03 ppm1 6.382 ppm2 3.590 CV 1
ASSI { 2653}
(( segid " " and resid 352 and name H ))
(( segid " " and resid 352 and name HA ))
2.800 1.000 1.000 peak 2653 spectrum 1 weight 0.10000E+01 volume 0.16826E-02 ppm1 7.054 ppm2 4.161 CV 1
ASSI { 867}
(( segid " " and resid 245 and name H ))
(( segid " " and resid 247 and name H ))
4.300 2.300 1.700 peak 867 spectrum 1 weight 0.10000E+01 volume 0.54675E-03 ppm1 7.530 ppm2 8.421 CV 1
ASSI { 2809}
(( segid " " and resid 237 and name H ))
(( segid " " and resid 236 and name HA ))
2.800 1.000 1.000 peak 2809 spectrum 1 weight 0.10000E+01 volume 0.13553E-02 ppm1 8.770 ppm2 3.994 CV 1
ASSI { 736}
(( segid " " and resid 266 and name H ))
( segid " " and resid 243 and name HD1%)
4.300 2.300 1.700 peak 736 spectrum 1 weight 0.10000E+01 volume 0.49090E-03 ppm1 8.236 ppm2 0.058 CV 1
ASSI { 2174}
(( segid " " and resid 211 and name H ))
(( segid " " and resid 210 and name HA ))
2.600 0.800 0.800 peak 2174 spectrum 1 weight 0.10000E+01 volume 0.10107E-02 ppm1 7.467 ppm2 4.036 CV 1
ASSI { 1962}
(( segid " " and resid 277 and name HD22))
(( segid " " and resid 277 and name HA ))
4.800 2.900 1.200 peak 1962 spectrum 1 weight 0.10000E+01 volume 0.50246E-03 ppm1 6.134 ppm2 4.520 CV 1
ASSI { 2410}
(( segid " " and resid 296 and name H ))
(( segid " " and resid 296 and name HB2 ))
3.500 1.500 1.500 peak 2410 spectrum 1 weight 0.10000E+01 volume 0.44662E-03 ppm1 8.932 ppm2 2.127 CV 1
ASSI { 241}
(( segid " " and resid 340 and name HE22))
(( segid " " and resid 344 and name HG13))
4.400 2.400 1.600 peak 241 spectrum 1 weight 0.10000E+01 volume 0.66224E-03 ppm1 7.419 ppm2 1.231 CV 1
ASSI { 3118}
(( segid " " and resid 228 and name H ))
(( segid " " and resid 227 and name HA ))
2.200 0.600 0.600 peak 3118 spectrum 1 weight 0.10000E+01 volume 0.61200E-02 ppm1 8.444 ppm2 4.223 CV 1
ASSI { 1316}
(( segid " " and resid 304 and name H ))
(( segid " " and resid 303 and name HB2 ))
3.100 1.200 1.200 peak 1316 spectrum 1 weight 0.10000E+01 volume 0.68534E-03 ppm1 8.669 ppm2 3.472 CV 1
ASSI { 490}
(( segid " " and resid 313 and name H ))
(( segid " " and resid 311 and name HB3 ))
4.300 2.300 1.700 peak 490 spectrum 1 weight 0.10000E+01 volume 0.63915E-03 ppm1 8.624 ppm2 2.507 CV 1
ASSI { 1195}
(( segid " " and resid 316 and name H ))
(( segid " " and resid 316 and name HB3 ))
2.600 0.800 0.800 peak 1195 spectrum 1 weight 0.10000E+01 volume 0.29686E-02 ppm1 8.715 ppm2 1.607 CV 1
OR { 1195}
(( segid " " and resid 316 and name H ))
(( segid " " and resid 316 and name HB2 ))
OR { 1195}
(( segid " " and resid 316 and name H ))
(( segid " " and resid 316 and name HG ))
ASSI { 1836}
(( segid " " and resid 312 and name H ))
(( segid " " and resid 311 and name HA ))
2.400 0.700 0.700 peak 1836 spectrum 1 weight 0.10000E+01 volume 0.43008E-02 ppm1 8.789 ppm2 4.473 CV 1
ASSI { 2351}
(( segid " " and resid 290 and name H ))
(( segid " " and resid 290 and name HA ))
2.400 0.700 0.700 peak 2351 spectrum 1 weight 0.10000E+01 volume 0.35598E-02 ppm1 7.821 ppm2 4.058 CV 1
ASSI { 2293}
(( segid " " and resid 391 and name H ))
(( segid " " and resid 391 and name HB3 ))
3.300 1.400 1.400 peak 2293 spectrum 1 weight 0.10000E+01 volume 0.20541E-02 ppm1 8.203 ppm2 1.525 CV 1
ASSI { 2521}
(( segid " " and resid 358 and name H ))
(( segid " " and resid 357 and name HB3 ))
3.300 1.400 1.400 peak 2521 spectrum 1 weight 0.10000E+01 volume 0.12032E-02 ppm1 8.550 ppm2 1.774 CV 1
ASSI { 3101}
(( segid " " and resid 241 and name H ))
( segid " " and resid 240 and name HG1%)
3.300 1.300 1.300 peak 3101 spectrum 1 weight 0.10000E+01 volume 0.40660E-02 ppm1 8.372 ppm2 1.060 CV 1
ASSI { 1209}
(( segid " " and resid 280 and name H ))
(( segid " " and resid 279 and name HB2 ))
3.500 1.500 1.500 peak 1209 spectrum 1 weight 0.10000E+01 volume 0.57178E-03 ppm1 7.656 ppm2 1.574 CV 1
ASSI { 412}
(( segid " " and resid 253 and name H ))
( segid " " and resid 255 and name HD2%)
4.600 2.600 1.400 peak 412 spectrum 1 weight 0.10000E+01 volume 0.29070E-03 ppm1 8.261 ppm2 0.805 CV 1
ASSI { 1355}
(( segid " " and resid 443 and name H ))
(( segid " " and resid 440 and name HA ))
3.000 1.200 1.200 peak 1355 spectrum 1 weight 0.10000E+01 volume 0.13976E-02 ppm1 7.652 ppm2 3.779 CV 1
ASSI { 246}
(( segid " " and resid 433 and name HE22))
(( segid " " and resid 433 and name HB2 ))
4.300 2.300 1.700 peak 246 spectrum 1 weight 0.10000E+01 volume 0.94908E-03 ppm1 6.711 ppm2 1.979 CV 1
ASSI { 2409}
(( segid " " and resid 213 and name H ))
(( segid " " and resid 213 and name HA ))
3.400 1.500 1.500 peak 2409 spectrum 1 weight 0.10000E+01 volume 0.51978E-03 ppm1 5.884 ppm2 3.590 CV 1
ASSI { 52}
(( segid " " and resid 283 and name H ))
(( segid " " and resid 285 and name HD2 ))
4.300 2.300 1.700 peak 52 spectrum 1 weight 0.10000E+01 volume 0.36000E-03 ppm1 7.324 ppm2 3.575 CV 1
ASSI { 1068}
(( segid " " and resid 242 and name H ))
(( segid " " and resid 244 and name H ))
4.400 2.400 1.600 peak 1068 spectrum 1 weight 0.10000E+01 volume 0.37734E-03 ppm1 7.546 ppm2 8.556 CV 1
ASSI { 646}
(( segid " " and resid 410 and name H ))
( segid " " and resid 409 and name HD2%)
4.000 2.000 2.000 peak 646 spectrum 1 weight 0.10000E+01 volume 0.16114E-02 ppm1 7.898 ppm2 0.778 CV 1
OR { 646}
(( segid " " and resid 410 and name H ))
( segid " " and resid 409 and name HD1%)
ASSI { 675}
(( segid " " and resid 273 and name H ))
(( segid " " and resid 271 and name HB2 ))
4.500 2.500 1.500 peak 675 spectrum 1 weight 0.10000E+01 volume 0.53518E-03 ppm1 7.702 ppm2 1.224 CV 1
ASSI { 2046}
(( segid " " and resid 286 and name H ))
(( segid " " and resid 285 and name HD2 ))
2.900 1.000 1.000 peak 2046 spectrum 1 weight 0.10000E+01 volume 0.92215E-03 ppm1 7.446 ppm2 3.539 CV 1
ASSI { 2267}
(( segid " " and resid 314 and name H ))
(( segid " " and resid 313 and name HA ))
3.500 1.600 1.600 peak 2267 spectrum 1 weight 0.10000E+01 volume 0.94718E-03 ppm1 7.341 ppm2 4.406 CV 1
ASSI { 1128}
(( segid " " and resid 298 and name H ))
(( segid " " and resid 296 and name H ))
5.100 3.300 0.900 peak 1128 spectrum 1 weight 0.10000E+01 volume 0.25604E-03 ppm1 7.332 ppm2 8.932 CV 1
ASSI { 2043}
(( segid " " and resid 195 and name H ))
( segid " " and resid 194 and name HD1%)
4.300 2.300 1.700 peak 2043 spectrum 1 weight 0.10000E+01 volume 0.16229E-02 ppm1 8.992 ppm2 0.733 CV 1
ASSI { 1028}
(( segid " " and resid 190 and name H ))
( segid " " and resid 190 and name HD% )
3.400 1.400 1.400 peak 1028 spectrum 1 weight 0.10000E+01 volume 0.61796E-03 ppm1 10.638 ppm2 7.869 CV 1
ASSI { 1065}
(( segid " " and resid 363 and name H ))
(( segid " " and resid 362 and name H ))
2.600 0.900 0.900 peak 1065 spectrum 1 weight 0.10000E+01 volume 0.22043E-02 ppm1 7.266 ppm2 7.796 CV 1
ASSI { 446}
(( segid " " and resid 357 and name H ))
(( segid " " and resid 346 and name HB3 ))
5.000 3.100 1.000 peak 446 spectrum 1 weight 0.10000E+01 volume 0.93946E-03 ppm1 8.143 ppm2 1.483 CV 1
ASSI { 2014}
(( segid " " and resid 320 and name HE1 ))
(( segid " " and resid 319 and name HG ))
5.400 3.600 0.600 peak 2014 spectrum 1 weight 0.10000E+01 volume 0.48128E-03 ppm1 10.122 ppm2 4.087 CV 1
ASSI { 2964}
(( segid " " and resid 243 and name H ))
(( segid " " and resid 243 and name HA ))
3.000 1.100 1.100 peak 2964 spectrum 1 weight 0.10000E+01 volume 0.14593E-02 ppm1 7.862 ppm2 3.903 CV 1
ASSI { 2788}
(( segid " " and resid 425 and name H ))
( segid " " and resid 416 and name HD2%)
5.100 3.200 0.900 peak 2788 spectrum 1 weight 0.10000E+01 volume 0.59487E-03 ppm1 7.761 ppm2 0.697 CV 1
ASSI { 2455}
(( segid " " and resid 354 and name HD21))
(( segid " " and resid 354 and name HA ))
2.800 1.000 1.000 peak 2455 spectrum 1 weight 0.10000E+01 volume 0.13611E-02 ppm1 7.475 ppm2 4.173 CV 1
ASSI { 3001}
(( segid " " and resid 293 and name H ))
(( segid " " and resid 293 and name HG3 ))
3.100 1.200 1.200 peak 3001 spectrum 1 weight 0.10000E+01 volume 0.37135E-02 ppm1 7.004 ppm2 2.016 CV 1
ASSI { 1827}
(( segid " " and resid 323 and name H ))
(( segid " " and resid 322 and name H ))
2.900 1.100 1.100 peak 1827 spectrum 1 weight 0.10000E+01 volume 0.63531E-03 ppm1 7.780 ppm2 8.237 CV 1
ASSI { 2711}
(( segid " " and resid 218 and name H ))
(( segid " " and resid 218 and name HB3 ))
2.700 0.900 0.900 peak 2711 spectrum 1 weight 0.10000E+01 volume 0.19752E-02 ppm1 7.978 ppm2 2.542 CV 1
ASSI { 2064}
(( segid " " and resid 338 and name HD22))
(( segid " " and resid 340 and name H ))
5.000 3.100 1.000 peak 2064 spectrum 1 weight 0.10000E+01 volume 0.25797E-03 ppm1 7.444 ppm2 8.167 CV 1
ASSI { 2502}
(( segid " " and resid 190 and name H ))
(( segid " " and resid 190 and name HB2 ))
3.400 1.500 1.500 peak 2502 spectrum 1 weight 0.10000E+01 volume 0.43125E-03 ppm1 10.642 ppm2 2.546 CV 1
ASSI { 2374}
(( segid " " and resid 374 and name H ))
(( segid " " and resid 374 and name HA ))
3.000 1.200 1.200 peak 2374 spectrum 1 weight 0.10000E+01 volume 0.11897E-02 ppm1 6.330 ppm2 4.058 CV 1
ASSI { 2208}
(( segid " " and resid 286 and name H ))
( segid " " and resid 306 and name HD1%)
4.200 2.200 1.800 peak 2208 spectrum 1 weight 0.10000E+01 volume 0.12128E-02 ppm1 7.450 ppm2 0.387 CV 1
ASSI { 2630}
(( segid " " and resid 196 and name H ))
(( segid " " and resid 196 and name HB3 ))
3.500 1.500 1.500 peak 2630 spectrum 1 weight 0.10000E+01 volume 0.17288E-02 ppm1 7.180 ppm2 2.754 CV 1
ASSI { 1615}
(( segid " " and resid 273 and name H ))
(( segid " " and resid 191 and name H ))
5.700 4.100 0.300 peak 1615 spectrum 1 weight 0.10000E+01 volume 0.34460E-03 ppm1 7.705 ppm2 9.239 CV 1
ASSI { 750}
(( segid " " and resid 433 and name HE21))
(( segid " " and resid 433 and name HG2 ))
2.700 0.900 0.900 peak 750 spectrum 1 weight 0.10000E+01 volume 0.26220E-02 ppm1 6.976 ppm2 2.238 CV 1
ASSI { 2679}
(( segid " " and resid 261 and name HD22))
(( segid " " and resid 261 and name HB3 ))
4.100 2.100 1.900 peak 2679 spectrum 1 weight 0.10000E+01 volume 0.12976E-02 ppm1 6.628 ppm2 3.048 CV 1
ASSI { 2944}
(( segid " " and resid 445 and name H ))
(( segid " " and resid 445 and name HB2 ))
2.500 0.800 0.800 peak 2944 spectrum 1 weight 0.10000E+01 volume 0.49823E-02 ppm1 7.906 ppm2 2.058 CV 1
ASSI { 426}
(( segid " " and resid 246 and name H ))
(( segid " " and resid 248 and name HB2 ))
5.000 3.100 1.000 peak 426 spectrum 1 weight 0.10000E+01 volume 0.40043E-03 ppm1 7.445 ppm2 2.509 CV 1
ASSI { 2761}
(( segid " " and resid 280 and name H ))
(( segid " " and resid 279 and name HB3 ))
4.200 2.200 1.800 peak 2761 spectrum 1 weight 0.10000E+01 volume 0.97605E-03 ppm1 7.656 ppm2 1.430 CV 1
OR { 2761}
(( segid " " and resid 280 and name H ))
(( segid " " and resid 279 and name HG ))
ASSI { 79}
(( segid " " and resid 338 and name HD21))
(( segid " " and resid 338 and name H ))
5.200 3.400 0.800 peak 79 spectrum 1 weight 0.10000E+01 volume 0.36962E-03 ppm1 6.625 ppm2 7.706 CV 1
ASSI { 1866}
(( segid " " and resid 349 and name H ))
(( segid " " and resid 348 and name HD2 ))
3.100 1.200 1.200 peak 1866 spectrum 1 weight 0.10000E+01 volume 0.56215E-03 ppm1 7.108 ppm2 3.568 CV 1
ASSI { 2854}
(( segid " " and resid 257 and name H ))
(( segid " " and resid 256 and name HA ))
3.200 1.300 1.300 peak 2854 spectrum 1 weight 0.10000E+01 volume 0.97990E-03 ppm1 7.441 ppm2 4.134 CV 1
ASSI { 1970}
(( segid " " and resid 307 and name H ))
(( segid " " and resid 307 and name HA ))
3.000 1.200 1.200 peak 1970 spectrum 1 weight 0.10000E+01 volume 0.79703E-03 ppm1 8.735 ppm2 4.177 CV 1
ASSI { 1347}
(( segid " " and resid 286 and name H ))
(( segid " " and resid 285 and name HD3 ))
3.900 1.900 1.900 peak 1347 spectrum 1 weight 0.10000E+01 volume 0.74118E-03 ppm1 7.446 ppm2 3.687 CV 1
ASSI { 574}
(( segid " " and resid 361 and name H ))
( segid " " and resid 364 and name HG1%)
4.900 3.000 1.100 peak 574 spectrum 1 weight 0.10000E+01 volume 0.47165E-03 ppm1 8.406 ppm2 1.077 CV 1
ASSI { 918}
(( segid " " and resid 256 and name H ))
( segid " " and resid 219 and name HE% )
4.700 2.700 1.300 peak 918 spectrum 1 weight 0.10000E+01 volume 0.67187E-03 ppm1 8.259 ppm2 6.405 CV 1
ASSI { 2994}
(( segid " " and resid 401 and name H ))
(( segid " " and resid 402 and name H ))
3.000 1.100 1.100 peak 2994 spectrum 1 weight 0.10000E+01 volume 0.95102E-03 ppm1 7.791 ppm2 8.726 CV 1
ASSI { 2618}
(( segid " " and resid 281 and name H ))
(( segid " " and resid 276 and name HG3 ))
3.400 1.500 1.500 peak 2618 spectrum 1 weight 0.10000E+01 volume 0.91058E-03 ppm1 9.178 ppm2 2.211 CV 1
ASSI { 1774}
(( segid " " and resid 380 and name H ))
(( segid " " and resid 379 and name HG2 ))
5.400 3.600 0.600 peak 1774 spectrum 1 weight 0.10000E+01 volume 0.27144E-03 ppm1 9.046 ppm2 1.816 CV 1
ASSI { 2527}
(( segid " " and resid 254 and name HD21))
(( segid " " and resid 254 and name HA ))
3.100 1.200 1.200 peak 2527 spectrum 1 weight 0.10000E+01 volume 0.11089E-02 ppm1 7.497 ppm2 4.873 CV 1
ASSI { 1433}
(( segid " " and resid 337 and name H ))
(( segid " " and resid 336 and name HA ))
3.500 1.500 1.500 peak 1433 spectrum 1 weight 0.10000E+01 volume 0.84321E-03 ppm1 7.310 ppm2 3.962 CV 1
ASSI { 2712}
(( segid " " and resid 319 and name H ))
( segid " " and resid 318 and name HG2%)
2.400 0.700 0.700 peak 2712 spectrum 1 weight 0.10000E+01 volume 0.32554E-02 ppm1 7.859 ppm2 0.372 CV 1
OR { 2712}
(( segid " " and resid 319 and name H ))
( segid " " and resid 318 and name HD1%)
ASSI { 1084}
(( segid " " and resid 304 and name HE22))
(( segid " " and resid 304 and name H ))
6.000 4.700 0.000 peak 1084 spectrum 1 weight 0.10000E+01 volume 0.47165E-03 ppm1 7.014 ppm2 8.678 CV 1
ASSI { 81}
(( segid " " and resid 317 and name H ))
(( segid " " and resid 316 and name HA ))
3.900 1.900 1.900 peak 81 spectrum 1 weight 0.10000E+01 volume 0.50631E-03 ppm1 7.530 ppm2 3.595 CV 1
ASSI { 418}
(( segid " " and resid 442 and name H ))
( segid " " and resid 398 and name HD1%)
4.300 2.300 1.700 peak 418 spectrum 1 weight 0.10000E+01 volume 0.96065E-03 ppm1 7.550 ppm2 0.570 CV 1
OR { 418}
(( segid " " and resid 442 and name H ))
(( segid " " and resid 398 and name HG12))
ASSI { 1106}
(( segid " " and resid 242 and name H ))
(( segid " " and resid 239 and name HA ))
3.100 1.200 1.200 peak 1106 spectrum 1 weight 0.10000E+01 volume 0.14535E-02 ppm1 7.549 ppm2 4.303 CV 1
ASSI { 2943}
(( segid " " and resid 406 and name H ))
(( segid " " and resid 405 and name HA ))
3.600 1.600 1.600 peak 2943 spectrum 1 weight 0.10000E+01 volume 0.76815E-03 ppm1 9.263 ppm2 3.856 CV 1
ASSI { 872}
(( segid " " and resid 421 and name H ))
(( segid " " and resid 422 and name HB3 ))
5.200 3.400 0.800 peak 872 spectrum 1 weight 0.10000E+01 volume 0.29070E-03 ppm1 8.386 ppm2 2.652 CV 1
ASSI { 1578}
(( segid " " and resid 270 and name H ))
(( segid " " and resid 269 and name HB3 ))
3.300 1.400 1.400 peak 1578 spectrum 1 weight 0.10000E+01 volume 0.48128E-03 ppm1 8.539 ppm2 1.848 CV 1
ASSI { 2675}
(( segid " " and resid 240 and name H ))
(( segid " " and resid 240 and name HA ))
3.300 1.300 1.300 peak 2675 spectrum 1 weight 0.10000E+01 volume 0.95296E-03 ppm1 8.013 ppm2 3.246 CV 1
ASSI { 963}
(( segid " " and resid 375 and name HE21))
(( segid " " and resid 378 and name HB3 ))
4.900 3.000 1.100 peak 963 spectrum 1 weight 0.10000E+01 volume 0.24064E-03 ppm1 6.665 ppm2 1.656 CV 1
OR { 963}
(( segid " " and resid 375 and name HE21))
(( segid " " and resid 378 and name HB2 ))
OR { 963}
(( segid " " and resid 375 and name HE21))
(( segid " " and resid 378 and name HD2 ))
OR { 963}
(( segid " " and resid 375 and name HE21))
(( segid " " and resid 378 and name HD3 ))
ASSI { 1687}
(( segid " " and resid 221 and name H ))
( segid " " and resid 220 and name HG1%)
4.000 2.000 2.000 peak 1687 spectrum 1 weight 0.10000E+01 volume 0.10896E-02 ppm1 8.748 ppm2 1.136 CV 1
OR { 1687}
(( segid " " and resid 221 and name H ))
( segid " " and resid 220 and name HG2%)
ASSI { 853}
(( segid " " and resid 433 and name HE21))
( segid " " and resid 429 and name HD2%)
3.400 1.400 1.400 peak 853 spectrum 1 weight 0.10000E+01 volume 0.27202E-02 ppm1 6.975 ppm2 0.673 CV 1
ASSI { 2694}
(( segid " " and resid 372 and name H ))
( segid " " and resid 373 and name HD1%)
4.500 2.500 1.500 peak 2694 spectrum 1 weight 0.10000E+01 volume 0.37925E-03 ppm1 7.922 ppm2 -0.168 CV 1
ASSI { 529}
(( segid " " and resid 254 and name HD22))
(( segid " " and resid 256 and name HB3 ))
3.800 1.800 1.800 peak 529 spectrum 1 weight 0.10000E+01 volume 0.22062E-02 ppm1 6.859 ppm2 1.950 CV 1
ASSI { 2457}
(( segid " " and resid 223 and name H ))
(( segid " " and resid 223 and name HB2 ))
3.200 1.200 1.200 peak 2457 spectrum 1 weight 0.10000E+01 volume 0.89712E-03 ppm1 8.420 ppm2 1.798 CV 1
ASSI { 530}
(( segid " " and resid 264 and name H ))
( segid " " and resid 262 and name HG2%)
3.700 1.700 1.700 peak 530 spectrum 1 weight 0.10000E+01 volume 0.13515E-02 ppm1 8.513 ppm2 1.113 CV 1
ASSI { 3014}
(( segid " " and resid 258 and name H ))
( segid " " and resid 258 and name HD% )
2.400 0.700 0.700 peak 3014 spectrum 1 weight 0.10000E+01 volume 0.31765E-02 ppm1 8.133 ppm2 7.095 CV 1
ASSI { 1486}
(( segid " " and resid 202 and name H ))
(( segid " " and resid 202 and name HB2 ))
2.500 0.800 0.800 peak 1486 spectrum 1 weight 0.10000E+01 volume 0.24623E-02 ppm1 8.209 ppm2 2.061 CV 1
ASSI { 403}
(( segid " " and resid 201 and name H ))
( segid " " and resid 198 and name HG1%)
4.700 2.700 1.300 peak 403 spectrum 1 weight 0.10000E+01 volume 0.58909E-03 ppm1 7.495 ppm2 0.624 CV 1
OR { 403}
(( segid " " and resid 201 and name H ))
( segid " " and resid 198 and name HG2%)
ASSI { 1731}
(( segid " " and resid 356 and name H ))
(( segid " " and resid 355 and name HD3 ))
3.100 3.100 2.900 peak 1731 spectrum 1 weight 0.10000E+01 volume 0.42737E-03 ppm1 7.363 ppm2 3.092 CV 1
OR { 1731}
(( segid " " and resid 356 and name H ))
(( segid " " and resid 355 and name HD2 ))
ASSI { 1605}
(( segid " " and resid 201 and name H ))
(( segid " " and resid 201 and name HG1 ))
3.000 1.200 1.200 peak 1605 spectrum 1 weight 0.10000E+01 volume 0.14054E-02 ppm1 7.499 ppm2 4.443 CV 1
OR { 1605}
(( segid " " and resid 201 and name H ))
(( segid " " and resid 201 and name HB ))
ASSI { 2273}
(( segid " " and resid 382 and name HE1 ))
(( segid " " and resid 382 and name HZ2 ))
2.700 0.900 0.900 peak 2273 spectrum 1 weight 0.10000E+01 volume 0.41351E-02 ppm1 9.606 ppm2 7.473 CV 1
ASSI { 1729}
(( segid " " and resid 413 and name H ))
( segid " " and resid 412 and name HD1%)
2.600 2.600 3.400 peak 1729 spectrum 1 weight 0.10000E+01 volume 0.11474E-02 ppm1 8.478 ppm2 0.838 CV 1
ASSI { 1045}
(( segid " " and resid 410 and name HD21))
(( segid " " and resid 410 and name HB3 ))
2.600 0.900 0.900 peak 1045 spectrum 1 weight 0.10000E+01 volume 0.20811E-02 ppm1 6.911 ppm2 2.710 CV 1
ASSI { 1046}
(( segid " " and resid 244 and name H ))
(( segid " " and resid 244 and name HG3 ))
3.600 1.600 1.600 peak 1046 spectrum 1 weight 0.10000E+01 volume 0.37156E-03 ppm1 8.558 ppm2 -0.529 CV 1
ASSI { 3181}
(( segid " " and resid 380 and name H ))
(( segid " " and resid 380 and name HB2 ))
4.000 2.000 2.000 peak 3181 spectrum 1 weight 0.10000E+01 volume 0.42162E-03 ppm1 9.060 ppm2 1.198 CV 1
ASSI { 1722}
(( segid " " and resid 356 and name H ))
( segid " " and resid 356 and name HG2%)
2.800 0.900 0.900 peak 1722 spectrum 1 weight 0.10000E+01 volume 0.15902E-02 ppm1 7.365 ppm2 0.395 CV 1
ASSI { 2494}
(( segid " " and resid 264 and name H ))
(( segid " " and resid 261 and name HA ))
3.300 1.400 1.400 peak 2494 spectrum 1 weight 0.10000E+01 volume 0.10781E-02 ppm1 8.513 ppm2 4.515 CV 1
ASSI { 2517}
(( segid " " and resid 266 and name H ))
(( segid " " and resid 263 and name HA ))
3.400 1.500 1.500 peak 2517 spectrum 1 weight 0.10000E+01 volume 0.82396E-03 ppm1 8.223 ppm2 3.178 CV 1
ASSI { 1190}
(( segid " " and resid 437 and name H ))
( segid " " and resid 437 and name HG2%)
4.300 2.300 1.700 peak 1190 spectrum 1 weight 0.10000E+01 volume 0.19078E-02 ppm1 8.216 ppm2 1.193 CV 1
ASSI { 2057}
(( segid " " and resid 187 and name H ))
(( segid " " and resid 188 and name HB3 ))
5.700 4.000 0.300 peak 2057 spectrum 1 weight 0.10000E+01 volume 0.49862E-03 ppm1 8.522 ppm2 2.166 CV 1
OR { 2057}
(( segid " " and resid 187 and name H ))
(( segid " " and resid 188 and name HB2 ))
ASSI { 1671}
(( segid " " and resid 228 and name H ))
(( segid " " and resid 228 and name HB2 ))
2.500 0.800 0.800 peak 1671 spectrum 1 weight 0.10000E+01 volume 0.35520E-02 ppm1 8.445 ppm2 1.813 CV 1
ASSI { 1674}
(( segid " " and resid 332 and name H ))
(( segid " " and resid 332 and name HB2 ))
2.300 0.700 0.700 peak 1674 spectrum 1 weight 0.10000E+01 volume 0.30109E-02 ppm1 7.439 ppm2 1.830 CV 1
ASSI { 766}
(( segid " " and resid 273 and name H ))
(( segid " " and resid 274 and name HA ))
4.500 2.500 1.500 peak 766 spectrum 1 weight 0.10000E+01 volume 0.65262E-03 ppm1 7.703 ppm2 3.984 CV 1
ASSI { 1457}
(( segid " " and resid 262 and name H ))
( segid " " and resid 263 and name HG1%)
4.900 3.000 1.100 peak 1457 spectrum 1 weight 0.10000E+01 volume 0.55637E-03 ppm1 7.891 ppm2 0.063 CV 1
ASSI { 1526}
(( segid " " and resid 298 and name H ))
(( segid " " and resid 297 and name HA ))
3.000 1.200 1.200 peak 1526 spectrum 1 weight 0.10000E+01 volume 0.17326E-02 ppm1 7.338 ppm2 3.753 CV 1
ASSI { 2207}
(( segid " " and resid 320 and name H ))
( segid " " and resid 209 and name HD2%)
4.900 3.000 1.100 peak 2207 spectrum 1 weight 0.10000E+01 volume 0.24449E-03 ppm1 8.422 ppm2 -0.885 CV 1
ASSI { 1997}
(( segid " " and resid 297 and name H ))
(( segid " " and resid 296 and name HG2 ))
3.700 1.700 1.700 peak 1997 spectrum 1 weight 0.10000E+01 volume 0.14304E-02 ppm1 8.074 ppm2 2.427 CV 1
OR { 1997}
(( segid " " and resid 297 and name H ))
(( segid " " and resid 296 and name HG3 ))
ASSI { 2864}
(( segid " " and resid 310 and name H ))
(( segid " " and resid 310 and name HA ))
2.900 1.000 1.000 peak 2864 spectrum 1 weight 0.10000E+01 volume 0.15228E-02 ppm1 7.065 ppm2 4.352 CV 1
ASSI { 1637}
(( segid " " and resid 215 and name H ))
(( segid " " and resid 215 and name HA ))
3.400 1.400 1.400 peak 1637 spectrum 1 weight 0.10000E+01 volume 0.90674E-03 ppm1 8.894 ppm2 3.914 CV 1
ASSI { 2389}
(( segid " " and resid 388 and name H ))
(( segid " " and resid 382 and name HZ2 ))
3.700 1.800 1.800 peak 2389 spectrum 1 weight 0.10000E+01 volume 0.63337E-03 ppm1 8.233 ppm2 7.472 CV 1
ASSI { 556}
(( segid " " and resid 333 and name H ))
( segid " " and resid 333 and name HD2%)
3.600 1.600 1.600 peak 556 spectrum 1 weight 0.10000E+01 volume 0.32573E-02 ppm1 8.641 ppm2 0.867 CV 1
OR { 556}
(( segid " " and resid 333 and name H ))
( segid " " and resid 333 and name HD1%)
ASSI { 1831}
(( segid " " and resid 337 and name H ))
(( segid " " and resid 335 and name H ))
4.600 2.600 1.400 peak 1831 spectrum 1 weight 0.10000E+01 volume 0.27530E-03 ppm1 7.329 ppm2 8.873 CV 1
ASSI { 1051}
(( segid " " and resid 398 and name H ))
(( segid " " and resid 398 and name HB ))
2.800 1.000 1.000 peak 1051 spectrum 1 weight 0.10000E+01 volume 0.12860E-02 ppm1 8.684 ppm2 1.799 CV 1
ASSI { 92}
(( segid " " and resid 445 and name H ))
(( segid " " and resid 446 and name HA ))
4.300 2.300 1.700 peak 92 spectrum 1 weight 0.10000E+01 volume 0.23275E-02 ppm1 7.905 ppm2 4.070 CV 1
ASSI { 2748}
(( segid " " and resid 433 and name HE21))
(( segid " " and resid 429 and name HA ))
4.100 2.100 1.900 peak 2748 spectrum 1 weight 0.10000E+01 volume 0.30995E-03 ppm1 6.975 ppm2 3.789 CV 1
ASSI { 1339}
(( segid " " and resid 254 and name H ))
(( segid " " and resid 252 and name HA ))
2.500 2.500 3.500 peak 1339 spectrum 1 weight 0.10000E+01 volume 0.14342E-02 ppm1 8.730 ppm2 4.345 CV 1
ASSI { 2915}
(( segid " " and resid 287 and name H ))
(( segid " " and resid 287 and name HA ))
3.200 1.300 1.300 peak 2915 spectrum 1 weight 0.10000E+01 volume 0.10646E-02 ppm1 8.015 ppm2 3.506 CV 1
ASSI { 1375}
(( segid " " and resid 338 and name HD21))
( segid " " and resid 329 and name HG2%)
6.000 4.700 0.000 peak 1375 spectrum 1 weight 0.10000E+01 volume 0.29840E-03 ppm1 6.627 ppm2 0.728 CV 1
ASSI { 526}
(( segid " " and resid 433 and name HE22))
(( segid " " and resid 433 and name HG2 ))
3.600 1.700 1.700 peak 526 spectrum 1 weight 0.10000E+01 volume 0.22409E-02 ppm1 6.711 ppm2 2.237 CV 1
ASSI { 508}
(( segid " " and resid 282 and name H ))
(( segid " " and resid 280 and name HB ))
2.800 1.000 1.000 peak 508 spectrum 1 weight 0.10000E+01 volume 0.23660E-02 ppm1 8.700 ppm2 4.555 CV 1
ASSI { 946}
(( segid " " and resid 375 and name HE22))
( segid " " and resid 376 and name HG2%)
4.500 2.500 1.500 peak 946 spectrum 1 weight 0.10000E+01 volume 0.48128E-03 ppm1 7.505 ppm2 0.955 CV 1
OR { 946}
(( segid " " and resid 375 and name HE22))
( segid " " and resid 376 and name HG1%)
ASSI { 2691}
(( segid " " and resid 215 and name H ))
(( segid " " and resid 215 and name HB2 ))
2.900 1.100 1.100 peak 2691 spectrum 1 weight 0.10000E+01 volume 0.84515E-03 ppm1 8.889 ppm2 1.899 CV 1
ASSI { 1057}
(( segid " " and resid 186 and name H ))
(( segid " " and resid 185 and name HA ))
1.800 0.400 0.400 peak 1057 spectrum 1 weight 0.10000E+01 volume 0.17190E-01 ppm1 8.055 ppm2 4.591 CV 1
ASSI { 520}
(( segid " " and resid 209 and name H ))
( segid " " and resid 198 and name HG1%)
3.300 1.300 1.300 peak 520 spectrum 1 weight 0.10000E+01 volume 0.14708E-02 ppm1 7.832 ppm2 0.621 CV 1
OR { 520}
(( segid " " and resid 209 and name H ))
( segid " " and resid 198 and name HG2%)
ASSI { 2154}
(( segid " " and resid 255 and name H ))
( segid " " and resid 258 and name HE% )
5.200 3.400 0.800 peak 2154 spectrum 1 weight 0.10000E+01 volume 0.22717E-03 ppm1 8.612 ppm2 6.643 CV 1
ASSI { 1207}
(( segid " " and resid 413 and name H ))
(( segid " " and resid 410 and name HA ))
3.500 1.600 1.600 peak 1207 spectrum 1 weight 0.10000E+01 volume 0.10396E-02 ppm1 8.480 ppm2 4.360 CV 1
ASSI { 1816}
(( segid " " and resid 319 and name H ))
(( segid " " and resid 318 and name H ))
2.900 1.100 1.100 peak 1816 spectrum 1 weight 0.10000E+01 volume 0.10454E-02 ppm1 7.860 ppm2 8.048 CV 1
ASSI { 348}
(( segid " " and resid 303 and name H ))
(( segid " " and resid 300 and name HA ))
3.800 1.800 1.800 peak 348 spectrum 1 weight 0.10000E+01 volume 0.78546E-03 ppm1 8.731 ppm2 2.889 CV 1
ASSI { 1531}
(( segid " " and resid 370 and name HD21))
(( segid " " and resid 370 and name HB3 ))
2.500 0.800 0.800 peak 1531 spectrum 1 weight 0.10000E+01 volume 0.72599E-02 ppm1 6.834 ppm2 2.768 CV 1
OR { 1531}
(( segid " " and resid 370 and name HD21))
(( segid " " and resid 370 and name HB2 ))
ASSI { 593}
(( segid " " and resid 273 and name H ))
(( segid " " and resid 269 and name HA ))
3.900 1.900 1.900 peak 593 spectrum 1 weight 0.10000E+01 volume 0.73734E-03 ppm1 7.703 ppm2 3.813 CV 1
ASSI { 2220}
(( segid " " and resid 261 and name HD21))
(( segid " " and resid 233 and name HB ))
3.700 1.700 1.700 peak 2220 spectrum 1 weight 0.10000E+01 volume 0.42353E-03 ppm1 7.521 ppm2 1.774 CV 1
ASSI { 3116}
(( segid " " and resid 433 and name H ))
(( segid " " and resid 433 and name HB2 ))
3.100 1.200 1.200 peak 3116 spectrum 1 weight 0.10000E+01 volume 0.14362E-02 ppm1 8.314 ppm2 1.974 CV 1
ASSI { 2876}
(( segid " " and resid 276 and name H ))
(( segid " " and resid 276 and name HG3 ))
4.200 2.200 1.800 peak 2876 spectrum 1 weight 0.10000E+01 volume 0.21850E-02 ppm1 6.947 ppm2 2.215 CV 1
ASSI { 189}
(( segid " " and resid 295 and name H ))
(( segid " " and resid 293 and name HD3 ))
5.300 3.600 0.700 peak 189 spectrum 1 weight 0.10000E+01 volume 0.72962E-03 ppm1 7.394 ppm2 3.144 CV 1
ASSI { 2266}
(( segid " " and resid 431 and name H ))
(( segid " " and resid 430 and name HB2 ))
3.700 1.700 1.700 peak 2266 spectrum 1 weight 0.10000E+01 volume 0.59871E-03 ppm1 7.968 ppm2 3.338 CV 1
OR { 2266}
(( segid " " and resid 431 and name H ))
(( segid " " and resid 430 and name HB3 ))
ASSI { 1844}
(( segid " " and resid 368 and name H ))
(( segid " " and resid 367 and name HB3 ))
3.600 1.600 1.600 peak 1844 spectrum 1 weight 0.10000E+01 volume 0.68149E-03 ppm1 8.219 ppm2 0.034 CV 1
ASSI { 2109}
(( segid " " and resid 204 and name H ))
(( segid " " and resid 204 and name HB2 ))
3.800 1.900 1.900 peak 2109 spectrum 1 weight 0.10000E+01 volume 0.93177E-03 ppm1 8.138 ppm2 2.738 CV 1
ASSI { 2296}
(( segid " " and resid 395 and name HE21))
( segid " " and resid 398 and name HD1%)
3.700 1.700 1.700 peak 2296 spectrum 1 weight 0.10000E+01 volume 0.14246E-02 ppm1 7.772 ppm2 0.568 CV 1
ASSI { 2642}
(( segid " " and resid 222 and name H ))
(( segid " " and resid 222 and name HG3 ))
2.700 0.900 0.900 peak 2642 spectrum 1 weight 0.10000E+01 volume 0.15767E-02 ppm1 7.251 ppm2 0.981 CV 1
ASSI { 3131}
(( segid " " and resid 365 and name HE21))
( segid " " and resid 364 and name HG2%)
3.000 1.100 1.100 peak 3131 spectrum 1 weight 0.10000E+01 volume 0.30494E-02 ppm1 6.881 ppm2 0.911 CV 1
ASSI { 1140}
(( segid " " and resid 347 and name H ))
(( segid " " and resid 346 and name HB2 ))
3.500 1.600 1.600 peak 1140 spectrum 1 weight 0.10000E+01 volume 0.12995E-02 ppm1 9.033 ppm2 1.731 CV 1
OR { 1140}
(( segid " " and resid 347 and name H ))
(( segid " " and resid 346 and name HG ))
ASSI { 3133}
(( segid " " and resid 446 and name H ))
(( segid " " and resid 444 and name HD3 ))
2.900 2.900 3.100 peak 3133 spectrum 1 weight 0.10000E+01 volume 0.63147E-03 ppm1 7.642 ppm2 3.159 CV 1
OR { 3133}
(( segid " " and resid 446 and name H ))
(( segid " " and resid 444 and name HD2 ))
ASSI { 125}
(( segid " " and resid 205 and name H ))
(( segid " " and resid 203 and name HA ))
5.500 3.800 0.500 peak 125 spectrum 1 weight 0.10000E+01 volume 0.45624E-03 ppm1 6.375 ppm2 4.504 CV 1
ASSI { 2936}
(( segid " " and resid 224 and name H ))
(( segid " " and resid 223 and name HB2 ))
3.900 1.900 1.900 peak 2936 spectrum 1 weight 0.10000E+01 volume 0.32535E-03 ppm1 9.044 ppm2 1.807 CV 1
ASSI { 206}
(( segid " " and resid 310 and name H ))
(( segid " " and resid 310 and name HB2 ))
2.800 1.000 1.000 peak 206 spectrum 1 weight 0.10000E+01 volume 0.18308E-02 ppm1 7.065 ppm2 1.397 CV 1
ASSI { 280}
(( segid " " and resid 322 and name H ))
(( segid " " and resid 322 and name HG12))
2.300 0.700 0.700 peak 280 spectrum 1 weight 0.10000E+01 volume 0.16575E-02 ppm1 8.221 ppm2 1.372 CV 1
OR { 280}
(( segid " " and resid 322 and name H ))
(( segid " " and resid 322 and name HB ))
ASSI { 1267}
(( segid " " and resid 200 and name H ))
( segid " " and resid 198 and name HG1%)
5.200 3.400 0.800 peak 1267 spectrum 1 weight 0.10000E+01 volume 0.38118E-03 ppm1 7.611 ppm2 0.616 CV 1
OR { 1267}
(( segid " " and resid 200 and name H ))
( segid " " and resid 198 and name HG2%)
ASSI { 3122}
(( segid " " and resid 296 and name H ))
(( segid " " and resid 296 and name HG3 ))
5.300 3.500 0.700 peak 3122 spectrum 1 weight 0.10000E+01 volume 0.46975E-03 ppm1 8.916 ppm2 2.435 CV 1
OR { 3122}
(( segid " " and resid 296 and name H ))
(( segid " " and resid 296 and name HG2 ))
ASSI { 1839}
(( segid " " and resid 410 and name H ))
(( segid " " and resid 411 and name H ))
2.900 1.000 1.000 peak 1839 spectrum 1 weight 0.10000E+01 volume 0.13553E-02 ppm1 7.899 ppm2 7.723 CV 1
ASSI { 2329}
(( segid " " and resid 328 and name H ))
(( segid " " and resid 328 and name HB ))
3.000 1.100 1.100 peak 2329 spectrum 1 weight 0.10000E+01 volume 0.11050E-02 ppm1 7.188 ppm2 2.396 CV 1
ASSI { 247}
(( segid " " and resid 371 and name H ))
(( segid " " and resid 369 and name HA3 ))
4.100 2.100 1.900 peak 247 spectrum 1 weight 0.10000E+01 volume 0.95102E-03 ppm1 7.542 ppm2 4.002 CV 1
ASSI { 1799}
(( segid " " and resid 268 and name H ))
(( segid " " and resid 267 and name HB2 ))
3.600 1.600 1.600 peak 1799 spectrum 1 weight 0.10000E+01 volume 0.14958E-02 ppm1 7.863 ppm2 1.656 CV 1
ASSI { 452}
(( segid " " and resid 378 and name H ))
(( segid " " and resid 377 and name HG3 ))
3.000 3.000 3.000 peak 452 spectrum 1 weight 0.10000E+01 volume 0.49862E-03 ppm1 8.588 ppm2 2.420 CV 1
ASSI { 1444}
(( segid " " and resid 375 and name HE21))
(( segid " " and resid 375 and name H ))
6.000 4.500 0.000 peak 1444 spectrum 1 weight 0.10000E+01 volume 0.26374E-03 ppm1 6.668 ppm2 8.485 CV 1
ASSI { 2849}
(( segid " " and resid 255 and name H ))
(( segid " " and resid 254 and name HB2 ))
4.500 2.500 1.500 peak 2849 spectrum 1 weight 0.10000E+01 volume 0.99724E-03 ppm1 8.612 ppm2 2.617 CV 1
ASSI { 1588}
(( segid " " and resid 394 and name H ))
(( segid " " and resid 397 and name H ))
4.200 2.200 1.800 peak 1588 spectrum 1 weight 0.10000E+01 volume 0.59681E-03 ppm1 7.550 ppm2 8.082 CV 1
ASSI { 2503}
(( segid " " and resid 223 and name H ))
(( segid " " and resid 220 and name HA ))
4.600 2.600 1.400 peak 2503 spectrum 1 weight 0.10000E+01 volume 0.56406E-03 ppm1 8.420 ppm2 3.328 CV 1
ASSI { 3134}
(( segid " " and resid 296 and name H ))
(( segid " " and resid 296 and name HB3 ))
3.400 1.500 1.500 peak 3134 spectrum 1 weight 0.10000E+01 volume 0.57562E-03 ppm1 8.944 ppm2 1.967 CV 1
ASSI { 2127}
(( segid " " and resid 287 and name H ))
( segid " " and resid 306 and name HD2%)
4.300 2.300 1.700 peak 2127 spectrum 1 weight 0.10000E+01 volume 0.55253E-03 ppm1 8.016 ppm2 -0.354 CV 1
ASSI { 2863}
(( segid " " and resid 365 and name H ))
(( segid " " and resid 364 and name HA ))
2.900 1.000 1.000 peak 2863 spectrum 1 weight 0.10000E+01 volume 0.21099E-02 ppm1 8.370 ppm2 3.704 CV 1
ASSI { 2726}
(( segid " " and resid 395 and name H ))
(( segid " " and resid 395 and name HB2 ))
3.400 1.500 1.500 peak 2726 spectrum 1 weight 0.10000E+01 volume 0.61796E-03 ppm1 9.083 ppm2 2.041 CV 1
OR { 2726}
(( segid " " and resid 395 and name H ))
(( segid " " and resid 395 and name HB3 ))
ASSI { 1178}
(( segid " " and resid 354 and name HD21))
(( segid " " and resid 343 and name HA ))
3.600 1.600 1.600 peak 1178 spectrum 1 weight 0.10000E+01 volume 0.13649E-02 ppm1 7.473 ppm2 4.051 CV 1
ASSI { 3103}
(( segid " " and resid 227 and name H ))
(( segid " " and resid 230 and name HG12))
4.500 2.600 1.500 peak 3103 spectrum 1 weight 0.10000E+01 volume 0.45240E-03 ppm1 7.134 ppm2 0.820 CV 1
ASSI { 1034}
(( segid " " and resid 280 and name H ))
(( segid " " and resid 277 and name HB3 ))
3.300 1.400 1.400 peak 1034 spectrum 1 weight 0.10000E+01 volume 0.92599E-03 ppm1 7.654 ppm2 1.937 CV 1
ASSI { 1320}
(( segid " " and resid 339 and name H ))
(( segid " " and resid 338 and name HA ))
3.000 1.100 1.100 peak 1320 spectrum 1 weight 0.10000E+01 volume 0.89518E-03 ppm1 8.365 ppm2 4.658 CV 1
ASSI { 2328}
(( segid " " and resid 342 and name H ))
(( segid " " and resid 343 and name HG ))
4.800 2.900 1.200 peak 2328 spectrum 1 weight 0.10000E+01 volume 0.50825E-03 ppm1 8.652 ppm2 4.821 CV 1
ASSI { 2881}
(( segid " " and resid 410 and name HD21))
(( segid " " and resid 410 and name HB2 ))
3.500 1.500 1.500 peak 2881 spectrum 1 weight 0.10000E+01 volume 0.21408E-02 ppm1 6.913 ppm2 2.806 CV 1
ASSI { 303}
(( segid " " and resid 365 and name HE22))
( segid " " and resid 323 and name HG1%)
3.100 1.200 1.200 peak 303 spectrum 1 weight 0.10000E+01 volume 0.42737E-03 ppm1 7.587 ppm2 0.756 CV 1
ASSI { 1087}
(( segid " " and resid 256 and name H ))
( segid " " and resid 255 and name HD1%)
4.800 2.900 1.200 peak 1087 spectrum 1 weight 0.10000E+01 volume 0.76237E-03 ppm1 8.259 ppm2 0.614 CV 1
ASSI { 2900}
(( segid " " and resid 381 and name H ))
( segid " " and resid 380 and name HD1%)
3.400 1.400 1.400 peak 2900 spectrum 1 weight 0.10000E+01 volume 0.33305E-02 ppm1 8.200 ppm2 0.779 CV 1
OR { 2900}
(( segid " " and resid 381 and name H ))
( segid " " and resid 380 and name HD2%)
ASSI { 1288}
(( segid " " and resid 317 and name H ))
(( segid " " and resid 316 and name H ))
2.900 1.000 1.000 peak 1288 spectrum 1 weight 0.10000E+01 volume 0.10781E-02 ppm1 7.528 ppm2 8.704 CV 1
ASSI { 3059}
(( segid " " and resid 257 and name H ))
(( segid " " and resid 255 and name HA ))
3.400 1.500 1.500 peak 3059 spectrum 1 weight 0.10000E+01 volume 0.83359E-03 ppm1 7.440 ppm2 3.975 CV 1
ASSI { 2318}
(( segid " " and resid 320 and name HE1 ))
(( segid " " and resid 320 and name HZ2 ))
2.600 0.900 0.900 peak 2318 spectrum 1 weight 0.10000E+01 volume 0.39271E-02 ppm1 10.125 ppm2 7.382 CV 1
ASSI { 2555}
(( segid " " and resid 380 and name H ))
(( segid " " and resid 380 and name HB3 ))
4.600 2.600 1.400 peak 2555 spectrum 1 weight 0.10000E+01 volume 0.24834E-03 ppm1 9.056 ppm2 1.453 CV 1
ASSI { 2769}
(( segid " " and resid 367 and name H ))
(( segid " " and resid 363 and name HA ))
4.100 2.100 1.900 peak 2769 spectrum 1 weight 0.10000E+01 volume 0.36578E-03 ppm1 7.865 ppm2 5.140 CV 1
ASSI { 1119}
(( segid " " and resid 396 and name H ))
(( segid " " and resid 395 and name H ))
3.500 1.500 1.500 peak 1119 spectrum 1 weight 0.10000E+01 volume 0.57368E-03 ppm1 8.690 ppm2 9.084 CV 1
ASSI { 2975}
(( segid " " and resid 239 and name H ))
(( segid " " and resid 239 and name HG3 ))
3.400 1.500 1.500 peak 2975 spectrum 1 weight 0.10000E+01 volume 0.15170E-02 ppm1 7.097 ppm2 1.595 CV 1
ASSI { 2476}
(( segid " " and resid 324 and name H ))
(( segid " " and resid 323 and name H ))
3.000 1.100 1.100 peak 2476 spectrum 1 weight 0.10000E+01 volume 0.77584E-03 ppm1 8.502 ppm2 7.792 CV 1
ASSI { 1659}
(( segid " " and resid 395 and name HE22))
( segid " " and resid 398 and name HD1%)
3.700 1.700 1.700 peak 1659 spectrum 1 weight 0.10000E+01 volume 0.19290E-02 ppm1 6.979 ppm2 0.568 CV 1
OR { 1659}
(( segid " " and resid 395 and name HE22))
(( segid " " and resid 398 and name HG12))
ASSI { 2261}
(( segid " " and resid 395 and name HE21))
(( segid " " and resid 395 and name HA ))
3.000 1.200 1.200 peak 2261 spectrum 1 weight 0.10000E+01 volume 0.11262E-02 ppm1 7.772 ppm2 3.762 CV 1
ASSI { 3195}
(( segid " " and resid 417 and name HE22))
(( segid " " and resid 417 and name HG3 ))
3.400 1.400 1.400 peak 3195 spectrum 1 weight 0.10000E+01 volume 0.39850E-02 ppm1 6.741 ppm2 2.382 CV 1
OR { 3195}
(( segid " " and resid 417 and name HE22))
(( segid " " and resid 417 and name HG2 ))
ASSI { 2552}
(( segid " " and resid 404 and name H ))
(( segid " " and resid 404 and name HA ))
3.200 1.300 1.300 peak 2552 spectrum 1 weight 0.10000E+01 volume 0.79315E-03 ppm1 7.637 ppm2 3.457 CV 1
ASSI { 2238}
(( segid " " and resid 334 and name H ))
(( segid " " and resid 334 and name HB3 ))
2.900 1.000 1.000 peak 2238 spectrum 1 weight 0.10000E+01 volume 0.23910E-02 ppm1 8.129 ppm2 1.969 CV 1
OR { 2238}
(( segid " " and resid 334 and name H ))
(( segid " " and resid 334 and name HB2 ))
ASSI { 809}
(( segid " " and resid 238 and name H ))
( segid " " and resid 236 and name HG2%)
2.500 0.800 0.800 peak 809 spectrum 1 weight 0.10000E+01 volume 0.14612E-02 ppm1 8.663 ppm2 0.971 CV 1
ASSI { 2320}
(( segid " " and resid 216 and name H ))
(( segid " " and resid 215 and name H ))
3.100 1.200 1.200 peak 2320 spectrum 1 weight 0.10000E+01 volume 0.10338E-02 ppm1 7.633 ppm2 8.896 CV 1
ASSI { 2892}
(( segid " " and resid 395 and name HE22))
(( segid " " and resid 395 and name HG3 ))
3.700 1.700 1.700 peak 2892 spectrum 1 weight 0.10000E+01 volume 0.24161E-02 ppm1 6.979 ppm2 2.453 CV 1
ASSI { 2511}
(( segid " " and resid 301 and name HE21))
( segid " " and resid 300 and name HG2%)
4.100 2.100 1.900 peak 2511 spectrum 1 weight 0.10000E+01 volume 0.25989E-03 ppm1 6.702 ppm2 0.549 CV 1
ASSI { 1086}
(( segid " " and resid 422 and name H ))
(( segid " " and resid 425 and name H ))
4.600 2.600 1.400 peak 1086 spectrum 1 weight 0.10000E+01 volume 0.44087E-03 ppm1 8.201 ppm2 7.762 CV 1
ASSI { 2717}
(( segid " " and resid 340 and name HE21))
(( segid " " and resid 340 and name H ))
5.000 3.100 1.000 peak 2717 spectrum 1 weight 0.10000E+01 volume 0.44278E-03 ppm1 6.783 ppm2 8.168 CV 1
ASSI { 2139}
(( segid " " and resid 211 and name H ))
( segid " " and resid 201 and name HG2%)
4.500 2.500 1.500 peak 2139 spectrum 1 weight 0.10000E+01 volume 0.73350E-03 ppm1 7.468 ppm2 1.314 CV 1
ASSI { 558}
(( segid " " and resid 337 and name H ))
(( segid " " and resid 332 and name HB3 ))
3.900 1.900 1.900 peak 558 spectrum 1 weight 0.10000E+01 volume 0.71809E-03 ppm1 7.316 ppm2 2.601 CV 1
ASSI { 1712}
(( segid " " and resid 324 and name H ))
( segid " " and resid 364 and name HG2%)
4.700 2.700 1.300 peak 1712 spectrum 1 weight 0.10000E+01 volume 0.93946E-03 ppm1 8.502 ppm2 0.907 CV 1
ASSI { 2627}
(( segid " " and resid 207 and name H ))
( segid " " and resid 207 and name HG2%)
3.200 1.300 1.300 peak 2627 spectrum 1 weight 0.10000E+01 volume 0.14246E-02 ppm1 6.899 ppm2 0.464 CV 1
ASSI { 2391}
(( segid " " and resid 232 and name H ))
( segid " " and resid 337 and name HE% )
3.200 1.300 1.300 peak 2391 spectrum 1 weight 0.10000E+01 volume 0.16402E-02 ppm1 8.794 ppm2 1.799 CV 1
ASSI { 2050}
(( segid " " and resid 261 and name H ))
( segid " " and resid 263 and name HG1%)
5.400 3.700 0.600 peak 2050 spectrum 1 weight 0.10000E+01 volume 0.33883E-03 ppm1 8.908 ppm2 0.065 CV 1
ASSI { 1480}
(( segid " " and resid 245 and name H ))
(( segid " " and resid 244 and name HA ))
3.300 1.300 1.300 peak 1480 spectrum 1 weight 0.10000E+01 volume 0.12456E-02 ppm1 7.533 ppm2 3.289 CV 1
ASSI { 2407}
(( segid " " and resid 269 and name HE22))
(( segid " " and resid 269 and name HA ))
3.700 1.800 1.800 peak 2407 spectrum 1 weight 0.10000E+01 volume 0.10646E-02 ppm1 6.866 ppm2 3.814 CV 1
ASSI { 1365}
(( segid " " and resid 347 and name H ))
(( segid " " and resid 348 and name HD2 ))
3.000 1.100 1.100 peak 1365 spectrum 1 weight 0.10000E+01 volume 0.89327E-03 ppm1 9.034 ppm2 3.554 CV 1
ASSI { 1441}
(( segid " " and resid 297 and name H ))
( segid " " and resid 300 and name HG1%)
4.700 2.800 1.300 peak 1441 spectrum 1 weight 0.10000E+01 volume 0.44278E-03 ppm1 8.069 ppm2 0.086 CV 1
ASSI { 1452}
(( segid " " and resid 274 and name H ))
(( segid " " and resid 273 and name HB3 ))
4.000 2.000 2.000 peak 1452 spectrum 1 weight 0.10000E+01 volume 0.74502E-03 ppm1 7.024 ppm2 2.464 CV 1
ASSI { 249}
(( segid " " and resid 314 and name HD21))
( segid " " and resid 194 and name HD2%)
4.300 2.300 1.700 peak 249 spectrum 1 weight 0.10000E+01 volume 0.40622E-03 ppm1 7.384 ppm2 0.557 CV 1
ASSI { 569}
(( segid " " and resid 266 and name H ))
(( segid " " and resid 267 and name HB3 ))
3.900 1.900 1.900 peak 569 spectrum 1 weight 0.10000E+01 volume 0.86246E-03 ppm1 8.234 ppm2 2.267 CV 1
ASSI { 1843}
(( segid " " and resid 411 and name H ))
(( segid " " and resid 411 and name HB3 ))
3.400 1.500 1.500 peak 1843 spectrum 1 weight 0.10000E+01 volume 0.16653E-02 ppm1 7.728 ppm2 2.992 CV 1
ASSI { 1110}
(( segid " " and resid 394 and name H ))
(( segid " " and resid 393 and name HB2 ))
3.500 1.500 1.500 peak 1110 spectrum 1 weight 0.10000E+01 volume 0.22717E-02 ppm1 7.545 ppm2 2.111 CV 1
OR { 1110}
(( segid " " and resid 394 and name H ))
(( segid " " and resid 393 and name HG2 ))
ASSI { 2158}
(( segid " " and resid 185 and name HD21))
(( segid " " and resid 189 and name H ))
5.500 3.800 0.500 peak 2158 spectrum 1 weight 0.10000E+01 volume 0.36578E-03 ppm1 6.788 ppm2 8.875 CV 1
ASSI { 1040}
(( segid " " and resid 320 and name HE1 ))
(( segid " " and resid 372 and name H ))
3.900 1.900 1.900 peak 1040 spectrum 1 weight 0.10000E+01 volume 0.47165E-03 ppm1 10.126 ppm2 7.879 CV 1
ASSI { 1211}
(( segid " " and resid 430 and name HE1 ))
(( segid " " and resid 430 and name HD1 ))
2.000 0.500 0.500 peak 1211 spectrum 1 weight 0.10000E+01 volume 0.18004E-01 ppm1 10.080 ppm2 7.183 CV 1
ASSI { 3123}
(( segid " " and resid 304 and name H ))
( segid " " and resid 303 and name HD% )
4.500 2.500 1.500 peak 3123 spectrum 1 weight 0.10000E+01 volume 0.94140E-03 ppm1 8.674 ppm2 7.071 CV 1
ASSI { 2482}
(( segid " " and resid 433 and name HE21))
( segid " " and resid 432 and name HG1%)
3.700 1.800 1.800 peak 2482 spectrum 1 weight 0.10000E+01 volume 0.45624E-03 ppm1 6.969 ppm2 1.099 CV 1
ASSI { 1993}
(( segid " " and resid 216 and name H ))
(( segid " " and resid 212 and name HA ))
4.400 2.400 1.600 peak 1993 spectrum 1 weight 0.10000E+01 volume 0.53328E-03 ppm1 7.637 ppm2 3.240 CV 1
ASSI { 2377}
(( segid " " and resid 413 and name H ))
(( segid " " and resid 413 and name HA ))
3.100 1.200 1.200 peak 2377 spectrum 1 weight 0.10000E+01 volume 0.16094E-02 ppm1 8.484 ppm2 4.205 CV 1
ASSI { 1641}
(( segid " " and resid 422 and name H ))
(( segid " " and resid 421 and name HE3 ))
3.000 3.000 3.000 peak 1641 spectrum 1 weight 0.10000E+01 volume 0.45624E-03 ppm1 8.202 ppm2 2.903 CV 1
OR { 1641}
(( segid " " and resid 422 and name H ))
(( segid " " and resid 421 and name HE2 ))
ASSI { 2889}
(( segid " " and resid 214 and name H ))
( segid " " and resid 213 and name HD% )
3.900 1.900 1.900 peak 2889 spectrum 1 weight 0.10000E+01 volume 0.61412E-03 ppm1 7.189 ppm2 6.710 CV 1
ASSI { 3073}
(( segid " " and resid 341 and name HD21))
(( segid " " and resid 337 and name HA ))
3.300 1.300 1.300 peak 3073 spectrum 1 weight 0.10000E+01 volume 0.14362E-02 ppm1 6.992 ppm2 4.987 CV 1
ASSI { 1567}
(( segid " " and resid 214 and name H ))
( segid " " and resid 212 and name HG1%)
5.400 3.700 0.600 peak 1567 spectrum 1 weight 0.10000E+01 volume 0.29455E-03 ppm1 7.201 ppm2 -0.321 CV 1
ASSI { 1482}
(( segid " " and resid 341 and name HD21))
(( segid " " and resid 341 and name H ))
4.400 2.400 1.600 peak 1482 spectrum 1 weight 0.10000E+01 volume 0.51403E-03 ppm1 6.988 ppm2 8.539 CV 1
ASSI { 2904}
(( segid " " and resid 232 and name H ))
(( segid " " and resid 232 and name HD3 ))
5.000 3.200 1.000 peak 2904 spectrum 1 weight 0.10000E+01 volume 0.40237E-03 ppm1 8.791 ppm2 3.000 CV 1
ASSI { 3053}
(( segid " " and resid 361 and name H ))
( segid " " and resid 359 and name HG2%)
5.200 3.400 0.800 peak 3053 spectrum 1 weight 0.10000E+01 volume 0.27530E-03 ppm1 8.408 ppm2 -0.452 CV 1
ASSI { 3093}
(( segid " " and resid 378 and name H ))
(( segid " " and resid 379 and name HD2 ))
5.000 3.200 1.000 peak 3093 spectrum 1 weight 0.10000E+01 volume 0.51787E-03 ppm1 8.589 ppm2 3.628 CV 1
ASSI { 1854}
(( segid " " and resid 318 and name H ))
(( segid " " and resid 319 and name HG ))
5.100 3.300 0.900 peak 1854 spectrum 1 weight 0.10000E+01 volume 0.30225E-03 ppm1 8.052 ppm2 4.099 CV 1
ASSI { 1210}
(( segid " " and resid 349 and name H ))
(( segid " " and resid 349 and name HB ))
2.800 1.000 1.000 peak 1210 spectrum 1 weight 0.10000E+01 volume 0.15459E-02 ppm1 7.112 ppm2 4.433 CV 1
ASSI { 2990}
(( segid " " and resid 228 and name H ))
(( segid " " and resid 229 and name H ))
4.800 2.900 1.200 peak 2990 spectrum 1 weight 0.10000E+01 volume 0.55831E-03 ppm1 8.440 ppm2 9.622 CV 1
ASSI { 1358}
(( segid " " and resid 360 and name H ))
(( segid " " and resid 360 and name HB3 ))
3.600 1.600 1.600 peak 1358 spectrum 1 weight 0.10000E+01 volume 0.13611E-02 ppm1 7.279 ppm2 3.099 CV 1
ASSI { 2950}
(( segid " " and resid 258 and name H ))
(( segid " " and resid 258 and name HB2 ))
2.700 0.900 0.900 peak 2950 spectrum 1 weight 0.10000E+01 volume 0.21927E-02 ppm1 8.131 ppm2 2.678 CV 1
OR { 2950}
(( segid " " and resid 258 and name H ))
(( segid " " and resid 258 and name HB3 ))
ASSI { 449}
(( segid " " and resid 221 and name H ))
(( segid " " and resid 217 and name HA ))
4.100 2.100 1.900 peak 449 spectrum 1 weight 0.10000E+01 volume 0.32343E-03 ppm1 8.752 ppm2 2.997 CV 1
ASSI { 2324}
(( segid " " and resid 310 and name H ))
( segid " " and resid 283 and name HD1%)
3.200 3.200 2.800 peak 2324 spectrum 1 weight 0.10000E+01 volume 0.31188E-03 ppm1 7.056 ppm2 0.716 CV 1
ASSI { 1081}
(( segid " " and resid 342 and name H ))
( segid " " and resid 329 and name HD1%)
5.300 3.500 0.700 peak 1081 spectrum 1 weight 0.10000E+01 volume 0.32343E-03 ppm1 8.644 ppm2 0.138 CV 1
ASSI { 1873}
(( segid " " and resid 424 and name H ))
(( segid " " and resid 423 and name HB3 ))
2.500 0.800 0.800 peak 1873 spectrum 1 weight 0.10000E+01 volume 0.45395E-02 ppm1 8.280 ppm2 1.627 CV 1
OR { 1873}
(( segid " " and resid 424 and name H ))
(( segid " " and resid 423 and name HG ))
ASSI { 323}
(( segid " " and resid 437 and name H ))
(( segid " " and resid 436 and name HB2 ))
4.300 2.300 1.700 peak 323 spectrum 1 weight 0.10000E+01 volume 0.66034E-03 ppm1 8.214 ppm2 1.432 CV 1
ASSI { 3193}
(( segid " " and resid 301 and name HE22))
( segid " " and resid 300 and name HG1%)
6.000 5.400 0.000 peak 3193 spectrum 1 weight 0.10000E+01 volume 0.31380E-03 ppm1 7.357 ppm2 0.081 CV 1
ASSI { 1007}
(( segid " " and resid 313 and name H ))
(( segid " " and resid 312 and name H ))
3.000 1.100 1.100 peak 1007 spectrum 1 weight 0.10000E+01 volume 0.16710E-02 ppm1 8.625 ppm2 8.788 CV 1
ASSI { 275}
(( segid " " and resid 310 and name H ))
(( segid " " and resid 314 and name HB3 ))
5.500 3.700 0.500 peak 275 spectrum 1 weight 0.10000E+01 volume 0.49862E-03 ppm1 7.065 ppm2 2.817 CV 1
OR { 275}
(( segid " " and resid 310 and name H ))
(( segid " " and resid 314 and name HB2 ))
ASSI { 1856}
(( segid " " and resid 278 and name H ))
(( segid " " and resid 277 and name HB2 ))
4.400 2.400 1.600 peak 1856 spectrum 1 weight 0.10000E+01 volume 0.41584E-03 ppm1 10.077 ppm2 2.705 CV 1
ASSI { 1129}
(( segid " " and resid 380 and name H ))
(( segid " " and resid 380 and name HA ))
4.100 2.100 1.900 peak 1129 spectrum 1 weight 0.10000E+01 volume 0.34653E-03 ppm1 9.042 ppm2 4.066 CV 1
ASSI { 714}
(( segid " " and resid 421 and name H ))
(( segid " " and resid 422 and name HB2 ))
4.500 2.500 1.500 peak 714 spectrum 1 weight 0.10000E+01 volume 0.28877E-03 ppm1 8.382 ppm2 2.425 CV 1
ASSI { 2488}
(( segid " " and resid 340 and name H ))
(( segid " " and resid 339 and name HB ))
2.600 0.800 0.800 peak 2488 spectrum 1 weight 0.10000E+01 volume 0.29647E-02 ppm1 8.164 ppm2 1.559 CV 1
OR { 2488}
(( segid " " and resid 340 and name H ))
(( segid " " and resid 339 and name HG13))
ASSI { 1953}
(( segid " " and resid 376 and name H ))
(( segid " " and resid 375 and name HB2 ))
3.100 1.200 1.200 peak 1953 spectrum 1 weight 0.10000E+01 volume 0.16941E-02 ppm1 9.516 ppm2 1.879 CV 1
OR { 1953}
(( segid " " and resid 376 and name H ))
(( segid " " and resid 375 and name HB3 ))
ASSI { 2359}
(( segid " " and resid 252 and name H ))
(( segid " " and resid 252 and name HB3 ))
2.900 1.100 1.100 peak 2359 spectrum 1 weight 0.10000E+01 volume 0.33305E-02 ppm1 8.424 ppm2 3.719 CV 1
OR { 2359}
(( segid " " and resid 252 and name H ))
(( segid " " and resid 252 and name HB2 ))
ASSI { 2033}
(( segid " " and resid 319 and name H ))
(( segid " " and resid 319 and name HB2 ))
3.000 1.100 1.100 peak 2033 spectrum 1 weight 0.10000E+01 volume 0.13669E-02 ppm1 7.859 ppm2 3.308 CV 1
ASSI { 5}
(( segid " " and resid 355 and name H ))
( segid " " and resid 356 and name HG2%)
5.100 3.200 0.900 peak 5 spectrum 1 weight 0.10000E+01 volume 0.34268E-03 ppm1 8.074 ppm2 0.381 CV 1
ASSI { 9}
(( segid " " and resid 390 and name H ))
( segid " " and resid 391 and name HD2%)
6.000 5.100 0.000 peak 9 spectrum 1 weight 0.10000E+01 volume 0.31958E-03 ppm1 8.068 ppm2 0.537 CV 1
ASSI { 1861}
(( segid " " and resid 295 and name H ))
(( segid " " and resid 294 and name H ))
2.300 0.600 0.600 peak 1861 spectrum 1 weight 0.10000E+01 volume 0.32939E-02 ppm1 7.396 ppm2 8.530 CV 1
ASSI { 3119}
(( segid " " and resid 298 and name H ))
( segid " " and resid 300 and name HG1%)
5.400 3.600 0.600 peak 3119 spectrum 1 weight 0.10000E+01 volume 0.33883E-03 ppm1 7.336 ppm2 0.078 CV 1
ASSI { 1157}
(( segid " " and resid 192 and name H ))
(( segid " " and resid 192 and name HA ))
3.200 1.300 1.300 peak 1157 spectrum 1 weight 0.10000E+01 volume 0.63531E-03 ppm1 6.707 ppm2 4.860 CV 1
ASSI { 995}
(( segid " " and resid 360 and name H ))
( segid " " and resid 359 and name HG1%)
2.700 0.900 0.900 peak 995 spectrum 1 weight 0.10000E+01 volume 0.19463E-02 ppm1 7.278 ppm2 0.897 CV 1
ASSI { 1542}
(( segid " " and resid 281 and name H ))
(( segid " " and resid 280 and name H ))
3.900 1.900 1.900 peak 1542 spectrum 1 weight 0.10000E+01 volume 0.13976E-02 ppm1 9.176 ppm2 7.645 CV 1
ASSI { 2902}
(( segid " " and resid 268 and name H ))
( segid " " and resid 231 and name HE% )
2.900 2.900 3.100 peak 2902 spectrum 1 weight 0.10000E+01 volume 0.56600E-03 ppm1 7.873 ppm2 6.786 CV 1
OR { 2902}
(( segid " " and resid 268 and name H ))
( segid " " and resid 231 and name HD% )
ASSI { 1592}
(( segid " " and resid 243 and name H ))
(( segid " " and resid 239 and name HA ))
4.400 2.400 1.600 peak 1592 spectrum 1 weight 0.10000E+01 volume 0.37734E-03 ppm1 7.865 ppm2 4.302 CV 1
ASSI { 2340}
(( segid " " and resid 231 and name H ))
(( segid " " and resid 230 and name HB ))
4.800 2.800 1.200 peak 2340 spectrum 1 weight 0.10000E+01 volume 0.51209E-03 ppm1 8.439 ppm2 1.817 CV 1
ASSI { 3138}
(( segid " " and resid 369 and name H ))
(( segid " " and resid 370 and name H ))
2.900 1.000 1.000 peak 3138 spectrum 1 weight 0.10000E+01 volume 0.20060E-02 ppm1 7.756 ppm2 8.403 CV 1
ASSI { 2446}
(( segid " " and resid 427 and name H ))
(( segid " " and resid 427 and name HB2 ))
2.500 0.800 0.800 peak 2446 spectrum 1 weight 0.10000E+01 volume 0.50997E-02 ppm1 8.058 ppm2 2.019 CV 1
OR { 2446}
(( segid " " and resid 427 and name H ))
(( segid " " and resid 427 and name HB3 ))
ASSI { 2309}
(( segid " " and resid 362 and name H ))
(( segid " " and resid 361 and name HB2 ))
3.200 1.300 1.300 peak 2309 spectrum 1 weight 0.10000E+01 volume 0.40237E-03 ppm1 7.794 ppm2 3.082 CV 1
ASSI { 1248}
(( segid " " and resid 403 and name H ))
( segid " " and resid 402 and name HG2%)
3.000 1.200 1.200 peak 1248 spectrum 1 weight 0.10000E+01 volume 0.29147E-02 ppm1 7.560 ppm2 0.785 CV 1
ASSI { 213}
(( segid " " and resid 265 and name H ))
(( segid " " and resid 261 and name HA ))
3.800 1.800 1.800 peak 213 spectrum 1 weight 0.10000E+01 volume 0.59103E-03 ppm1 7.754 ppm2 4.514 CV 1
ASSI { 2713}
(( segid " " and resid 420 and name H ))
(( segid " " and resid 420 and name HG12))
3.200 1.300 1.300 peak 2713 spectrum 1 weight 0.10000E+01 volume 0.49841E-02 ppm1 7.494 ppm2 1.124 CV 1
ASSI { 1310}
(( segid " " and resid 357 and name H ))
(( segid " " and resid 357 and name HA ))
2.900 1.000 1.000 peak 1310 spectrum 1 weight 0.10000E+01 volume 0.88171E-03 ppm1 8.146 ppm2 3.870 CV 1
ASSI { 3164}
(( segid " " and resid 274 and name H ))
(( segid " " and resid 274 and name HA ))
2.900 1.000 1.000 peak 3164 spectrum 1 weight 0.10000E+01 volume 0.16518E-02 ppm1 7.027 ppm2 3.996 CV 1
ASSI { 887}
(( segid " " and resid 268 and name H ))
(( segid " " and resid 268 and name HE3 ))
5.200 3.300 0.800 peak 887 spectrum 1 weight 0.10000E+01 volume 0.48706E-03 ppm1 7.862 ppm2 3.220 CV 1
OR { 887}
(( segid " " and resid 268 and name H ))
(( segid " " and resid 268 and name HE2 ))
ASSI { 2680}
(( segid " " and resid 301 and name H ))
(( segid " " and resid 300 and name HA ))
3.300 1.400 1.400 peak 2680 spectrum 1 weight 0.10000E+01 volume 0.10704E-02 ppm1 8.075 ppm2 2.917 CV 1
ASSI { 2234}
(( segid " " and resid 209 and name H ))
(( segid " " and resid 210 and name HD3 ))
4.400 2.500 1.600 peak 2234 spectrum 1 weight 0.10000E+01 volume 0.66224E-03 ppm1 7.824 ppm2 2.915 CV 1
ASSI { 1006}
(( segid " " and resid 369 and name H ))
(( segid " " and resid 368 and name HB3 ))
2.700 0.900 0.900 peak 1006 spectrum 1 weight 0.10000E+01 volume 0.84705E-03 ppm1 7.755 ppm2 2.719 CV 1
ASSI { 855}
(( segid " " and resid 421 and name H ))
(( segid " " and resid 421 and name HG2 ))
3.500 1.500 1.500 peak 855 spectrum 1 weight 0.10000E+01 volume 0.26952E-02 ppm1 8.386 ppm2 1.336 CV 1
OR { 855}
(( segid " " and resid 421 and name H ))
(( segid " " and resid 421 and name HG3 ))
ASSI { 858}
(( segid " " and resid 297 and name H ))
(( segid " " and resid 295 and name HB ))
3.100 1.200 1.200 peak 858 spectrum 1 weight 0.10000E+01 volume 0.26413E-02 ppm1 8.072 ppm2 4.397 CV 1
ASSI { 267}
(( segid " " and resid 445 and name H ))
(( segid " " and resid 445 and name HG2 ))
3.700 1.700 1.700 peak 267 spectrum 1 weight 0.10000E+01 volume 0.41274E-02 ppm1 7.906 ppm2 2.256 CV 1
OR { 267}
(( segid " " and resid 445 and name H ))
(( segid " " and resid 445 and name HG3 ))
ASSI { 2937}
(( segid " " and resid 343 and name H ))
( segid " " and resid 329 and name HD1%)
5.100 3.300 0.900 peak 2937 spectrum 1 weight 0.10000E+01 volume 0.32920E-03 ppm1 8.201 ppm2 0.119 CV 1
ASSI { 2065}
(( segid " " and resid 326 and name H ))
(( segid " " and resid 326 and name HB2 ))
2.900 1.000 1.000 peak 2065 spectrum 1 weight 0.10000E+01 volume 0.16768E-02 ppm1 8.928 ppm2 2.864 CV 1
ASSI { 1850}
(( segid " " and resid 419 and name H ))
(( segid " " and resid 419 and name HA2 ))
2.400 0.700 0.700 peak 1850 spectrum 1 weight 0.10000E+01 volume 0.54096E-02 ppm1 7.959 ppm2 3.791 CV 1
ASSI { 2980}
(( segid " " and resid 327 and name H ))
( segid " " and resid 329 and name HD1%)
6.000 4.700 0.000 peak 2980 spectrum 1 weight 0.10000E+01 volume 0.27337E-03 ppm1 7.608 ppm2 0.131 CV 1
ASSI { 162}
(( segid " " and resid 216 and name H ))
(( segid " " and resid 218 and name H ))
4.400 2.400 1.600 peak 162 spectrum 1 weight 0.10000E+01 volume 0.37156E-03 ppm1 7.638 ppm2 7.966 CV 1
ASSI { 2985}
(( segid " " and resid 295 and name H ))
(( segid " " and resid 295 and name HA ))
2.400 0.700 0.700 peak 2985 spectrum 1 weight 0.10000E+01 volume 0.40911E-02 ppm1 7.396 ppm2 4.732 CV 1
ASSI { 2161}
(( segid " " and resid 267 and name H ))
( segid " " and resid 231 and name HE% )
4.300 2.400 1.700 peak 2161 spectrum 1 weight 0.10000E+01 volume 0.53518E-03 ppm1 8.067 ppm2 6.781 CV 1
ASSI { 2804}
(( segid " " and resid 431 and name H ))
(( segid " " and resid 430 and name HE3 ))
4.700 2.800 1.300 peak 2804 spectrum 1 weight 0.10000E+01 volume 0.47937E-03 ppm1 7.962 ppm2 7.544 CV 1
ASSI { 1779}
(( segid " " and resid 314 and name H ))
(( segid " " and resid 311 and name HD3 ))
5.000 3.100 1.000 peak 1779 spectrum 1 weight 0.10000E+01 volume 0.95296E-03 ppm1 7.345 ppm2 3.140 CV 1
ASSI { 2015}
(( segid " " and resid 254 and name H ))
(( segid " " and resid 253 and name HB ))
3.800 1.800 1.800 peak 2015 spectrum 1 weight 0.10000E+01 volume 0.18597E-02 ppm1 8.709 ppm2 3.531 CV 1
ASSI { 1273}
(( segid " " and resid 388 and name H ))
(( segid " " and resid 387 and name HB ))
2.100 0.600 0.600 peak 1273 spectrum 1 weight 0.10000E+01 volume 0.31476E-02 ppm1 8.233 ppm2 4.029 CV 1
ASSI { 2572}
(( segid " " and resid 382 and name HE1 ))
(( segid " " and resid 385 and name HA ))
3.200 1.300 1.300 peak 2572 spectrum 1 weight 0.10000E+01 volume 0.22774E-02 ppm1 9.605 ppm2 4.186 CV 1
ASSI { 1009}
(( segid " " and resid 360 and name H ))
(( segid " " and resid 359 and name HB ))
3.800 1.800 1.800 peak 1009 spectrum 1 weight 0.10000E+01 volume 0.16017E-02 ppm1 7.277 ppm2 1.606 CV 1
ASSI { 1151}
(( segid " " and resid 249 and name H ))
(( segid " " and resid 248 and name HA ))
3.800 1.800 1.800 peak 1151 spectrum 1 weight 0.10000E+01 volume 0.66996E-03 ppm1 7.299 ppm2 4.870 CV 1
ASSI { 782}
(( segid " " and resid 373 and name H ))
( segid " " and resid 373 and name HD2%)
2.600 0.800 0.800 peak 782 spectrum 1 weight 0.10000E+01 volume 0.25393E-02 ppm1 8.240 ppm2 0.460 CV 1
OR { 782}
(( segid " " and resid 373 and name H ))
(( segid " " and resid 373 and name HB2 ))
ASSI { 2002}
(( segid " " and resid 236 and name H ))
(( segid " " and resid 236 and name HA ))
2.800 1.000 1.000 peak 2002 spectrum 1 weight 0.10000E+01 volume 0.23410E-02 ppm1 7.803 ppm2 4.020 CV 1
ASSI { 1550}
(( segid " " and resid 358 and name H ))
(( segid " " and resid 358 and name HB3 ))
2.700 0.900 0.900 peak 1550 spectrum 1 weight 0.10000E+01 volume 0.27895E-02 ppm1 8.560 ppm2 2.951 CV 1
ASSI { 2116}
(( segid " " and resid 304 and name H ))
( segid " " and resid 300 and name HG1%)
5.800 4.200 0.200 peak 2116 spectrum 1 weight 0.10000E+01 volume 0.33690E-03 ppm1 8.672 ppm2 0.075 CV 1
ASSI { 3158}
(( segid " " and resid 185 and name H ))
(( segid " " and resid 184 and name HA ))
2.800 1.000 1.000 peak 3158 spectrum 1 weight 0.10000E+01 volume 0.48589E-02 ppm1 8.461 ppm2 4.322 CV 1
ASSI { 2739}
(( segid " " and resid 237 and name H ))
(( segid " " and resid 236 and name HG12))
5.600 3.900 0.400 peak 2739 spectrum 1 weight 0.10000E+01 volume 0.31188E-03 ppm1 8.770 ppm2 1.122 CV 1
ASSI { 1150}
(( segid " " and resid 350 and name H ))
(( segid " " and resid 350 and name HB ))
4.500 2.500 1.500 peak 1150 spectrum 1 weight 0.10000E+01 volume 0.42737E-03 ppm1 7.628 ppm2 2.494 CV 1
ASSI { 1366}
(( segid " " and resid 335 and name H ))
(( segid " " and resid 334 and name HG3 ))
3.200 1.300 1.300 peak 1366 spectrum 1 weight 0.10000E+01 volume 0.11397E-02 ppm1 8.876 ppm2 2.181 CV 1
OR { 1366}
(( segid " " and resid 335 and name H ))
(( segid " " and resid 334 and name HG2 ))
ASSI { 2797}
(( segid " " and resid 446 and name H ))
(( segid " " and resid 445 and name H ))
1.800 0.400 0.400 peak 2797 spectrum 1 weight 0.10000E+01 volume 0.13605E-01 ppm1 7.644 ppm2 7.918 CV 1
ASSI { 2468}
(( segid " " and resid 325 and name H ))
(( segid " " and resid 325 and name HA ))
2.900 1.000 1.000 peak 2468 spectrum 1 weight 0.10000E+01 volume 0.10473E-02 ppm1 8.509 ppm2 3.891 CV 1
ASSI { 1284}
(( segid " " and resid 304 and name HE22))
(( segid " " and resid 304 and name HB3 ))
4.100 2.100 1.900 peak 1284 spectrum 1 weight 0.10000E+01 volume 0.19425E-02 ppm1 7.014 ppm2 1.881 CV 1
ASSI { 2606}
(( segid " " and resid 261 and name H ))
(( segid " " and resid 261 and name HD22))
3.700 1.700 1.700 peak 2606 spectrum 1 weight 0.10000E+01 volume 0.11070E-02 ppm1 8.909 ppm2 6.622 CV 1
ASSI { 245}
(( segid " " and resid 340 and name HE21))
( segid " " and resid 344 and name HD1%)
3.100 1.200 1.200 peak 245 spectrum 1 weight 0.10000E+01 volume 0.25123E-02 ppm1 6.786 ppm2 0.835 CV 1
OR { 245}
(( segid " " and resid 340 and name HE21))
( segid " " and resid 344 and name HG2%)
ASSI { 1352}
(( segid " " and resid 284 and name H ))
(( segid " " and resid 284 and name HB2 ))
2.400 0.700 0.700 peak 1352 spectrum 1 weight 0.10000E+01 volume 0.37618E-02 ppm1 8.115 ppm2 2.246 CV 1
OR { 1352}
(( segid " " and resid 284 and name H ))
(( segid " " and resid 284 and name HB3 ))
OR { 1352}
(( segid " " and resid 284 and name H ))
( segid " " and resid 284 and name HE% )
ASSI { 1460}
(( segid " " and resid 186 and name H ))
( segid " " and resid 186 and name HD2%)
2.700 0.900 0.900 peak 1460 spectrum 1 weight 0.10000E+01 volume 0.39754E-02 ppm1 8.054 ppm2 0.813 CV 1
OR { 1460}
(( segid " " and resid 186 and name H ))
( segid " " and resid 186 and name HD1%)
ASSI { 26}
(( segid " " and resid 327 and name H ))
(( segid " " and resid 324 and name HA ))
2.700 0.900 0.900 peak 26 spectrum 1 weight 0.10000E+01 volume 0.26933E-02 ppm1 7.614 ppm2 3.955 CV 1
ASSI { 1056}
(( segid " " and resid 207 and name H ))
( segid " " and resid 316 and name HD2%)
5.600 3.900 0.400 peak 1056 spectrum 1 weight 0.10000E+01 volume 0.42547E-03 ppm1 6.895 ppm2 0.746 CV 1
ASSI { 1517}
(( segid " " and resid 382 and name HE1 ))
(( segid " " and resid 382 and name HB2 ))
4.500 2.500 1.500 peak 1517 spectrum 1 weight 0.10000E+01 volume 0.76043E-03 ppm1 9.606 ppm2 3.146 CV 1
ASSI { 2747}
(( segid " " and resid 360 and name H ))
( segid " " and resid 322 and name HD1%)
5.700 4.100 0.300 peak 2747 spectrum 1 weight 0.10000E+01 volume 0.49284E-03 ppm1 7.285 ppm2 -0.154 CV 1
ASSI { 2499}
(( segid " " and resid 410 and name HD21))
( segid " " and resid 409 and name HD1%)
5.700 4.100 0.300 peak 2499 spectrum 1 weight 0.10000E+01 volume 0.56215E-03 ppm1 6.916 ppm2 0.795 CV 1
ASSI { 907}
(( segid " " and resid 251 and name H ))
(( segid " " and resid 251 and name HB2 ))
2.800 1.000 1.000 peak 907 spectrum 1 weight 0.10000E+01 volume 0.30860E-02 ppm1 7.888 ppm2 1.756 CV 1
ASSI { 2454}
(( segid " " and resid 346 and name H ))
(( segid " " and resid 346 and name HB2 ))
2.500 0.800 0.800 peak 2454 spectrum 1 weight 0.10000E+01 volume 0.23314E-02 ppm1 8.994 ppm2 1.733 CV 1
OR { 2454}
(( segid " " and resid 346 and name H ))
(( segid " " and resid 346 and name HG ))
ASSI { 1346}
(( segid " " and resid 330 and name H ))
(( segid " " and resid 330 and name HA ))
2.900 1.000 1.000 peak 1346 spectrum 1 weight 0.10000E+01 volume 0.25277E-02 ppm1 8.629 ppm2 4.131 CV 1
ASSI { 1994}
(( segid " " and resid 295 and name H ))
(( segid " " and resid 299 and name HG3 ))
4.200 2.200 1.800 peak 1994 spectrum 1 weight 0.10000E+01 volume 0.55443E-03 ppm1 7.394 ppm2 1.399 CV 1
OR { 1994}
(( segid " " and resid 295 and name H ))
(( segid " " and resid 299 and name HG2 ))
ASSI { 1904}
(( segid " " and resid 382 and name HE1 ))
(( segid " " and resid 382 and name HH2 ))
4.700 2.700 1.300 peak 1904 spectrum 1 weight 0.10000E+01 volume 0.11859E-02 ppm1 9.603 ppm2 7.178 CV 1
ASSI { 2816}
(( segid " " and resid 442 and name H ))
(( segid " " and resid 442 and name HG2 ))
2.400 0.700 0.700 peak 2816 spectrum 1 weight 0.10000E+01 volume 0.37424E-02 ppm1 7.553 ppm2 1.625 CV 1
ASSI { 3050}
(( segid " " and resid 296 and name H ))
( segid " " and resid 295 and name HG2%)
3.400 1.400 1.400 peak 3050 spectrum 1 weight 0.10000E+01 volume 0.55637E-03 ppm1 8.925 ppm2 1.179 CV 1
ASSI { 83}
(( segid " " and resid 358 and name H ))
(( segid " " and resid 356 and name H ))
3.500 1.500 1.500 peak 83 spectrum 1 weight 0.10000E+01 volume 0.78109E-03 ppm1 8.551 ppm2 7.337 CV 1
ASSI { 419}
(( segid " " and resid 335 and name H ))
(( segid " " and resid 335 and name HG1 ))
3.700 1.700 1.700 peak 419 spectrum 1 weight 0.10000E+01 volume 0.18809E-03 ppm1 8.875 ppm2 3.574 CV 1
ASSI { 343}
(( segid " " and resid 437 and name H ))
(( segid " " and resid 436 and name H ))
2.600 0.800 0.800 peak 343 spectrum 1 weight 0.10000E+01 volume 0.11248E-02 ppm1 8.209 ppm2 8.925 CV 1
ASSI { 24}
(( segid " " and resid 246 and name H ))
(( segid " " and resid 244 and name H ))
4.400 2.500 1.600 peak 24 spectrum 1 weight 0.10000E+01 volume 0.38453E-03 ppm1 7.448 ppm2 8.534 CV 1
ASSI { 324}
(( segid " " and resid 302 and name H ))
(( segid " " and resid 303 and name H ))
2.200 0.600 0.600 peak 324 spectrum 1 weight 0.10000E+01 volume 0.22284E-02 ppm1 7.985 ppm2 8.705 CV 1
ASSI { 167}
(( segid " " and resid 223 and name H ))
(( segid " " and resid 225 and name H ))
3.900 1.900 1.900 peak 167 spectrum 1 weight 0.10000E+01 volume 0.49943E-03 ppm1 8.425 ppm2 7.792 CV 1
ASSI { 460}
(( segid " " and resid 380 and name H ))
(( segid " " and resid 384 and name HD22))
3.900 1.900 1.900 peak 460 spectrum 1 weight 0.10000E+01 volume 0.70511E-03 ppm1 9.015 ppm2 8.705 CV 1
ASSI { 245}
(( segid " " and resid 345 and name H ))
(( segid " " and resid 344 and name H ))
2.300 0.600 0.600 peak 245 spectrum 1 weight 0.10000E+01 volume 0.12175E-02 ppm1 6.994 ppm2 7.673 CV 1
ASSI { 335}
(( segid " " and resid 212 and name H ))
(( segid " " and resid 213 and name H ))
3.000 1.100 1.100 peak 335 spectrum 1 weight 0.10000E+01 volume 0.50405E-03 ppm1 9.070 ppm2 5.877 CV 1
ASSI { 475}
(( segid " " and resid 214 and name H ))
(( segid " " and resid 213 and name H ))
2.400 0.700 0.700 peak 475 spectrum 1 weight 0.10000E+01 volume 0.12685E-02 ppm1 7.193 ppm2 5.878 CV 1
ASSI { 291}
(( segid " " and resid 334 and name H ))
(( segid " " and resid 333 and name H ))
2.600 0.800 0.800 peak 291 spectrum 1 weight 0.10000E+01 volume 0.10109E-02 ppm1 8.121 ppm2 8.624 CV 1
ASSI { 328}
(( segid " " and resid 274 and name H ))
(( segid " " and resid 273 and name H ))
2.200 0.600 0.600 peak 328 spectrum 1 weight 0.10000E+01 volume 0.25314E-02 ppm1 7.018 ppm2 7.705 CV 1
ASSI { 331}
(( segid " " and resid 358 and name H ))
(( segid " " and resid 357 and name H ))
2.400 0.700 0.700 peak 331 spectrum 1 weight 0.10000E+01 volume 0.16400E-02 ppm1 8.549 ppm2 8.133 CV 1
ASSI { 266}
(( segid " " and resid 410 and name H ))
(( segid " " and resid 409 and name H ))
2.600 0.800 0.800 peak 266 spectrum 1 weight 0.10000E+01 volume 0.12268E-02 ppm1 7.883 ppm2 8.733 CV 1
ASSI { 155}
(( segid " " and resid 201 and name H ))
(( segid " " and resid 201 and name HG1 ))
2.900 1.100 1.100 peak 155 spectrum 1 weight 0.10000E+01 volume 0.82371E-03 ppm1 7.490 ppm2 4.454 CV 1
ASSI { 205}
(( segid " " and resid 317 and name H ))
(( segid " " and resid 315 and name H ))
3.800 1.800 1.800 peak 205 spectrum 1 weight 0.10000E+01 volume 0.53183E-03 ppm1 7.509 ppm2 8.315 CV 1
ASSI { 272}
(( segid " " and resid 334 and name H ))
(( segid " " and resid 337 and name H ))
5.800 4.200 0.200 peak 272 spectrum 1 weight 0.10000E+01 volume 0.26222E-03 ppm1 8.116 ppm2 7.334 CV 1
ASSI { 164}
(( segid " " and resid 284 and name H ))
(( segid " " and resid 282 and name H ))
3.500 1.500 1.500 peak 164 spectrum 1 weight 0.10000E+01 volume 0.68195E-03 ppm1 8.108 ppm2 8.690 CV 1
ASSI { 383}
(( segid " " and resid 435 and name H ))
(( segid " " and resid 436 and name H ))
2.600 0.800 0.800 peak 383 spectrum 1 weight 0.10000E+01 volume 0.12861E-02 ppm1 8.206 ppm2 8.926 CV 1
ASSI { 502}
(( segid " " and resid 330 and name H ))
(( segid " " and resid 329 and name H ))
3.000 1.100 1.100 peak 502 spectrum 1 weight 0.10000E+01 volume 0.56797E-03 ppm1 8.617 ppm2 7.946 CV 1
ASSI { 501}
(( segid " " and resid 407 and name H ))
(( segid " " and resid 406 and name H ))
2.600 0.900 0.900 peak 501 spectrum 1 weight 0.10000E+01 volume 0.12574E-02 ppm1 7.788 ppm2 9.255 CV 1
ASSI { 415}
(( segid " " and resid 249 and name H ))
(( segid " " and resid 250 and name H ))
2.400 0.700 0.700 peak 415 spectrum 1 weight 0.10000E+01 volume 0.17716E-02 ppm1 7.300 ppm2 8.044 CV 1
ASSI { 450}
(( segid " " and resid 384 and name HD22))
(( segid " " and resid 384 and name HD21))
3.200 3.200 2.800 peak 450 spectrum 1 weight 0.10000E+01 volume 0.19829E-03 ppm1 8.693 ppm2 6.846 CV 1
ASSI { 74}
(( segid " " and resid 394 and name H ))
(( segid " " and resid 393 and name H ))
2.200 0.600 0.600 peak 74 spectrum 1 weight 0.10000E+01 volume 0.21015E-02 ppm1 7.549 ppm2 8.260 CV 1
ASSI { 507}
(( segid " " and resid 326 and name H ))
(( segid " " and resid 328 and name H ))
4.000 2.000 2.000 peak 507 spectrum 1 weight 0.10000E+01 volume 0.33634E-03 ppm1 8.910 ppm2 7.195 CV 1
ASSI { 208}
(( segid " " and resid 344 and name H ))
(( segid " " and resid 346 and name H ))
3.400 1.500 1.500 peak 208 spectrum 1 weight 0.10000E+01 volume 0.77460E-03 ppm1 7.680 ppm2 8.976 CV 1
ASSI { 209}
(( segid " " and resid 279 and name H ))
(( segid " " and resid 278 and name H ))
2.400 0.700 0.700 peak 209 spectrum 1 weight 0.10000E+01 volume 0.10220E-02 ppm1 9.021 ppm2 10.044 CV 1
ASSI { 414}
(( segid " " and resid 307 and name H ))
(( segid " " and resid 308 and name H ))
2.300 0.700 0.700 peak 414 spectrum 1 weight 0.10000E+01 volume 0.11193E-02 ppm1 8.723 ppm2 7.091 CV 1
ASSI { 467}
(( segid " " and resid 411 and name H ))
(( segid " " and resid 409 and name H ))
4.500 2.600 1.500 peak 467 spectrum 1 weight 0.10000E+01 volume 0.19643E-03 ppm1 7.714 ppm2 8.725 CV 1
ASSI { 370}
(( segid " " and resid 406 and name H ))
(( segid " " and resid 405 and name H ))
2.600 0.900 0.900 peak 370 spectrum 1 weight 0.10000E+01 volume 0.10442E-02 ppm1 9.254 ppm2 8.348 CV 1
ASSI { 384}
(( segid " " and resid 191 and name H ))
(( segid " " and resid 192 and name H ))
2.500 0.800 0.800 peak 384 spectrum 1 weight 0.10000E+01 volume 0.67268E-03 ppm1 9.237 ppm2 6.706 CV 1
ASSI { 110}
(( segid " " and resid 350 and name H ))
(( segid " " and resid 351 and name H ))
2.300 0.700 0.700 peak 110 spectrum 1 weight 0.10000E+01 volume 0.12286E-02 ppm1 7.617 ppm2 7.888 CV 1
ASSI { 497}
(( segid " " and resid 214 and name H ))
(( segid " " and resid 212 and name H ))
4.300 2.300 1.700 peak 497 spectrum 1 weight 0.10000E+01 volume 0.41510E-03 ppm1 7.195 ppm2 9.066 CV 1
ASSI { 157}
(( segid " " and resid 369 and name H ))
(( segid " " and resid 368 and name H ))
3.000 1.100 1.100 peak 157 spectrum 1 weight 0.10000E+01 volume 0.18355E-02 ppm1 7.742 ppm2 8.193 CV 1
ASSI { 364}
(( segid " " and resid 428 and name H ))
(( segid " " and resid 427 and name H ))
2.300 0.700 0.700 peak 364 spectrum 1 weight 0.10000E+01 volume 0.25388E-02 ppm1 7.725 ppm2 8.059 CV 1
ASSI { 188}
(( segid " " and resid 336 and name H ))
(( segid " " and resid 335 and name HG1 ))
4.300 2.300 1.700 peak 188 spectrum 1 weight 0.10000E+01 volume 0.26870E-03 ppm1 9.118 ppm2 3.564 CV 1
ASSI { 181}
(( segid " " and resid 360 and name H ))
(( segid " " and resid 361 and name H ))
2.600 0.900 0.900 peak 181 spectrum 1 weight 0.10000E+01 volume 0.10220E-02 ppm1 7.271 ppm2 8.371 CV 1
ASSI { 446}
(( segid " " and resid 364 and name H ))
(( segid " " and resid 363 and name H ))
2.300 0.700 0.700 peak 446 spectrum 1 weight 0.10000E+01 volume 0.16799E-02 ppm1 7.473 ppm2 7.282 CV 1
ASSI { 354}
(( segid " " and resid 282 and name H ))
(( segid " " and resid 280 and name HG1 ))
2.000 0.500 0.500 peak 354 spectrum 1 weight 0.10000E+01 volume 0.75331E-03 ppm1 8.686 ppm2 7.572 CV 1
ASSI { 509}
(( segid " " and resid 298 and name H ))
(( segid " " and resid 299 and name H ))
2.200 0.600 0.600 peak 509 spectrum 1 weight 0.10000E+01 volume 0.15112E-02 ppm1 7.331 ppm2 7.488 CV 1
ASSI { 238}
(( segid " " and resid 331 and name H ))
(( segid " " and resid 329 and name H ))
3.900 1.900 1.900 peak 238 spectrum 1 weight 0.10000E+01 volume 0.31225E-03 ppm1 7.174 ppm2 7.936 CV 1
ASSI { 359}
(( segid " " and resid 243 and name H ))
(( segid " " and resid 242 and name H ))
2.500 0.800 0.800 peak 359 spectrum 1 weight 0.10000E+01 volume 0.17623E-02 ppm1 7.851 ppm2 7.539 CV 1
ASSI { 11}
(( segid " " and resid 369 and name H ))
(( segid " " and resid 372 and name H ))
4.700 2.800 1.300 peak 11 spectrum 1 weight 0.10000E+01 volume 0.10711E-02 ppm1 7.742 ppm2 7.897 CV 1
ASSI { 192}
(( segid " " and resid 359 and name H ))
(( segid " " and resid 357 and name H ))
4.200 2.200 1.800 peak 192 spectrum 1 weight 0.10000E+01 volume 0.48551E-03 ppm1 7.191 ppm2 8.129 CV 1
ASSI { 97}
(( segid " " and resid 284 and name H ))
(( segid " " and resid 281 and name H ))
4.400 2.400 1.600 peak 97 spectrum 1 weight 0.10000E+01 volume 0.25851E-03 ppm1 8.106 ppm2 9.163 CV 1
ASSI { 33}
(( segid " " and resid 313 and name H ))
(( segid " " and resid 314 and name H ))
3.000 1.100 1.100 peak 33 spectrum 1 weight 0.10000E+01 volume 0.75423E-03 ppm1 8.618 ppm2 7.340 CV 1
OR { 33}
(( segid " " and resid 313 and name H ))
(( segid " " and resid 314 and name HD21))
ASSI { 246}
(( segid " " and resid 211 and name H ))
(( segid " " and resid 213 and name H ))
4.800 2.900 1.200 peak 246 spectrum 1 weight 0.10000E+01 volume 0.18439E-03 ppm1 7.475 ppm2 5.875 CV 1
ASSI { 89}
(( segid " " and resid 271 and name H ))
(( segid " " and resid 269 and name H ))
4.000 2.000 2.000 peak 89 spectrum 1 weight 0.10000E+01 volume 0.36507E-03 ppm1 7.658 ppm2 8.201 CV 1
ASSI { 338}
(( segid " " and resid 433 and name H ))
(( segid " " and resid 434 and name H ))
2.400 0.700 0.700 peak 338 spectrum 1 weight 0.10000E+01 volume 0.16687E-02 ppm1 8.309 ppm2 7.986 CV 1
ASSI { 268}
(( segid " " and resid 284 and name H ))
(( segid " " and resid 283 and name H ))
1.900 0.400 0.400 peak 268 spectrum 1 weight 0.10000E+01 volume 0.14862E-02 ppm1 8.107 ppm2 7.320 CV 1
ASSI { 461}
(( segid " " and resid 199 and name H ))
(( segid " " and resid 198 and name H ))
2.500 0.800 0.800 peak 461 spectrum 1 weight 0.10000E+01 volume 0.14667E-02 ppm1 7.770 ppm2 8.602 CV 1
ASSI { 45}
(( segid " " and resid 318 and name H ))
(( segid " " and resid 316 and name H ))
4.300 2.300 1.700 peak 45 spectrum 1 weight 0.10000E+01 volume 0.32245E-03 ppm1 8.020 ppm2 8.702 CV 1
ASSI { 514}
(( segid " " and resid 433 and name H ))
(( segid " " and resid 432 and name H ))
2.500 0.800 0.800 peak 514 spectrum 1 weight 0.10000E+01 volume 0.14695E-02 ppm1 8.308 ppm2 8.469 CV 1
ASSI { 118}
(( segid " " and resid 200 and name H ))
(( segid " " and resid 202 and name H ))
4.400 2.400 1.600 peak 118 spectrum 1 weight 0.10000E+01 volume 0.62727E-03 ppm1 7.616 ppm2 8.202 CV 1
ASSI { 486}
(( segid " " and resid 331 and name H ))
(( segid " " and resid 330 and name H ))
2.600 0.800 0.800 peak 486 spectrum 1 weight 0.10000E+01 volume 0.10257E-02 ppm1 7.176 ppm2 8.612 CV 1
ASSI { 396}
(( segid " " and resid 206 and name H ))
(( segid " " and resid 205 and name H ))
2.200 0.600 0.600 peak 396 spectrum 1 weight 0.10000E+01 volume 0.15937E-02 ppm1 7.660 ppm2 6.377 CV 1
ASSI { 65}
(( segid " " and resid 220 and name H ))
(( segid " " and resid 219 and name H ))
2.700 0.900 0.900 peak 65 spectrum 1 weight 0.10000E+01 volume 0.10183E-02 ppm1 8.662 ppm2 7.707 CV 1
ASSI { 174}
(( segid " " and resid 270 and name H ))
(( segid " " and resid 271 and name H ))
2.600 0.900 0.900 peak 174 spectrum 1 weight 0.10000E+01 volume 0.11591E-02 ppm1 8.543 ppm2 7.668 CV 1
ASSI { 295}
(( segid " " and resid 337 and name H ))
(( segid " " and resid 335 and name HG1 ))
3.200 1.300 1.300 peak 295 spectrum 1 weight 0.10000E+01 volume 0.52351E-03 ppm1 7.321 ppm2 3.564 CV 1
ASSI { 244}
(( segid " " and resid 413 and name H ))
(( segid " " and resid 414 and name H ))
2.500 0.800 0.800 peak 244 spectrum 1 weight 0.10000E+01 volume 0.21561E-02 ppm1 8.485 ppm2 7.664 CV 1
ASSI { 458}
(( segid " " and resid 222 and name H ))
(( segid " " and resid 224 and name H ))
3.700 1.700 1.700 peak 458 spectrum 1 weight 0.10000E+01 volume 0.64490E-03 ppm1 7.243 ppm2 9.030 CV 1
ASSI { 429}
(( segid " " and resid 199 and name H ))
(( segid " " and resid 202 and name H ))
5.600 3.900 0.400 peak 429 spectrum 1 weight 0.10000E+01 volume 0.31781E-03 ppm1 7.770 ppm2 8.215 CV 1
ASSI { 484}
(( segid " " and resid 248 and name H ))
(( segid " " and resid 246 and name H ))
3.800 1.800 1.800 peak 484 spectrum 1 weight 0.10000E+01 volume 0.54946E-03 ppm1 8.882 ppm2 7.464 CV 1
ASSI { 92}
(( segid " " and resid 310 and name H ))
(( segid " " and resid 309 and name H ))
2.300 0.700 0.700 peak 92 spectrum 1 weight 0.10000E+01 volume 0.20422E-02 ppm1 7.062 ppm2 7.482 CV 1
ASSI { 252}
(( segid " " and resid 239 and name H ))
(( segid " " and resid 240 and name H ))
2.300 0.600 0.600 peak 252 spectrum 1 weight 0.10000E+01 volume 0.16669E-02 ppm1 7.094 ppm2 8.001 CV 1
ASSI { 333}
(( segid " " and resid 196 and name H ))
(( segid " " and resid 195 and name H ))
2.800 1.000 1.000 peak 333 spectrum 1 weight 0.10000E+01 volume 0.15853E-02 ppm1 7.186 ppm2 8.977 CV 1
ASSI { 309}
(( segid " " and resid 436 and name H ))
(( segid " " and resid 434 and name H ))
4.000 2.000 2.000 peak 309 spectrum 1 weight 0.10000E+01 volume 0.51237E-03 ppm1 8.925 ppm2 7.987 CV 1
ASSI { 150}
(( segid " " and resid 359 and name H ))
(( segid " " and resid 358 and name H ))
2.700 0.900 0.900 peak 150 spectrum 1 weight 0.10000E+01 volume 0.14946E-02 ppm1 7.193 ppm2 8.555 CV 1
ASSI { 317}
(( segid " " and resid 216 and name H ))
(( segid " " and resid 216 and name HG ))
3.800 1.800 1.800 peak 317 spectrum 1 weight 0.10000E+01 volume 0.81261E-03 ppm1 7.639 ppm2 2.747 CV 1
ASSI { 361}
(( segid " " and resid 200 and name H ))
(( segid " " and resid 201 and name HG1 ))
4.500 2.500 1.500 peak 361 spectrum 1 weight 0.10000E+01 volume 0.60506E-03 ppm1 7.616 ppm2 4.453 CV 1
ASSI { 166}
(( segid " " and resid 244 and name H ))
(( segid " " and resid 245 and name H ))
2.500 0.800 0.800 peak 166 spectrum 1 weight 0.10000E+01 volume 0.17215E-02 ppm1 8.539 ppm2 7.528 CV 1
ASSI { 459}
(( segid " " and resid 282 and name H ))
(( segid " " and resid 283 and name H ))
2.600 0.800 0.800 peak 459 spectrum 1 weight 0.10000E+01 volume 0.11258E-02 ppm1 8.685 ppm2 7.321 CV 1
ASSI { 129}
(( segid " " and resid 349 and name H ))
(( segid " " and resid 350 and name H ))
2.400 0.700 0.700 peak 129 spectrum 1 weight 0.10000E+01 volume 0.14204E-02 ppm1 7.103 ppm2 7.617 CV 1
ASSI { 142}
(( segid " " and resid 308 and name H ))
(( segid " " and resid 309 and name H ))
2.300 0.600 0.600 peak 142 spectrum 1 weight 0.10000E+01 volume 0.14454E-02 ppm1 7.094 ppm2 7.483 CV 1
ASSI { 210}
(( segid " " and resid 218 and name H ))
(( segid " " and resid 219 and name H ))
2.800 1.000 1.000 peak 210 spectrum 1 weight 0.10000E+01 volume 0.96735E-03 ppm1 7.964 ppm2 7.691 CV 1
ASSI { 99}
(( segid " " and resid 316 and name H ))
(( segid " " and resid 314 and name H ))
4.100 2.100 1.900 peak 99 spectrum 1 weight 0.10000E+01 volume 0.56614E-03 ppm1 8.706 ppm2 7.339 CV 1
OR { 99}
(( segid " " and resid 316 and name H ))
(( segid " " and resid 314 and name HD21))
ASSI { 172}
(( segid " " and resid 215 and name H ))
(( segid " " and resid 213 and name H ))
3.500 1.500 1.500 peak 172 spectrum 1 weight 0.10000E+01 volume 0.53462E-03 ppm1 8.884 ppm2 5.872 CV 1
ASSI { 292}
(( segid " " and resid 409 and name H ))
(( segid " " and resid 408 and name H ))
2.300 0.700 0.700 peak 292 spectrum 1 weight 0.10000E+01 volume 0.16224E-02 ppm1 8.727 ppm2 7.478 CV 1
ASSI { 91}
(( segid " " and resid 441 and name H ))
(( segid " " and resid 440 and name H ))
2.400 0.700 0.700 peak 91 spectrum 1 weight 0.10000E+01 volume 0.15427E-02 ppm1 7.617 ppm2 8.420 CV 1
ASSI { 36}
(( segid " " and resid 430 and name H ))
(( segid " " and resid 429 and name H ))
2.900 1.000 1.000 peak 36 spectrum 1 weight 0.10000E+01 volume 0.88301E-03 ppm1 7.768 ppm2 8.116 CV 1
ASSI { 71}
(( segid " " and resid 266 and name H ))
(( segid " " and resid 265 and name H ))
2.500 0.800 0.800 peak 71 spectrum 1 weight 0.10000E+01 volume 0.11100E-02 ppm1 8.224 ppm2 7.748 CV 1
ASSI { 367}
(( segid " " and resid 438 and name H ))
(( segid " " and resid 437 and name H ))
2.700 0.900 0.900 peak 367 spectrum 1 weight 0.10000E+01 volume 0.14241E-02 ppm1 7.567 ppm2 8.209 CV 1
ASSI { 457}
(( segid " " and resid 242 and name H ))
(( segid " " and resid 241 and name H ))
2.500 0.800 0.800 peak 457 spectrum 1 weight 0.10000E+01 volume 0.19180E-02 ppm1 7.546 ppm2 8.368 CV 1
ASSI { 400}
(( segid " " and resid 337 and name H ))
(( segid " " and resid 336 and name H ))
2.800 1.000 1.000 peak 400 spectrum 1 weight 0.10000E+01 volume 0.88393E-03 ppm1 7.321 ppm2 9.119 CV 1
ASSI { 300}
(( segid " " and resid 273 and name H ))
(( segid " " and resid 272 and name H ))
2.400 0.700 0.700 peak 300 spectrum 1 weight 0.10000E+01 volume 0.15576E-02 ppm1 7.704 ppm2 8.502 CV 1
ASSI { 431}
(( segid " " and resid 412 and name H ))
(( segid " " and resid 411 and name H ))
2.500 0.800 0.800 peak 431 spectrum 1 weight 0.10000E+01 volume 0.14584E-02 ppm1 8.424 ppm2 7.704 CV 1
ASSI { 182}
(( segid " " and resid 221 and name H ))
(( segid " " and resid 219 and name H ))
4.100 2.100 1.900 peak 182 spectrum 1 weight 0.10000E+01 volume 0.37896E-03 ppm1 8.745 ppm2 7.702 CV 1
ASSI { 255}
(( segid " " and resid 217 and name H ))
(( segid " " and resid 216 and name H ))
2.600 0.800 0.800 peak 255 spectrum 1 weight 0.10000E+01 volume 0.10025E-02 ppm1 7.486 ppm2 7.662 CV 1
ASSI { 302}
(( segid " " and resid 349 and name H ))
(( segid " " and resid 351 and name H ))
3.500 1.600 1.600 peak 302 spectrum 1 weight 0.10000E+01 volume 0.94510E-03 ppm1 7.105 ppm2 7.886 CV 1
ASSI { 434}
(( segid " " and resid 343 and name H ))
(( segid " " and resid 342 and name H ))
2.700 0.900 0.900 peak 434 spectrum 1 weight 0.10000E+01 volume 0.55500E-03 ppm1 8.172 ppm2 8.652 CV 1
ASSI { 15}
(( segid " " and resid 251 and name H ))
(( segid " " and resid 250 and name H ))
3.100 1.200 1.200 peak 15 spectrum 1 weight 0.10000E+01 volume 0.18031E-02 ppm1 7.895 ppm2 8.045 CV 1
ASSI { 280}
(( segid " " and resid 241 and name H ))
(( segid " " and resid 239 and name H ))
3.800 1.800 1.800 peak 280 spectrum 1 weight 0.10000E+01 volume 0.80704E-03 ppm1 8.368 ppm2 7.094 CV 1
ASSI { 358}
(( segid " " and resid 345 and name H ))
(( segid " " and resid 343 and name H ))
4.200 2.200 1.800 peak 358 spectrum 1 weight 0.10000E+01 volume 0.32337E-03 ppm1 6.993 ppm2 8.171 CV 1
ASSI { 323}
(( segid " " and resid 212 and name H ))
(( segid " " and resid 211 and name H ))
2.800 1.000 1.000 peak 323 spectrum 1 weight 0.10000E+01 volume 0.65043E-03 ppm1 9.065 ppm2 7.473 CV 1
ASSI { 481}
(( segid " " and resid 196 and name H ))
(( segid " " and resid 197 and name H ))
2.500 0.800 0.800 peak 481 spectrum 1 weight 0.10000E+01 volume 0.16419E-02 ppm1 7.186 ppm2 8.053 CV 1
ASSI { 226}
(( segid " " and resid 198 and name H ))
(( segid " " and resid 196 and name H ))
3.900 1.900 1.900 peak 226 spectrum 1 weight 0.10000E+01 volume 0.63471E-03 ppm1 8.601 ppm2 7.189 CV 1
ASSI { 163}
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(( segid " " and resid 384 and name HD21))
4.200 2.200 1.800 peak 163 spectrum 1 weight 0.10000E+01 volume 0.63471E-03 ppm1 9.015 ppm2 6.837 CV 1
ASSI { 393}
(( segid " " and resid 360 and name H ))
(( segid " " and resid 358 and name H ))
3.600 1.700 1.700 peak 393 spectrum 1 weight 0.10000E+01 volume 0.50684E-03 ppm1 7.275 ppm2 8.556 CV 1
ASSI { 469}
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(( segid " " and resid 407 and name H ))
2.600 0.800 0.800 peak 469 spectrum 1 weight 0.10000E+01 volume 0.12305E-02 ppm1 7.476 ppm2 7.803 CV 1
ASSI { 451}
(( segid " " and resid 360 and name H ))
(( segid " " and resid 362 and name H ))
4.700 2.700 1.300 peak 451 spectrum 1 weight 0.10000E+01 volume 0.25295E-03 ppm1 7.270 ppm2 7.839 CV 1
ASSI { 151}
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(( segid " " and resid 438 and name H ))
2.500 0.800 0.800 peak 151 spectrum 1 weight 0.10000E+01 volume 0.19643E-02 ppm1 8.768 ppm2 7.573 CV 1
ASSI { 126}
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(( segid " " and resid 230 and name H ))
2.300 0.600 0.600 peak 126 spectrum 1 weight 0.10000E+01 volume 0.17614E-02 ppm1 9.605 ppm2 7.103 CV 1
ASSI { 137}
(( segid " " and resid 248 and name H ))
(( segid " " and resid 247 and name H ))
2.700 0.900 0.900 peak 137 spectrum 1 weight 0.10000E+01 volume 0.99143E-03 ppm1 8.884 ppm2 8.421 CV 1
ASSI { 220}
(( segid " " and resid 257 and name H ))
(( segid " " and resid 255 and name H ))
3.800 1.800 1.800 peak 220 spectrum 1 weight 0.10000E+01 volume 0.60506E-03 ppm1 7.444 ppm2 8.598 CV 1
ASSI { 183}
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(( segid " " and resid 204 and name H ))
4.300 2.300 1.700 peak 183 spectrum 1 weight 0.10000E+01 volume 0.30391E-03 ppm1 7.656 ppm2 8.132 CV 1
ASSI { 311}
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(( segid " " and resid 439 and name H ))
2.600 0.800 0.800 peak 311 spectrum 1 weight 0.10000E+01 volume 0.11248E-02 ppm1 8.427 ppm2 8.771 CV 1
ASSI { 408}
(( segid " " and resid 202 and name H ))
(( segid " " and resid 201 and name HG1 ))
4.100 2.100 1.900 peak 408 spectrum 1 weight 0.10000E+01 volume 0.92564E-03 ppm1 8.202 ppm2 4.451 CV 1
ASSI { 189}
(( segid " " and resid 331 and name H ))
(( segid " " and resid 332 and name H ))
2.300 0.600 0.600 peak 189 spectrum 1 weight 0.10000E+01 volume 0.12731E-02 ppm1 7.179 ppm2 7.428 CV 1
ASSI { 511}
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(( segid " " and resid 247 and name H ))
2.700 0.900 0.900 peak 511 spectrum 1 weight 0.10000E+01 volume 0.11183E-02 ppm1 7.448 ppm2 8.421 CV 1
ASSI { 26}
(( segid " " and resid 256 and name H ))
(( segid " " and resid 255 and name H ))
2.200 0.600 0.600 peak 26 spectrum 1 weight 0.10000E+01 volume 0.19625E-02 ppm1 8.229 ppm2 8.603 CV 1
ASSI { 288}
(( segid " " and resid 404 and name H ))
(( segid " " and resid 406 and name H ))
4.200 2.200 1.800 peak 288 spectrum 1 weight 0.10000E+01 volume 0.39285E-03 ppm1 7.624 ppm2 9.253 CV 1
ASSI { 403}
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(( segid " " and resid 315 and name H ))
2.700 0.900 0.900 peak 403 spectrum 1 weight 0.10000E+01 volume 0.14102E-02 ppm1 8.701 ppm2 8.309 CV 1
ASSI { 341}
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(( segid " " and resid 263 and name H ))
2.500 0.800 0.800 peak 341 spectrum 1 weight 0.10000E+01 volume 0.14983E-02 ppm1 8.494 ppm2 7.108 CV 1
ASSI { 169}
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(( segid " " and resid 364 and name H ))
4.300 2.400 1.700 peak 169 spectrum 1 weight 0.10000E+01 volume 0.29001E-03 ppm1 7.827 ppm2 7.481 CV 1
ASSI { 337}
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(( segid " " and resid 426 and name H ))
2.300 0.700 0.700 peak 337 spectrum 1 weight 0.10000E+01 volume 0.18541E-02 ppm1 7.769 ppm2 7.998 CV 1
ASSI { 424}
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(( segid " " and resid 239 and name H ))
4.600 2.600 1.400 peak 424 spectrum 1 weight 0.10000E+01 volume 0.31410E-03 ppm1 7.543 ppm2 7.097 CV 1
ASSI { 315}
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(( segid " " and resid 356 and name H ))
2.200 0.600 0.600 peak 315 spectrum 1 weight 0.10000E+01 volume 0.14621E-02 ppm1 8.131 ppm2 7.358 CV 1
ASSI { 390}
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(( segid " " and resid 317 and name H ))
2.600 0.800 0.800 peak 390 spectrum 1 weight 0.10000E+01 volume 0.10164E-02 ppm1 8.024 ppm2 7.513 CV 1
ASSI { 159}
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(( segid " " and resid 223 and name H ))
2.000 0.500 0.500 peak 159 spectrum 1 weight 0.10000E+01 volume 0.81910E-03 ppm1 9.033 ppm2 8.419 CV 1
ASSI { 499}
(( segid " " and resid 198 and name H ))
(( segid " " and resid 197 and name H ))
2.700 0.900 0.900 peak 499 spectrum 1 weight 0.10000E+01 volume 0.11063E-02 ppm1 8.596 ppm2 8.049 CV 1
ASSI { 113}
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(( segid " " and resid 342 and name H ))
3.800 1.800 1.800 peak 113 spectrum 1 weight 0.10000E+01 volume 0.57911E-03 ppm1 7.760 ppm2 8.647 CV 1
ASSI { 389}
(( segid " " and resid 352 and name H ))
(( segid " " and resid 351 and name H ))
2.300 0.600 0.600 peak 389 spectrum 1 weight 0.10000E+01 volume 0.24174E-02 ppm1 7.057 ppm2 7.888 CV 1
ASSI { 439}
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(( segid " " and resid 431 and name H ))
2.700 0.900 0.900 peak 439 spectrum 1 weight 0.10000E+01 volume 0.13111E-02 ppm1 8.472 ppm2 7.972 CV 1
ASSI { 215}
(( segid " " and resid 283 and name H ))
(( segid " " and resid 280 and name HG1 ))
1.900 0.500 0.500 peak 215 spectrum 1 weight 0.10000E+01 volume 0.16261E-02 ppm1 7.320 ppm2 7.574 CV 1
ASSI { 310}
(( segid " " and resid 194 and name H ))
(( segid " " and resid 196 and name H ))
5.100 3.200 0.900 peak 310 spectrum 1 weight 0.10000E+01 volume 0.37248E-03 ppm1 9.085 ppm2 7.184 CV 1
ASSI { 149}
(( segid " " and resid 230 and name H ))
(( segid " " and resid 231 and name H ))
5.400 3.700 0.600 peak 149 spectrum 1 weight 0.10000E+01 volume 0.29187E-03 ppm1 7.105 ppm2 8.415 CV 1
ASSI { 325}
(( segid " " and resid 189 and name H ))
(( segid " " and resid 190 and name H ))
2.600 0.900 0.900 peak 325 spectrum 1 weight 0.10000E+01 volume 0.98029E-03 ppm1 8.875 ppm2 10.624 CV 1
ASSI { 147}
(( segid " " and resid 232 and name H ))
(( segid " " and resid 231 and name H ))
2.600 0.800 0.800 peak 147 spectrum 1 weight 0.10000E+01 volume 0.10600E-02 ppm1 8.777 ppm2 8.422 CV 1
ASSI { 504}
(( segid " " and resid 225 and name H ))
(( segid " " and resid 226 and name H ))
2.600 0.800 0.800 peak 504 spectrum 1 weight 0.10000E+01 volume 0.96269E-03 ppm1 7.791 ppm2 7.414 CV 1
ASSI { 417}
(( segid " " and resid 257 and name H ))
(( segid " " and resid 258 and name H ))
2.000 0.500 0.500 peak 417 spectrum 1 weight 0.10000E+01 volume 0.20533E-02 ppm1 7.444 ppm2 8.160 CV 1
ASSI { 275}
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(( segid " " and resid 268 and name H ))
2.500 0.800 0.800 peak 275 spectrum 1 weight 0.10000E+01 volume 0.10665E-02 ppm1 8.196 ppm2 7.854 CV 1
ASSI { 2}
(( segid " " and resid 274 and name H ))
(( segid " " and resid 272 and name H ))
3.600 1.600 1.600 peak 2 spectrum 1 weight 0.10000E+01 volume 0.81444E-03 ppm1 7.017 ppm2 8.500 CV 1
ASSI { 239}
(( segid " " and resid 200 and name H ))
(( segid " " and resid 199 and name H ))
2.600 0.800 0.800 peak 239 spectrum 1 weight 0.10000E+01 volume 0.13843E-02 ppm1 7.613 ppm2 7.769 CV 1
ASSI { 241}
(( segid " " and resid 352 and name H ))
(( segid " " and resid 350 and name H ))
3.500 1.600 1.600 peak 241 spectrum 1 weight 0.10000E+01 volume 0.12953E-02 ppm1 7.058 ppm2 7.618 CV 1
ASSI { 468}
(( segid " " and resid 335 and name H ))
(( segid " " and resid 336 and name H ))
2.600 0.900 0.900 peak 468 spectrum 1 weight 0.10000E+01 volume 0.57541E-03 ppm1 8.866 ppm2 9.125 CV 1
ASSI { 63}
(( segid " " and resid 365 and name H ))
(( segid " " and resid 363 and name H ))
3.900 1.900 1.900 peak 63 spectrum 1 weight 0.10000E+01 volume 0.44288E-03 ppm1 8.344 ppm2 7.281 CV 1
ASSI { 298}
(( segid " " and resid 397 and name H ))
(( segid " " and resid 399 and name H ))
4.400 2.400 1.600 peak 298 spectrum 1 weight 0.10000E+01 volume 0.42346E-03 ppm1 8.069 ppm2 8.324 CV 1
ASSI { 406}
(( segid " " and resid 211 and name H ))
(( segid " " and resid 201 and name HG1 ))
3.300 1.300 1.300 peak 406 spectrum 1 weight 0.10000E+01 volume 0.64768E-03 ppm1 7.470 ppm2 4.451 CV 1
ASSI { 225}
(( segid " " and resid 319 and name H ))
(( segid " " and resid 317 and name H ))
4.500 2.500 1.500 peak 225 spectrum 1 weight 0.10000E+01 volume 0.18994E-03 ppm1 7.833 ppm2 7.512 CV 1
ASSI { 296}
(( segid " " and resid 280 and name H ))
(( segid " " and resid 279 and name H ))
1.900 0.400 0.400 peak 296 spectrum 1 weight 0.10000E+01 volume 0.20292E-02 ppm1 7.655 ppm2 9.021 CV 1
ASSI { 351}
(( segid " " and resid 329 and name H ))
(( segid " " and resid 328 and name H ))
2.200 0.600 0.600 peak 351 spectrum 1 weight 0.10000E+01 volume 0.12369E-02 ppm1 7.944 ppm2 7.187 CV 1
ASSI { 50}
(( segid " " and resid 399 and name H ))
(( segid " " and resid 400 and name H ))
2.700 0.900 0.900 peak 50 spectrum 1 weight 0.10000E+01 volume 0.14056E-02 ppm1 8.327 ppm2 7.973 CV 1
ASSI { 216}
(( segid " " and resid 233 and name H ))
(( segid " " and resid 232 and name H ))
2.100 0.500 0.500 peak 216 spectrum 1 weight 0.10000E+01 volume 0.20143E-02 ppm1 7.993 ppm2 8.781 CV 1
ASSI { 340}
(( segid " " and resid 222 and name H ))
(( segid " " and resid 221 and name H ))
2.600 0.800 0.800 peak 340 spectrum 1 weight 0.10000E+01 volume 0.11248E-02 ppm1 7.243 ppm2 8.736 CV 1
ASSI { 132}
(( segid " " and resid 314 and name H ))
(( segid " " and resid 315 and name H ))
2.400 0.700 0.700 peak 132 spectrum 1 weight 0.10000E+01 volume 0.15501E-02 ppm1 7.340 ppm2 8.313 CV 1
ASSI { 472}
(( segid " " and resid 345 and name H ))
(( segid " " and resid 346 and name H ))
2.100 0.500 0.500 peak 472 spectrum 1 weight 0.10000E+01 volume 0.19365E-02 ppm1 6.995 ppm2 8.978 CV 1
ASSI { 366}
(( segid " " and resid 215 and name H ))
(( segid " " and resid 217 and name H ))
4.100 2.100 1.900 peak 366 spectrum 1 weight 0.10000E+01 volume 0.36416E-03 ppm1 8.881 ppm2 7.482 CV 1
ASSI { 154}
(( segid " " and resid 290 and name H ))
(( segid " " and resid 291 and name H ))
2.600 0.800 0.800 peak 154 spectrum 1 weight 0.10000E+01 volume 0.11721E-02 ppm1 7.815 ppm2 7.370 CV 1
ASSI { 233}
(( segid " " and resid 326 and name H ))
(( segid " " and resid 327 and name H ))
2.700 0.900 0.900 peak 233 spectrum 1 weight 0.10000E+01 volume 0.99051E-03 ppm1 8.916 ppm2 7.608 CV 1
ASSI { 397}
(( segid " " and resid 280 and name H ))
(( segid " " and resid 278 and name H ))
3.500 1.500 1.500 peak 397 spectrum 1 weight 0.10000E+01 volume 0.62914E-03 ppm1 7.655 ppm2 10.049 CV 1
ASSI { 235}
(( segid " " and resid 342 and name H ))
(( segid " " and resid 341 and name H ))
2.400 0.700 0.700 peak 235 spectrum 1 weight 0.10000E+01 volume 0.10748E-02 ppm1 8.650 ppm2 8.512 CV 1
ASSI { 56}
(( segid " " and resid 333 and name H ))
(( segid " " and resid 332 and name H ))
2.700 0.900 0.900 peak 56 spectrum 1 weight 0.10000E+01 volume 0.52630E-03 ppm1 8.628 ppm2 7.431 CV 1
ASSI { 131}
(( segid " " and resid 264 and name H ))
(( segid " " and resid 261 and name H ))
4.700 2.700 1.300 peak 131 spectrum 1 weight 0.10000E+01 volume 0.23535E-03 ppm1 8.495 ppm2 8.887 CV 1
ASSI { 452}
(( segid " " and resid 198 and name H ))
(( segid " " and resid 200 and name H ))
4.200 2.200 1.800 peak 452 spectrum 1 weight 0.10000E+01 volume 0.37896E-03 ppm1 8.600 ppm2 7.611 CV 1
ASSI { 85}
(( segid " " and resid 401 and name H ))
(( segid " " and resid 400 and name H ))
2.600 0.900 0.900 peak 85 spectrum 1 weight 0.10000E+01 volume 0.13787E-02 ppm1 7.792 ppm2 7.977 CV 1
ASSI { 230}
(( segid " " and resid 364 and name H ))
(( segid " " and resid 365 and name H ))
2.400 0.700 0.700 peak 230 spectrum 1 weight 0.10000E+01 volume 0.13426E-02 ppm1 7.472 ppm2 8.341 CV 1
ASSI { 483}
(( segid " " and resid 325 and name H ))
(( segid " " and resid 326 and name H ))
2.600 0.800 0.800 peak 483 spectrum 1 weight 0.10000E+01 volume 0.78017E-03 ppm1 8.490 ppm2 8.915 CV 1
ASSI { 344}
(( segid " " and resid 197 and name H ))
(( segid " " and resid 195 and name H ))
3.900 1.900 1.900 peak 344 spectrum 1 weight 0.10000E+01 volume 0.52260E-03 ppm1 8.054 ppm2 8.984 CV 1
ASSI { 145}
(( segid " " and resid 281 and name H ))
(( segid " " and resid 280 and name HG1 ))
4.000 2.000 2.000 peak 145 spectrum 1 weight 0.10000E+01 volume 0.19458E-03 ppm1 9.157 ppm2 7.572 CV 1
ASSI { 312}
(( segid " " and resid 207 and name H ))
(( segid " " and resid 205 and name H ))
3.900 1.900 1.900 peak 312 spectrum 1 weight 0.10000E+01 volume 0.87283E-03 ppm1 6.899 ppm2 6.378 CV 1
ASSI { 410}
(( segid " " and resid 398 and name H ))
(( segid " " and resid 397 and name H ))
2.600 0.900 0.900 peak 410 spectrum 1 weight 0.10000E+01 volume 0.15474E-02 ppm1 8.672 ppm2 8.069 CV 1
ASSI { 303}
(( segid " " and resid 305 and name H ))
(( segid " " and resid 306 and name H ))
2.300 0.700 0.700 peak 303 spectrum 1 weight 0.10000E+01 volume 0.23136E-02 ppm1 7.492 ppm2 8.030 CV 1
ASSI { 436}
(( segid " " and resid 225 and name H ))
(( segid " " and resid 224 and name H ))
2.700 0.900 0.900 peak 436 spectrum 1 weight 0.10000E+01 volume 0.79315E-03 ppm1 7.792 ppm2 9.032 CV 1
ASSI { 299}
(( segid " " and resid 403 and name H ))
(( segid " " and resid 402 and name H ))
2.500 0.800 0.800 peak 299 spectrum 1 weight 0.10000E+01 volume 0.14047E-02 ppm1 7.557 ppm2 8.705 CV 1
ASSI { 133}
(( segid " " and resid 293 and name H ))
(( segid " " and resid 292 and name H ))
2.400 0.700 0.700 peak 133 spectrum 1 weight 0.10000E+01 volume 0.27612E-02 ppm1 7.001 ppm2 7.801 CV 1
ASSI { 222}
(( segid " " and resid 209 and name H ))
(( segid " " and resid 208 and name H ))
3.800 1.800 1.800 peak 222 spectrum 1 weight 0.10000E+01 volume 0.52908E-03 ppm1 7.824 ppm2 8.263 CV 1
ASSI { 352}
(( segid " " and resid 290 and name H ))
(( segid " " and resid 293 and name H ))
5.800 4.200 0.200 peak 352 spectrum 1 weight 0.10000E+01 volume 0.28538E-03 ppm1 7.813 ppm2 6.988 CV 1
ASSI { 175}
(( segid " " and resid 406 and name H ))
(( segid " " and resid 409 and name H ))
4.900 3.000 1.100 peak 175 spectrum 1 weight 0.10000E+01 volume 0.25851E-03 ppm1 9.256 ppm2 8.729 CV 1
ASSI { 449}
(( segid " " and resid 340 and name H ))
(( segid " " and resid 342 and name H ))
3.900 1.900 1.900 peak 449 spectrum 1 weight 0.10000E+01 volume 0.57724E-03 ppm1 8.138 ppm2 8.648 CV 1
ASSI { 279}
(( segid " " and resid 280 and name H ))
(( segid " " and resid 277 and name HD22))
6.000 5.700 0.000 peak 279 spectrum 1 weight 0.10000E+01 volume 0.20940E-03 ppm1 7.655 ppm2 6.123 CV 1
ASSI { 420}
(( segid " " and resid 215 and name H ))
(( segid " " and resid 214 and name H ))
2.500 0.800 0.800 peak 420 spectrum 1 weight 0.10000E+01 volume 0.10628E-02 ppm1 8.885 ppm2 7.194 CV 1
ASSI { 392}
(( segid " " and resid 207 and name H ))
(( segid " " and resid 206 and name H ))
2.400 0.700 0.700 peak 392 spectrum 1 weight 0.10000E+01 volume 0.22432E-02 ppm1 6.899 ppm2 7.660 CV 1
ASSI { 301}
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(( segid " " and resid 434 and name H ))
2.600 0.800 0.800 peak 301 spectrum 1 weight 0.10000E+01 volume 0.11156E-02 ppm1 8.206 ppm2 7.991 CV 1
ASSI { 270}
(( segid " " and resid 276 and name H ))
(( segid " " and resid 194 and name H ))
4.700 2.700 1.300 peak 270 spectrum 1 weight 0.10000E+01 volume 0.25017E-03 ppm1 6.949 ppm2 9.082 CV 1
ASSI { 470}
(( segid " " and resid 202 and name H ))
(( segid " " and resid 201 and name H ))
2.500 0.800 0.800 peak 470 spectrum 1 weight 0.10000E+01 volume 0.18615E-02 ppm1 8.203 ppm2 7.487 CV 1
ASSI { 421}
(( segid " " and resid 249 and name H ))
(( segid " " and resid 248 and name H ))
2.700 0.900 0.900 peak 421 spectrum 1 weight 0.10000E+01 volume 0.12805E-02 ppm1 7.301 ppm2 8.882 CV 1
ASSI { 165}
(( segid " " and resid 438 and name H ))
(( segid " " and resid 436 and name H ))
4.300 2.300 1.700 peak 165 spectrum 1 weight 0.10000E+01 volume 0.41880E-03 ppm1 7.572 ppm2 8.926 CV 1
ASSI { 348}
(( segid " " and resid 244 and name H ))
(( segid " " and resid 243 and name H ))
2.600 0.800 0.800 peak 348 spectrum 1 weight 0.10000E+01 volume 0.13797E-02 ppm1 8.540 ppm2 7.852 CV 1
ASSI { 178}
(( segid " " and resid 284 and name H ))
(( segid " " and resid 280 and name HG1 ))
3.300 1.300 1.300 peak 178 spectrum 1 weight 0.10000E+01 volume 0.10887E-02 ppm1 8.106 ppm2 7.572 CV 1
ASSI { 286}
(( segid " " and resid 267 and name H ))
(( segid " " and resid 266 and name H ))
2.300 0.700 0.700 peak 286 spectrum 1 weight 0.10000E+01 volume 0.18670E-02 ppm1 8.058 ppm2 8.221 CV 1
ASSI { 66}
(( segid " " and resid 403 and name H ))
(( segid " " and resid 405 and name H ))
4.000 2.000 2.000 peak 66 spectrum 1 weight 0.10000E+01 volume 0.48551E-03 ppm1 7.558 ppm2 8.352 CV 1
ASSI { 261}
(( segid " " and resid 424 and name H ))
(( segid " " and resid 426 and name H ))
4.200 2.200 1.800 peak 261 spectrum 1 weight 0.10000E+01 volume 0.45864E-03 ppm1 8.270 ppm2 8.003 CV 1
ASSI { 482}
(( segid " " and resid 340 and name H ))
(( segid " " and resid 339 and name H ))
2.400 0.700 0.700 peak 482 spectrum 1 weight 0.10000E+01 volume 0.14686E-02 ppm1 8.138 ppm2 8.363 CV 1
ASSI { 382}
(( segid " " and resid 218 and name H ))
(( segid " " and resid 217 and name H ))
2.700 0.900 0.900 peak 382 spectrum 1 weight 0.10000E+01 volume 0.79406E-03 ppm1 7.964 ppm2 7.483 CV 1
ASSI { 134}
(( segid " " and resid 283 and name H ))
(( segid " " and resid 281 and name H ))
4.400 2.400 1.600 peak 134 spectrum 1 weight 0.10000E+01 volume 0.31689E-03 ppm1 7.315 ppm2 9.161 CV 1
ASSI { 176}
(( segid " " and resid 307 and name H ))
(( segid " " and resid 306 and name H ))
2.300 0.600 0.600 peak 176 spectrum 1 weight 0.10000E+01 volume 0.10785E-02 ppm1 8.721 ppm2 8.013 CV 1
ASSI { 120}
(( segid " " and resid 398 and name H ))
(( segid " " and resid 399 and name H ))
2.500 0.800 0.800 peak 120 spectrum 1 weight 0.10000E+01 volume 0.15085E-02 ppm1 8.673 ppm2 8.321 CV 1
ASSI { 496}
(( segid " " and resid 240 and name H ))
(( segid " " and resid 241 and name H ))
2.700 0.900 0.900 peak 496 spectrum 1 weight 0.10000E+01 volume 0.13222E-02 ppm1 8.006 ppm2 8.378 CV 1
ASSI { 171}
(( segid " " and resid 334 and name H ))
(( segid " " and resid 335 and name H ))
2.400 0.700 0.700 peak 171 spectrum 1 weight 0.10000E+01 volume 0.13000E-02 ppm1 8.119 ppm2 8.870 CV 1
ASSI { 211}
(( segid " " and resid 297 and name H ))
(( segid " " and resid 299 and name H ))
4.100 2.100 1.900 peak 211 spectrum 1 weight 0.10000E+01 volume 0.28631E-03 ppm1 8.062 ppm2 7.486 CV 1
ASSI { 287}
(( segid " " and resid 368 and name H ))
(( segid " " and resid 367 and name H ))
2.400 0.700 0.700 peak 287 spectrum 1 weight 0.10000E+01 volume 0.12314E-02 ppm1 8.192 ppm2 7.892 CV 1
ASSI { 130}
(( segid " " and resid 344 and name H ))
(( segid " " and resid 343 and name H ))
2.500 0.800 0.800 peak 130 spectrum 1 weight 0.10000E+01 volume 0.10424E-02 ppm1 7.676 ppm2 8.169 CV 1
ASSI { 187}
(( segid " " and resid 300 and name H ))
(( segid " " and resid 299 and name H ))
2.200 0.600 0.600 peak 187 spectrum 1 weight 0.10000E+01 volume 0.18114E-02 ppm1 7.917 ppm2 7.485 CV 1
ASSI { 201}
(( segid " " and resid 194 and name H ))
(( segid " " and resid 197 and name H ))
5.400 3.700 0.600 peak 201 spectrum 1 weight 0.10000E+01 volume 0.18624E-03 ppm1 9.083 ppm2 8.044 CV 1
ASSI { 404}
(( segid " " and resid 201 and name H ))
(( segid " " and resid 199 and name H ))
4.700 2.700 1.300 peak 404 spectrum 1 weight 0.10000E+01 volume 0.23535E-03 ppm1 7.484 ppm2 7.775 CV 1
ASSI { 122}
(( segid " " and resid 256 and name H ))
(( segid " " and resid 257 and name H ))
2.600 0.800 0.800 peak 122 spectrum 1 weight 0.10000E+01 volume 0.11869E-02 ppm1 8.229 ppm2 7.447 CV 1
ASSI { 179}
(( segid " " and resid 414 and name H ))
(( segid " " and resid 415 and name H ))
2.400 0.700 0.700 peak 179 spectrum 1 weight 0.10000E+01 volume 0.22775E-02 ppm1 7.655 ppm2 7.969 CV 1
ASSI { 112}
(( segid " " and resid 231 and name H ))
(( segid " " and resid 233 and name H ))
3.800 1.800 1.800 peak 112 spectrum 1 weight 0.10000E+01 volume 0.69863E-03 ppm1 8.425 ppm2 7.991 CV 1
ASSI { 197}
(( segid " " and resid 361 and name H ))
(( segid " " and resid 362 and name H ))
2.900 1.100 1.100 peak 197 spectrum 1 weight 0.10000E+01 volume 0.69863E-03 ppm1 8.375 ppm2 7.838 CV 1
ASSI { 271}
(( segid " " and resid 200 and name H ))
(( segid " " and resid 201 and name H ))
2.500 0.800 0.800 peak 271 spectrum 1 weight 0.10000E+01 volume 0.11536E-02 ppm1 7.614 ppm2 7.487 CV 1
ASSI { 140}
(( segid " " and resid 322 and name H ))
(( segid " " and resid 321 and name H ))
2.900 1.100 1.100 peak 140 spectrum 1 weight 0.10000E+01 volume 0.42991E-03 ppm1 8.206 ppm2 8.547 CV 1
ASSI { 52}
(( segid " " and resid 431 and name H ))
(( segid " " and resid 429 and name H ))
4.300 2.300 1.700 peak 52 spectrum 1 weight 0.10000E+01 volume 0.29001E-03 ppm1 7.966 ppm2 8.120 CV 1
ASSI { 87}
(( segid " " and resid 263 and name H ))
(( segid " " and resid 262 and name H ))
2.600 0.900 0.900 peak 87 spectrum 1 weight 0.10000E+01 volume 0.12314E-02 ppm1 7.109 ppm2 7.881 CV 1
ASSI { 425}
(( segid " " and resid 267 and name H ))
(( segid " " and resid 268 and name H ))
2.500 0.800 0.800 peak 425 spectrum 1 weight 0.10000E+01 volume 0.13296E-02 ppm1 8.058 ppm2 7.852 CV 1
ASSI { 378}
(( segid " " and resid 333 and name H ))
(( segid " " and resid 335 and name H ))
3.900 1.900 1.900 peak 378 spectrum 1 weight 0.10000E+01 volume 0.46421E-03 ppm1 8.624 ppm2 8.867 CV 1
ASSI { 371}
(( segid " " and resid 269 and name H ))
(( segid " " and resid 270 and name H ))
2.600 0.800 0.800 peak 371 spectrum 1 weight 0.10000E+01 volume 0.10683E-02 ppm1 8.195 ppm2 8.542 CV 1
ASSI { 248}
(( segid " " and resid 218 and name H ))
(( segid " " and resid 220 and name H ))
4.600 2.600 1.400 peak 248 spectrum 1 weight 0.10000E+01 volume 0.25295E-03 ppm1 7.964 ppm2 8.676 CV 1
ASSI { 158}
(( segid " " and resid 374 and name H ))
(( segid " " and resid 373 and name H ))
3.900 1.900 1.900 peak 158 spectrum 1 weight 0.10000E+01 volume 0.40491E-03 ppm1 6.316 ppm2 8.223 CV 1
ASSI { 438}
(( segid " " and resid 359 and name H ))
(( segid " " and resid 361 and name H ))
4.200 2.200 1.800 peak 438 spectrum 1 weight 0.10000E+01 volume 0.50218E-03 ppm1 7.190 ppm2 8.377 CV 1
ASSI { 3899}
(( segid " " and resid 182 and name HB2 ))
( segid " " and resid 186 and name HD1%)
4.400 2.400 1.600 peak 3899 spectrum 1 weight 0.10000E+01 volume 0.54135E-03 ppm1 2.948 ppm2 0.783 CV 1
OR { 3899}
(( segid " " and resid 182 and name HB3 ))
( segid " " and resid 186 and name HD1%)
OR { 3899}
(( segid " " and resid 182 and name HB2 ))
( segid " " and resid 186 and name HD2%)
OR { 3899}
(( segid " " and resid 182 and name HB3 ))
( segid " " and resid 186 and name HD2%)
ASSI { 2308}
(( segid " " and resid 259 and name HB3 ))
(( segid " " and resid 259 and name HA ))
3.600 1.600 1.600 peak 2308 spectrum 1 weight 0.10000E+01 volume 0.37780E-03 ppm1 2.102 ppm2 4.797 CV 1
ASSI { 3850}
(( segid " " and resid 445 and name HB3 ))
(( segid " " and resid 445 and name HG2 ))
2.200 0.600 0.600 peak 3850 spectrum 1 weight 0.10000E+01 volume 0.13424E-01 ppm1 1.879 ppm2 2.214 CV 1
OR { 3850}
(( segid " " and resid 445 and name HB3 ))
(( segid " " and resid 445 and name HG3 ))
ASSI { 2575}
(( segid " " and resid 315 and name HA ))
(( segid " " and resid 315 and name HB3 ))
4.100 2.100 1.900 peak 2575 spectrum 1 weight 0.10000E+01 volume 0.40318E-03 ppm1 3.781 ppm2 3.010 CV 1
ASSI { 3838}
(( segid " " and resid 252 and name HA ))
(( segid " " and resid 252 and name HB3 ))
3.000 1.100 1.100 peak 3838 spectrum 1 weight 0.10000E+01 volume 0.26277E-02 ppm1 4.330 ppm2 3.709 CV 1
OR { 3838}
(( segid " " and resid 252 and name HA ))
(( segid " " and resid 252 and name HB2 ))
ASSI { 2145}
( segid " " and resid 435 and name HD1%)
(( segid " " and resid 382 and name HE3 ))
3.100 1.200 1.200 peak 2145 spectrum 1 weight 0.10000E+01 volume 0.19934E-02 ppm1 0.871 ppm2 7.177 CV 1
ASSI { 4380}
(( segid " " and resid 429 and name HB2 ))
(( segid " " and resid 430 and name H ))
4.000 2.000 2.000 peak 4380 spectrum 1 weight 0.10000E+01 volume 0.44831E-03 ppm1 1.441 ppm2 7.740 CV 1
ASSI { 3222}
(( segid " " and resid 197 and name HA ))
( segid " " and resid 189 and name HD1%)
3.100 1.200 1.200 peak 3222 spectrum 1 weight 0.10000E+01 volume 0.18073E-02 ppm1 3.900 ppm2 0.737 CV 1
ASSI { 2613}
(( segid " " and resid 232 and name HG3 ))
(( segid " " and resid 232 and name HD3 ))
2.900 1.000 1.000 peak 2613 spectrum 1 weight 0.10000E+01 volume 0.22105E-02 ppm1 1.488 ppm2 3.008 CV 1
ASSI { 4071}
(( segid " " and resid 360 and name HB3 ))
(( segid " " and resid 360 and name HA ))
3.500 1.500 1.500 peak 4071 spectrum 1 weight 0.10000E+01 volume 0.65413E-03 ppm1 3.052 ppm2 4.244 CV 1
ASSI { 2791}
(( segid " " and resid 345 and name HA ))
(( segid " " and resid 345 and name H ))
2.900 1.100 1.100 peak 2791 spectrum 1 weight 0.10000E+01 volume 0.17932E-02 ppm1 4.003 ppm2 6.992 CV 1
ASSI { 3892}
(( segid " " and resid 335 and name HB ))
( segid " " and resid 335 and name HG2%)
3.000 1.100 1.100 peak 3892 spectrum 1 weight 0.10000E+01 volume 0.11391E-02 ppm1 4.153 ppm2 1.253 CV 1
ASSI { 3854}
(( segid " " and resid 285 and name HB3 ))
(( segid " " and resid 286 and name H ))
4.100 2.100 1.900 peak 3854 spectrum 1 weight 0.10000E+01 volume 0.12124E-02 ppm1 1.760 ppm2 7.451 CV 1
ASSI { 2512}
(( segid " " and resid 251 and name HG3 ))
(( segid " " and resid 251 and name HB2 ))
2.600 0.900 0.900 peak 2512 spectrum 1 weight 0.10000E+01 volume 0.41024E-02 ppm1 2.111 ppm2 1.759 CV 1
ASSI { 4443}
(( segid " " and resid 304 and name HG3 ))
(( segid " " and resid 304 and name HE22))
3.400 1.400 1.400 peak 4443 spectrum 1 weight 0.10000E+01 volume 0.29605E-02 ppm1 2.294 ppm2 7.006 CV 1
ASSI { 3914}
(( segid " " and resid 272 and name HG3 ))
(( segid " " and resid 272 and name HD3 ))
1.900 0.400 0.400 peak 3914 spectrum 1 weight 0.10000E+01 volume 0.17639E-01 ppm1 1.800 ppm2 3.228 CV 1
OR { 3914}
(( segid " " and resid 272 and name HG3 ))
(( segid " " and resid 272 and name HD2 ))
OR { 3914}
(( segid " " and resid 272 and name HG2 ))
(( segid " " and resid 272 and name HD3 ))
OR { 3914}
(( segid " " and resid 272 and name HG2 ))
(( segid " " and resid 272 and name HD2 ))
ASSI { 3761}
(( segid " " and resid 377 and name HB2 ))
( segid " " and resid 204 and name HE% )
4.900 3.000 1.100 peak 3761 spectrum 1 weight 0.10000E+01 volume 0.44267E-03 ppm1 1.967 ppm2 6.899 CV 1
OR { 3761}
(( segid " " and resid 377 and name HB2 ))
( segid " " and resid 204 and name HD% )
ASSI { 3186}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 300 and name H ))
2.100 0.600 0.600 peak 3186 spectrum 1 weight 0.10000E+01 volume 0.59096E-02 ppm1 0.077 ppm2 7.919 CV 1
ASSI { 1971}
(( segid " " and resid 433 and name HG2 ))
(( segid " " and resid 430 and name HA ))
4.300 2.300 1.700 peak 1971 spectrum 1 weight 0.10000E+01 volume 0.37216E-03 ppm1 2.232 ppm2 4.412 CV 1
ASSI { 2879}
(( segid " " and resid 339 and name HG12))
(( segid " " and resid 339 and name HG13))
2.100 0.500 0.500 peak 2879 spectrum 1 weight 0.10000E+01 volume 0.17509E-02 ppm1 0.566 ppm2 1.538 CV 1
OR { 2879}
(( segid " " and resid 339 and name HG12))
(( segid " " and resid 339 and name HB ))
ASSI { 1531}
(( segid " " and resid 226 and name HG3 ))
(( segid " " and resid 334 and name HG3 ))
3.800 1.800 1.800 peak 1531 spectrum 1 weight 0.10000E+01 volume 0.15225E-02 ppm1 1.207 ppm2 2.174 CV 1
OR { 1531}
(( segid " " and resid 226 and name HG3 ))
(( segid " " and resid 334 and name HG2 ))
ASSI { 2626}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 216 and name H ))
5.000 3.100 1.000 peak 2626 spectrum 1 weight 0.10000E+01 volume 0.77816E-03 ppm1 2.220 ppm2 7.636 CV 1
ASSI { 1511}
(( segid " " and resid 344 and name HG13))
( segid " " and resid 344 and name HD1%)
2.300 0.700 0.700 peak 1511 spectrum 1 weight 0.10000E+01 volume 0.86757E-02 ppm1 1.222 ppm2 0.843 CV 1
OR { 1511}
(( segid " " and resid 344 and name HG13))
( segid " " and resid 344 and name HG2%)
ASSI { 633}
(( segid " " and resid 261 and name HB3 ))
( segid " " and resid 233 and name HG1%)
4.000 2.000 2.000 peak 633 spectrum 1 weight 0.10000E+01 volume 0.42011E-03 ppm1 3.039 ppm2 0.893 CV 1
OR { 633}
(( segid " " and resid 261 and name HB3 ))
( segid " " and resid 233 and name HG2%)
ASSI { 2631}
( segid " " and resid 446 and name HB% )
(( segid " " and resid 399 and name HE3 ))
2.600 2.600 3.400 peak 2631 spectrum 1 weight 0.10000E+01 volume 0.11870E-02 ppm1 1.265 ppm2 2.900 CV 1
OR { 2631}
( segid " " and resid 446 and name HB% )
(( segid " " and resid 399 and name HE2 ))
ASSI { 3508}
(( segid " " and resid 425 and name HG3 ))
(( segid " " and resid 425 and name HE3 ))
3.100 1.200 1.200 peak 3508 spectrum 1 weight 0.10000E+01 volume 0.16522E-02 ppm1 1.237 ppm2 2.889 CV 1
OR { 3508}
(( segid " " and resid 425 and name HG3 ))
(( segid " " and resid 425 and name HE2 ))
ASSI { 4600}
(( segid " " and resid 298 and name HB3 ))
(( segid " " and resid 298 and name H ))
4.100 2.100 1.900 peak 4600 spectrum 1 weight 0.10000E+01 volume 0.71897E-03 ppm1 1.995 ppm2 7.335 CV 1
ASSI { 3189}
(( segid " " and resid 323 and name HB ))
(( segid " " and resid 323 and name HA ))
3.800 1.800 1.800 peak 3189 spectrum 1 weight 0.10000E+01 volume 0.37780E-03 ppm1 1.748 ppm2 3.306 CV 1
ASSI { 4348}
( segid " " and resid 330 and name HB% )
(( segid " " and resid 331 and name H ))
2.500 0.800 0.800 peak 4348 spectrum 1 weight 0.10000E+01 volume 0.65526E-02 ppm1 1.554 ppm2 7.173 CV 1
ASSI { 1775}
(( segid " " and resid 244 and name HE2 ))
(( segid " " and resid 244 and name HD3 ))
3.000 1.100 1.100 peak 1775 spectrum 1 weight 0.10000E+01 volume 0.16494E-02 ppm1 2.563 ppm2 1.222 CV 1
OR { 1775}
(( segid " " and resid 244 and name HE3 ))
(( segid " " and resid 244 and name HD3 ))
ASSI { 3451}
( segid " " and resid 306 and name HD2%)
( segid " " and resid 287 and name HD% )
4.100 2.100 1.900 peak 3451 spectrum 1 weight 0.10000E+01 volume 0.56670E-03 ppm1 -0.356 ppm2 6.347 CV 1
ASSI { 1725}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 329 and name HG12))
3.500 1.500 1.500 peak 1725 spectrum 1 weight 0.10000E+01 volume 0.24953E-02 ppm1 0.750 ppm2 1.355 CV 1
ASSI { 2840}
(( segid " " and resid 299 and name HB3 ))
(( segid " " and resid 299 and name H ))
4.100 2.100 1.900 peak 2840 spectrum 1 weight 0.10000E+01 volume 0.81765E-03 ppm1 1.699 ppm2 7.501 CV 1
ASSI { 830}
(( segid " " and resid 358 and name HA ))
( segid " " and resid 339 and name HG2%)
3.100 1.200 1.200 peak 830 spectrum 1 weight 0.10000E+01 volume 0.14210E-02 ppm1 4.009 ppm2 0.682 CV 1
OR { 830}
(( segid " " and resid 358 and name HA ))
( segid " " and resid 339 and name HD1%)
ASSI { 9}
(( segid " " and resid 187 and name HD3 ))
(( segid " " and resid 187 and name H ))
3.500 1.500 1.500 peak 9 spectrum 1 weight 0.10000E+01 volume 0.19737E-02 ppm1 1.602 ppm2 8.472 CV 1
OR { 9}
(( segid " " and resid 187 and name HD2 ))
(( segid " " and resid 187 and name H ))
ASSI { 3938}
(( segid " " and resid 403 and name HG3 ))
(( segid " " and resid 403 and name HD3 ))
2.400 0.700 0.700 peak 3938 spectrum 1 weight 0.10000E+01 volume 0.57911E-02 ppm1 1.878 ppm2 3.241 CV 1
OR { 3938}
(( segid " " and resid 403 and name HG3 ))
(( segid " " and resid 403 and name HD2 ))
ASSI { 3977}
(( segid " " and resid 430 and name HZ2 ))
(( segid " " and resid 430 and name HH2 ))
2.500 0.800 0.800 peak 3977 spectrum 1 weight 0.10000E+01 volume 0.60224E-02 ppm1 7.299 ppm2 6.989 CV 1
OR { 3977}
(( segid " " and resid 430 and name HZ2 ))
(( segid " " and resid 430 and name HZ3 ))
ASSI { 4168}
(( segid " " and resid 222 and name HD3 ))
( segid " " and resid 223 and name HD% )
4.500 2.500 1.500 peak 4168 spectrum 1 weight 0.10000E+01 volume 0.85432E-03 ppm1 1.277 ppm2 6.422 CV 1
OR { 4168}
(( segid " " and resid 222 and name HD2 ))
( segid " " and resid 223 and name HD% )
ASSI { 2671}
( segid " " and resid 278 and name HD2%)
(( segid " " and resid 278 and name HA ))
2.500 0.800 0.800 peak 2671 spectrum 1 weight 0.10000E+01 volume 0.95384E-02 ppm1 0.745 ppm2 3.805 CV 1
ASSI { 2981}
(( segid " " and resid 391 and name HB2 ))
(( segid " " and resid 391 and name HA ))
4.300 2.300 1.700 peak 2981 spectrum 1 weight 0.10000E+01 volume 0.27067E-03 ppm1 1.132 ppm2 4.370 CV 1
ASSI { 4725}
(( segid " " and resid 298 and name HB3 ))
(( segid " " and resid 298 and name HA ))
2.700 0.900 0.900 peak 4725 spectrum 1 weight 0.10000E+01 volume 0.14069E-02 ppm1 1.999 ppm2 3.926 CV 1
ASSI { 1876}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 197 and name HA ))
2.600 0.800 0.800 peak 1876 spectrum 1 weight 0.10000E+01 volume 0.30366E-02 ppm1 1.454 ppm2 3.895 CV 1
ASSI { 1158}
(( segid " " and resid 411 and name HB2 ))
( segid " " and resid 412 and name HD1%)
4.700 2.700 1.300 peak 1158 spectrum 1 weight 0.10000E+01 volume 0.49058E-03 ppm1 2.801 ppm2 0.853 CV 1
ASSI { 792}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 406 and name HG2 ))
3.500 1.500 1.500 peak 792 spectrum 1 weight 0.10000E+01 volume 0.22217E-02 ppm1 0.769 ppm2 2.575 CV 1
ASSI { 4631}
( segid " " and resid 339 and name HD1%)
(( segid " " and resid 340 and name H ))
2.500 2.500 3.500 peak 4631 spectrum 1 weight 0.10000E+01 volume 0.15705E-02 ppm1 0.645 ppm2 8.151 CV 1
ASSI { 2518}
(( segid " " and resid 366 and name HG2 ))
(( segid " " and resid 366 and name H ))
2.800 1.000 1.000 peak 2518 spectrum 1 weight 0.10000E+01 volume 0.33439E-02 ppm1 2.279 ppm2 8.318 CV 1
ASSI { 2439}
( segid " " and resid 436 and name HD2%)
(( segid " " and resid 436 and name HG ))
2.100 0.600 0.600 peak 2439 spectrum 1 weight 0.10000E+01 volume 0.81370E-02 ppm1 0.857 ppm2 1.611 CV 1
ASSI { 2231}
( segid " " and resid 439 and name HD1%)
(( segid " " and resid 440 and name H ))
2.900 2.900 3.100 peak 2231 spectrum 1 weight 0.10000E+01 volume 0.59208E-03 ppm1 0.822 ppm2 8.397 CV 1
ASSI { 2861}
( segid " " and resid 373 and name HD1%)
(( segid " " and resid 373 and name HG ))
2.300 0.700 0.700 peak 2861 spectrum 1 weight 0.10000E+01 volume 0.33665E-02 ppm1 -0.196 ppm2 1.112 CV 1
ASSI { 1947}
(( segid " " and resid 318 and name HG13))
(( segid " " and resid 318 and name HB ))
2.700 0.900 0.900 peak 1947 spectrum 1 weight 0.10000E+01 volume 0.38034E-02 ppm1 0.611 ppm2 1.357 CV 1
ASSI { 2107}
(( segid " " and resid 182 and name HA ))
(( segid " " and resid 182 and name HD2 ))
4.300 2.300 1.700 peak 2107 spectrum 1 weight 0.10000E+01 volume 0.56388E-03 ppm1 3.887 ppm2 6.914 CV 1
ASSI { 2762}
(( segid " " and resid 411 and name HA ))
(( segid " " and resid 412 and name H ))
4.000 2.100 2.000 peak 2762 spectrum 1 weight 0.10000E+01 volume 0.56952E-03 ppm1 3.809 ppm2 8.400 CV 1
ASSI { 4105}
(( segid " " and resid 256 and name HG3 ))
( segid " " and resid 223 and name HE% )
2.600 2.600 3.400 peak 4105 spectrum 1 weight 0.10000E+01 volume 0.12011E-02 ppm1 2.385 ppm2 6.644 CV 1
ASSI { 2260}
(( segid " " and resid 445 and name HG2 ))
(( segid " " and resid 445 and name HA ))
2.600 0.800 0.800 peak 2260 spectrum 1 weight 0.10000E+01 volume 0.13204E-01 ppm1 2.174 ppm2 4.221 CV 1
ASSI { 2305}
(( segid " " and resid 375 and name HB3 ))
(( segid " " and resid 375 and name H ))
2.900 1.000 1.000 peak 2305 spectrum 1 weight 0.10000E+01 volume 0.23317E-02 ppm1 1.849 ppm2 8.464 CV 1
ASSI { 4328}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 283 and name HA ))
3.300 1.300 1.300 peak 4328 spectrum 1 weight 0.10000E+01 volume 0.21541E-02 ppm1 0.902 ppm2 4.479 CV 1
ASSI { 1926}
(( segid " " and resid 241 and name HB2 ))
(( segid " " and resid 241 and name H ))
3.400 1.400 1.400 peak 1926 spectrum 1 weight 0.10000E+01 volume 0.70487E-03 ppm1 2.476 ppm2 8.365 CV 1
ASSI { 1675}
(( segid " " and resid 419 and name HA3 ))
(( segid " " and resid 420 and name H ))
3.700 1.700 1.700 peak 1675 spectrum 1 weight 0.10000E+01 volume 0.12998E-02 ppm1 3.994 ppm2 7.498 CV 1
ASSI { 2943}
( segid " " and resid 323 and name HG1%)
(( segid " " and resid 323 and name HA ))
2.300 0.700 0.700 peak 2943 spectrum 1 weight 0.10000E+01 volume 0.64370E-02 ppm1 0.778 ppm2 3.277 CV 1
ASSI { 1783}
( segid " " and resid 223 and name HE% )
(( segid " " and resid 223 and name HB3 ))
5.100 3.200 0.900 peak 1783 spectrum 1 weight 0.10000E+01 volume 0.81483E-03 ppm1 6.645 ppm2 2.930 CV 1
ASSI { 3481}
(( segid " " and resid 342 and name HB ))
(( segid " " and resid 342 and name HA ))
3.200 1.300 1.300 peak 3481 spectrum 1 weight 0.10000E+01 volume 0.85150E-03 ppm1 1.710 ppm2 3.912 CV 1
ASSI { 3043}
(( segid " " and resid 183 and name HG3 ))
(( segid " " and resid 184 and name HD2 ))
4.300 2.300 1.700 peak 3043 spectrum 1 weight 0.10000E+01 volume 0.14802E-02 ppm1 2.445 ppm2 3.638 CV 1
OR { 3043}
(( segid " " and resid 183 and name HG3 ))
(( segid " " and resid 184 and name HD3 ))
ASSI { 2736}
(( segid " " and resid 222 and name HE2 ))
( segid " " and resid 223 and name HE% )
2.800 1.000 1.000 peak 2736 spectrum 1 weight 0.10000E+01 volume 0.25770E-02 ppm1 2.681 ppm2 6.647 CV 1
OR { 2736}
(( segid " " and resid 222 and name HE3 ))
( segid " " and resid 223 and name HE% )
ASSI { 3580}
(( segid " " and resid 392 and name HB3 ))
(( segid " " and resid 392 and name HD2 ))
4.900 3.000 1.100 peak 3580 spectrum 1 weight 0.10000E+01 volume 0.52443E-03 ppm1 1.632 ppm2 3.138 CV 1
ASSI { 2304}
( segid " " and resid 255 and name HD1%)
(( segid " " and resid 255 and name HB3 ))
2.700 0.900 0.900 peak 2304 spectrum 1 weight 0.10000E+01 volume 0.40290E-02 ppm1 0.600 ppm2 1.080 CV 1
ASSI { 1349}
(( segid " " and resid 208 and name HG3 ))
(( segid " " and resid 312 and name HG2 ))
3.000 1.100 1.100 peak 1349 spectrum 1 weight 0.10000E+01 volume 0.27123E-02 ppm1 0.748 ppm2 2.348 CV 1
OR { 1349}
(( segid " " and resid 208 and name HG2 ))
(( segid " " and resid 312 and name HG2 ))
ASSI { 3456}
(( segid " " and resid 256 and name HB3 ))
(( segid " " and resid 256 and name H ))
4.200 2.200 1.800 peak 3456 spectrum 1 weight 0.10000E+01 volume 0.10573E-02 ppm1 1.934 ppm2 8.256 CV 1
ASSI { 2314}
(( segid " " and resid 185 and name HA ))
( segid " " and resid 186 and name HD2%)
4.300 2.300 1.700 peak 2314 spectrum 1 weight 0.10000E+01 volume 0.74999E-03 ppm1 4.562 ppm2 0.808 CV 1
OR { 2314}
(( segid " " and resid 185 and name HA ))
( segid " " and resid 186 and name HD1%)
ASSI { 2017}
(( segid " " and resid 293 and name HG3 ))
(( segid " " and resid 293 and name HD2 ))
2.900 1.000 1.000 peak 2017 spectrum 1 weight 0.10000E+01 volume 0.12152E-02 ppm1 2.018 ppm2 3.131 CV 1
OR { 2017}
(( segid " " and resid 293 and name HG3 ))
(( segid " " and resid 293 and name HD3 ))
ASSI { 2725}
(( segid " " and resid 391 and name HG ))
(( segid " " and resid 391 and name HA ))
3.200 1.300 1.300 peak 2725 spectrum 1 weight 0.10000E+01 volume 0.15620E-02 ppm1 1.646 ppm2 4.385 CV 1
ASSI { 3245}
( segid " " and resid 364 and name HG1%)
(( segid " " and resid 364 and name HA ))
2.500 0.800 0.800 peak 3245 spectrum 1 weight 0.10000E+01 volume 0.77252E-02 ppm1 1.059 ppm2 3.652 CV 1
ASSI { 3717}
(( segid " " and resid 390 and name HB ))
(( segid " " and resid 390 and name H ))
3.400 1.400 1.400 peak 3717 spectrum 1 weight 0.10000E+01 volume 0.22330E-02 ppm1 3.855 ppm2 8.053 CV 1
ASSI { 4480}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 316 and name H ))
5.100 3.200 0.900 peak 4480 spectrum 1 weight 0.10000E+01 volume 0.42011E-03 ppm1 0.187 ppm2 8.708 CV 1
ASSI { 2254}
(( segid " " and resid 328 and name HA ))
(( segid " " and resid 328 and name H ))
3.100 1.200 1.200 peak 2254 spectrum 1 weight 0.10000E+01 volume 0.82893E-03 ppm1 3.449 ppm2 7.182 CV 1
ASSI { 3384}
( segid " " and resid 350 and name HG1%)
(( segid " " and resid 351 and name H ))
4.400 2.400 1.600 peak 3384 spectrum 1 weight 0.10000E+01 volume 0.13308E-02 ppm1 0.708 ppm2 7.874 CV 1
ASSI { 1699}
(( segid " " and resid 308 and name HA ))
(( segid " " and resid 308 and name HG3 ))
3.500 1.500 1.500 peak 1699 spectrum 1 weight 0.10000E+01 volume 0.38993E-02 ppm1 3.975 ppm2 1.361 CV 1
ASSI { 4213}
( segid " " and resid 307 and name HD1%)
(( segid " " and resid 306 and name H ))
4.500 2.500 1.500 peak 4213 spectrum 1 weight 0.10000E+01 volume 0.59773E-03 ppm1 1.215 ppm2 8.024 CV 1
ASSI { 4795}
( segid " " and resid 300 and name HG2%)
(( segid " " and resid 300 and name HA ))
3.100 1.200 1.200 peak 4795 spectrum 1 weight 0.10000E+01 volume 0.48776E-02 ppm1 0.538 ppm2 2.907 CV 1
ASSI { 4677}
( segid " " and resid 372 and name HG1%)
(( segid " " and resid 373 and name H ))
3.000 1.200 1.200 peak 4677 spectrum 1 weight 0.10000E+01 volume 0.78042E-02 ppm1 0.645 ppm2 8.232 CV 1
ASSI { 1470}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 352 and name HB ))
2.500 0.800 0.800 peak 1470 spectrum 1 weight 0.10000E+01 volume 0.25347E-02 ppm1 0.729 ppm2 1.135 CV 1
ASSI { 3114}
(( segid " " and resid 253 and name HB ))
( segid " " and resid 243 and name HD1%)
4.500 2.500 1.500 peak 3114 spectrum 1 weight 0.10000E+01 volume 0.76410E-03 ppm1 3.519 ppm2 0.016 CV 1
ASSI { 4015}
(( segid " " and resid 399 and name HA ))
(( segid " " and resid 399 and name HG2 ))
2.900 1.100 1.100 peak 4015 spectrum 1 weight 0.10000E+01 volume 0.43872E-02 ppm1 3.761 ppm2 1.352 CV 1
ASSI { 2927}
( segid " " and resid 391 and name HD2%)
(( segid " " and resid 439 and name H ))
4.100 2.100 1.900 peak 2927 spectrum 1 weight 0.10000E+01 volume 0.65413E-03 ppm1 0.530 ppm2 8.741 CV 1
ASSI { 2464}
( segid " " and resid 233 and name HG1%)
(( segid " " and resid 232 and name H ))
5.100 3.300 0.900 peak 2464 spectrum 1 weight 0.10000E+01 volume 0.97553E-03 ppm1 0.868 ppm2 8.786 CV 1
ASSI { 2097}
(( segid " " and resid 321 and name HB2 ))
(( segid " " and resid 321 and name H ))
3.400 1.400 1.400 peak 2097 spectrum 1 weight 0.10000E+01 volume 0.32424E-03 ppm1 1.929 ppm2 8.571 CV 1
ASSI { 3908}
( segid " " and resid 207 and name HG2%)
(( segid " " and resid 207 and name HA ))
2.900 1.100 1.100 peak 3908 spectrum 1 weight 0.10000E+01 volume 0.23768E-02 ppm1 0.461 ppm2 3.798 CV 1
ASSI { 3841}
(( segid " " and resid 320 and name HA ))
(( segid " " and resid 320 and name HB2 ))
3.700 1.700 1.700 peak 3841 spectrum 1 weight 0.10000E+01 volume 0.45677E-03 ppm1 3.829 ppm2 2.919 CV 1
ASSI { 708}
(( segid " " and resid 360 and name HA ))
( segid " " and resid 303 and name HE% )
3.700 1.700 1.700 peak 708 spectrum 1 weight 0.10000E+01 volume 0.42857E-03 ppm1 4.250 ppm2 6.786 CV 1
ASSI { 1611}
(( segid " " and resid 336 and name HG2 ))
(( segid " " and resid 336 and name HB3 ))
2.700 0.900 0.900 peak 1611 spectrum 1 weight 0.10000E+01 volume 0.35696E-02 ppm1 1.165 ppm2 2.011 CV 1
OR { 1611}
(( segid " " and resid 336 and name HG2 ))
(( segid " " and resid 336 and name HB2 ))
ASSI { 3263}
( segid " " and resid 204 and name HD% )
(( segid " " and resid 408 and name HB2 ))
3.700 1.700 1.700 peak 3263 spectrum 1 weight 0.10000E+01 volume 0.79791E-03 ppm1 6.873 ppm2 1.938 CV 1
ASSI { 4573}
(( segid " " and resid 420 and name HG12))
(( segid " " and resid 420 and name HB ))
2.500 0.800 0.800 peak 4573 spectrum 1 weight 0.10000E+01 volume 0.88023E-02 ppm1 1.113 ppm2 1.765 CV 1
ASSI { 4097}
(( segid " " and resid 242 and name HG2 ))
( segid " " and resid 243 and name HD1%)
5.600 3.900 0.400 peak 4097 spectrum 1 weight 0.10000E+01 volume 0.48776E-03 ppm1 2.238 ppm2 0.014 CV 1
ASSI { 4343}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 285 and name HD3 ))
2.000 2.000 4.000 peak 4343 spectrum 1 weight 0.10000E+01 volume 0.52189E-02 ppm1 2.152 ppm2 3.687 CV 1
ASSI { 2516}
( segid " " and resid 189 and name HD1%)
(( segid " " and resid 189 and name HB ))
3.600 1.600 1.600 peak 2516 spectrum 1 weight 0.10000E+01 volume 0.26306E-02 ppm1 0.736 ppm2 2.175 CV 1
ASSI { 2612}
(( segid " " and resid 382 and name HZ2 ))
(( segid " " and resid 388 and name HB2 ))
4.200 2.200 1.800 peak 2612 spectrum 1 weight 0.10000E+01 volume 0.54981E-03 ppm1 7.454 ppm2 1.574 CV 1
ASSI { 2049}
(( segid " " and resid 244 and name HG3 ))
(( segid " " and resid 244 and name HD2 ))
3.400 1.400 1.400 peak 2049 spectrum 1 weight 0.10000E+01 volume 0.56952E-03 ppm1 -0.553 ppm2 0.955 CV 1
ASSI { 2371}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 329 and name H ))
4.000 2.000 2.000 peak 2371 spectrum 1 weight 0.10000E+01 volume 0.22782E-02 ppm1 0.748 ppm2 7.948 CV 1
ASSI { 4338}
(( segid " " and resid 408 and name HB3 ))
(( segid " " and resid 408 and name H ))
3.400 1.500 1.500 peak 4338 spectrum 1 weight 0.10000E+01 volume 0.74153E-03 ppm1 1.644 ppm2 7.462 CV 1
ASSI { 2144}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 368 and name HZ ))
2.700 0.900 0.900 peak 2144 spectrum 1 weight 0.10000E+01 volume 0.30817E-02 ppm1 0.350 ppm2 6.285 CV 1
ASSI { 666}
(( segid " " and resid 242 and name HB2 ))
( segid " " and resid 243 and name HD2%)
5.300 3.600 0.700 peak 666 spectrum 1 weight 0.10000E+01 volume 0.63439E-03 ppm1 2.232 ppm2 0.166 CV 1
ASSI { 1810}
( segid " " and resid 372 and name HG1%)
(( segid " " and resid 320 and name HE1 ))
4.600 2.700 1.400 peak 1810 spectrum 1 weight 0.10000E+01 volume 0.34398E-03 ppm1 0.652 ppm2 10.108 CV 1
ASSI { 3794}
(( segid " " and resid 227 and name HB3 ))
(( segid " " and resid 227 and name HA ))
3.400 1.500 1.500 peak 3794 spectrum 1 weight 0.10000E+01 volume 0.10517E-02 ppm1 2.818 ppm2 4.210 CV 1
ASSI { 2275}
( segid " " and resid 240 and name HG2%)
(( segid " " and resid 240 and name HB ))
2.300 0.700 0.700 peak 2275 spectrum 1 weight 0.10000E+01 volume 0.67356E-02 ppm1 0.773 ppm2 2.178 CV 1
ASSI { 2352}
(( segid " " and resid 358 and name HB2 ))
(( segid " " and resid 358 and name HB3 ))
2.100 0.500 0.500 peak 2352 spectrum 1 weight 0.10000E+01 volume 0.18129E-02 ppm1 3.276 ppm2 2.952 CV 1
ASSI { 3734}
(( segid " " and resid 289 and name HA ))
(( segid " " and resid 289 and name HB2 ))
2.300 0.700 0.700 peak 3734 spectrum 1 weight 0.10000E+01 volume 0.10931E-01 ppm1 3.909 ppm2 1.997 CV 1
ASSI { 4196}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 284 and name HA ))
2.300 0.700 0.700 peak 4196 spectrum 1 weight 0.10000E+01 volume 0.58165E-02 ppm1 2.586 ppm2 4.299 CV 1
OR { 4196}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 284 and name HA ))
ASSI { 3986}
( segid " " and resid 243 and name HD1%)
(( segid " " and resid 243 and name HA ))
4.200 2.200 1.800 peak 3986 spectrum 1 weight 0.10000E+01 volume 0.16466E-02 ppm1 0.012 ppm2 3.907 CV 1
ASSI { 2165}
( segid " " and resid 443 and name HD2%)
(( segid " " and resid 399 and name H ))
2.300 2.300 3.700 peak 2165 spectrum 1 weight 0.10000E+01 volume 0.24417E-02 ppm1 0.782 ppm2 8.327 CV 1
ASSI { 504}
( segid " " and resid 316 and name HD1%)
(( segid " " and resid 317 and name H ))
4.100 2.100 1.900 peak 504 spectrum 1 weight 0.10000E+01 volume 0.20554E-02 ppm1 0.822 ppm2 7.507 CV 1
ASSI { 3809}
(( segid " " and resid 222 and name HB3 ))
(( segid " " and resid 222 and name HB2 ))
2.000 0.500 0.500 peak 3809 spectrum 1 weight 0.10000E+01 volume 0.29830E-02 ppm1 0.814 ppm2 1.230 CV 1
OR { 3809}
(( segid " " and resid 222 and name HB3 ))
(( segid " " and resid 222 and name HD3 ))
OR { 3809}
(( segid " " and resid 222 and name HB3 ))
(( segid " " and resid 222 and name HD2 ))
ASSI { 4336}
(( segid " " and resid 378 and name HE3 ))
(( segid " " and resid 378 and name H ))
4.800 2.900 1.200 peak 4336 spectrum 1 weight 0.10000E+01 volume 0.76970E-03 ppm1 2.967 ppm2 8.576 CV 1
OR { 4336}
(( segid " " and resid 378 and name HE2 ))
(( segid " " and resid 378 and name H ))
ASSI { 4799}
(( segid " " and resid 318 and name HA ))
( segid " " and resid 318 and name HD1%)
2.300 0.700 0.700 peak 4799 spectrum 1 weight 0.10000E+01 volume 0.38626E-02 ppm1 3.368 ppm2 0.363 CV 1
OR { 4799}
(( segid " " and resid 318 and name HA ))
( segid " " and resid 318 and name HG2%)
ASSI { 4780}
( segid " " and resid 420 and name HG2%)
(( segid " " and resid 422 and name HB3 ))
3.900 1.900 1.900 peak 4780 spectrum 1 weight 0.10000E+01 volume 0.15733E-02 ppm1 0.805 ppm2 2.656 CV 1
ASSI { 3872}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 306 and name HG ))
2.000 0.500 0.500 peak 3872 spectrum 1 weight 0.10000E+01 volume 0.49058E-02 ppm1 0.378 ppm2 1.350 CV 1
ASSI { 1500}
( segid " " and resid 443 and name HD2%)
(( segid " " and resid 399 and name HE2 ))
2.400 0.700 0.700 peak 1500 spectrum 1 weight 0.10000E+01 volume 0.69471E-02 ppm1 0.784 ppm2 2.849 CV 1
OR { 1500}
( segid " " and resid 443 and name HD2%)
(( segid " " and resid 399 and name HE3 ))
ASSI { 3582}
( segid " " and resid 202 and name HE% )
(( segid " " and resid 202 and name HG3 ))
2.600 0.800 0.800 peak 3582 spectrum 1 weight 0.10000E+01 volume 0.74548E-02 ppm1 1.869 ppm2 2.773 CV 1
ASSI { 4057}
( segid " " and resid 243 and name HD2%)
(( segid " " and resid 243 and name HB2 ))
3.500 1.600 1.600 peak 4057 spectrum 1 weight 0.10000E+01 volume 0.23063E-02 ppm1 0.166 ppm2 1.769 CV 1
ASSI { 3165}
(( segid " " and resid 256 and name HG2 ))
(( segid " " and resid 256 and name H ))
2.900 1.100 1.100 peak 3165 spectrum 1 weight 0.10000E+01 volume 0.31437E-02 ppm1 2.312 ppm2 8.253 CV 1
ASSI { 3448}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 284 and name HG3 ))
4.900 3.000 1.100 peak 3448 spectrum 1 weight 0.10000E+01 volume 0.12941E-02 ppm1 0.168 ppm2 2.587 CV 1
OR { 3448}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 284 and name HG2 ))
ASSI { 4399}
( segid " " and resid 212 and name HG1%)
(( segid " " and resid 211 and name H ))
5.200 3.300 0.800 peak 4399 spectrum 1 weight 0.10000E+01 volume 0.27913E-03 ppm1 -0.341 ppm2 7.449 CV 1
ASSI { 1800}
(( segid " " and resid 417 and name HA ))
(( segid " " and resid 417 and name HB3 ))
2.400 0.700 0.700 peak 1800 spectrum 1 weight 0.10000E+01 volume 0.83570E-02 ppm1 4.117 ppm2 2.059 CV 1
OR { 1800}
(( segid " " and resid 417 and name HA ))
(( segid " " and resid 417 and name HB2 ))
ASSI { 2537}
(( segid " " and resid 333 and name HB3 ))
(( segid " " and resid 333 and name H ))
3.000 1.100 1.100 peak 2537 spectrum 1 weight 0.10000E+01 volume 0.39247E-02 ppm1 1.504 ppm2 8.636 CV 1
ASSI { 644}
(( segid " " and resid 288 and name HB3 ))
( segid " " and resid 356 and name HG2%)
4.600 2.700 1.400 peak 644 spectrum 1 weight 0.10000E+01 volume 0.43139E-03 ppm1 2.059 ppm2 0.384 CV 1
ASSI { 3975}
(( segid " " and resid 252 and name HB2 ))
(( segid " " and resid 252 and name H ))
3.300 1.300 1.300 peak 3975 spectrum 1 weight 0.10000E+01 volume 0.14154E-02 ppm1 3.739 ppm2 8.399 CV 1
ASSI { 1530}
( segid " " and resid 267 and name HD1%)
(( segid " " and resid 213 and name HA ))
2.200 0.600 0.600 peak 1530 spectrum 1 weight 0.10000E+01 volume 0.49002E-02 ppm1 0.917 ppm2 3.591 CV 1
ASSI { 2983}
(( segid " " and resid 429 and name HB2 ))
(( segid " " and resid 429 and name HB3 ))
2.200 0.600 0.600 peak 2983 spectrum 1 weight 0.10000E+01 volume 0.96146E-03 ppm1 1.415 ppm2 1.775 CV 1
ASSI { 3494}
(( segid " " and resid 239 and name HG3 ))
(( segid " " and resid 239 and name HA ))
4.200 2.200 1.800 peak 3494 spectrum 1 weight 0.10000E+01 volume 0.76692E-03 ppm1 1.588 ppm2 4.285 CV 1
ASSI { 2303}
(( segid " " and resid 256 and name HG3 ))
(( segid " " and resid 256 and name HA ))
3.100 1.200 1.200 peak 2303 spectrum 1 weight 0.10000E+01 volume 0.30789E-02 ppm1 2.388 ppm2 4.104 CV 1
ASSI { 3637}
(( segid " " and resid 199 and name HG2 ))
(( segid " " and resid 199 and name HA ))
2.300 0.700 0.700 peak 3637 spectrum 1 weight 0.10000E+01 volume 0.14543E-01 ppm1 2.281 ppm2 3.805 CV 1
OR { 3637}
(( segid " " and resid 199 and name HG3 ))
(( segid " " and resid 199 and name HA ))
ASSI { 4807}
( segid " " and resid 429 and name HD2%)
(( segid " " and resid 429 and name HG ))
1.900 0.500 0.500 peak 4807 spectrum 1 weight 0.10000E+01 volume 0.25189E-01 ppm1 0.643 ppm2 1.398 CV 1
OR { 4807}
( segid " " and resid 429 and name HD2%)
(( segid " " and resid 429 and name HB2 ))
ASSI { 4230}
( segid " " and resid 437 and name HG2%)
(( segid " " and resid 438 and name H ))
3.100 1.200 1.200 peak 4230 spectrum 1 weight 0.10000E+01 volume 0.39585E-02 ppm1 1.187 ppm2 7.575 CV 1
ASSI { 3462}
( segid " " and resid 203 and name HE% )
( segid " " and resid 204 and name HE% )
3.600 1.600 1.600 peak 3462 spectrum 1 weight 0.10000E+01 volume 0.15564E-02 ppm1 2.220 ppm2 6.871 CV 1
OR { 3462}
( segid " " and resid 203 and name HE% )
( segid " " and resid 204 and name HD% )
ASSI { 3307}
(( segid " " and resid 387 and name HA ))
(( segid " " and resid 388 and name H ))
3.500 1.500 1.500 peak 3307 spectrum 1 weight 0.10000E+01 volume 0.15817E-02 ppm1 4.291 ppm2 8.233 CV 1
ASSI { 2888}
( segid " " and resid 207 and name HD1%)
( segid " " and resid 207 and name HG2%)
2.200 0.600 0.600 peak 2888 spectrum 1 weight 0.10000E+01 volume 0.11368E-01 ppm1 0.884 ppm2 0.456 CV 1
ASSI { 3046}
(( segid " " and resid 392 and name HD3 ))
( segid " " and resid 391 and name HD1%)
2.400 2.400 3.600 peak 3046 spectrum 1 weight 0.10000E+01 volume 0.16015E-02 ppm1 3.556 ppm2 0.759 CV 1
ASSI { 1736}
( segid " " and resid 409 and name HD2%)
(( segid " " and resid 409 and name H ))
4.100 2.100 1.900 peak 1736 spectrum 1 weight 0.10000E+01 volume 0.23486E-02 ppm1 0.740 ppm2 8.727 CV 1
ASSI { 4292}
( segid " " and resid 217 and name HD1%)
( segid " " and resid 220 and name HG1%)
3.600 1.600 1.600 peak 4292 spectrum 1 weight 0.10000E+01 volume 0.21654E-02 ppm1 -0.047 ppm2 1.107 CV 1
OR { 4292}
( segid " " and resid 217 and name HD1%)
( segid " " and resid 220 and name HG2%)
ASSI { 4227}
(( segid " " and resid 188 and name HG3 ))
(( segid " " and resid 188 and name HA ))
3.600 1.600 1.600 peak 4227 spectrum 1 weight 0.10000E+01 volume 0.27039E-02 ppm1 1.938 ppm2 4.708 CV 1
OR { 4227}
(( segid " " and resid 188 and name HG2 ))
(( segid " " and resid 188 and name HA ))
ASSI { 2310}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 319 and name HG ))
5.400 3.600 0.600 peak 2310 spectrum 1 weight 0.10000E+01 volume 0.96428E-03 ppm1 0.378 ppm2 4.058 CV 1
ASSI { 2818}
(( segid " " and resid 184 and name HB3 ))
(( segid " " and resid 184 and name HA ))
2.100 0.600 0.600 peak 2818 spectrum 1 weight 0.10000E+01 volume 0.10675E-01 ppm1 1.813 ppm2 4.302 CV 1
ASSI { 2321}
(( segid " " and resid 297 and name HB ))
(( segid " " and resid 300 and name H ))
5.000 3.100 1.000 peak 2321 spectrum 1 weight 0.10000E+01 volume 0.45959E-03 ppm1 3.942 ppm2 7.919 CV 1
ASSI { 2467}
(( segid " " and resid 305 and name HD3 ))
(( segid " " and resid 305 and name HA ))
3.200 1.300 1.300 peak 2467 spectrum 1 weight 0.10000E+01 volume 0.15789E-02 ppm1 3.020 ppm2 3.825 CV 1
ASSI { 1884}
(( segid " " and resid 282 and name HG2 ))
(( segid " " and resid 282 and name HB2 ))
2.200 0.600 0.600 peak 1884 spectrum 1 weight 0.10000E+01 volume 0.10012E-01 ppm1 2.396 ppm2 1.863 CV 1
ASSI { 2067}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 322 and name HG13))
2.500 0.800 0.800 peak 2067 spectrum 1 weight 0.10000E+01 volume 0.20272E-02 ppm1 0.389 ppm2 0.204 CV 1
ASSI { 2584}
(( segid " " and resid 398 and name HG13))
(( segid " " and resid 398 and name HG12))
2.600 2.600 3.400 peak 2584 spectrum 1 weight 0.10000E+01 volume 0.86560E-03 ppm1 1.601 ppm2 0.573 CV 1
OR { 2584}
(( segid " " and resid 398 and name HG13))
( segid " " and resid 398 and name HD1%)
ASSI { 2400}
( segid " " and resid 377 and name HE% )
( segid " " and resid 204 and name HE% )
3.800 1.800 1.800 peak 2400 spectrum 1 weight 0.10000E+01 volume 0.14492E-02 ppm1 1.995 ppm2 6.859 CV 1
OR { 2400}
( segid " " and resid 377 and name HE% )
( segid " " and resid 204 and name HD% )
ASSI { 2954}
(( segid " " and resid 366 and name HG3 ))
(( segid " " and resid 366 and name H ))
2.900 1.100 1.100 peak 2954 spectrum 1 weight 0.10000E+01 volume 0.28392E-02 ppm1 2.211 ppm2 8.325 CV 1
ASSI { 4223}
(( segid " " and resid 305 and name HB3 ))
(( segid " " and resid 305 and name HA ))
2.300 0.600 0.600 peak 4223 spectrum 1 weight 0.10000E+01 volume 0.44803E-02 ppm1 1.845 ppm2 3.828 CV 1
OR { 4223}
(( segid " " and resid 305 and name HB2 ))
(( segid " " and resid 305 and name HA ))
ASSI { 2944}
(( segid " " and resid 228 and name HG2 ))
(( segid " " and resid 336 and name HG3 ))
3.600 1.600 1.600 peak 2944 spectrum 1 weight 0.10000E+01 volume 0.15761E-02 ppm1 2.068 ppm2 1.329 CV 1
ASSI { 4812}
(( segid " " and resid 346 and name HB3 ))
(( segid " " and resid 346 and name HB2 ))
1.800 0.400 0.400 peak 4812 spectrum 1 weight 0.10000E+01 volume 0.39359E-02 ppm1 1.483 ppm2 1.720 CV 1
OR { 4812}
(( segid " " and resid 346 and name HB3 ))
(( segid " " and resid 346 and name HG ))
ASSI { 4354}
(( segid " " and resid 202 and name HB3 ))
(( segid " " and resid 202 and name HG3 ))
3.500 1.600 1.600 peak 4354 spectrum 1 weight 0.10000E+01 volume 0.93043E-03 ppm1 2.250 ppm2 2.764 CV 1
ASSI { 4442}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 398 and name HB ))
2.200 0.600 0.600 peak 4442 spectrum 1 weight 0.10000E+01 volume 0.46605E-02 ppm1 0.808 ppm2 1.796 CV 1
ASSI { 2155}
(( segid " " and resid 390 and name HB ))
( segid " " and resid 390 and name HG2%)
2.200 0.600 0.600 peak 2155 spectrum 1 weight 0.10000E+01 volume 0.10401E-01 ppm1 3.855 ppm2 1.078 CV 1
ASSI { 4195}
( segid " " and resid 287 and name HE% )
( segid " " and resid 287 and name HD% )
3.800 1.800 1.800 peak 4195 spectrum 1 weight 0.10000E+01 volume 0.31296E-03 ppm1 6.971 ppm2 6.352 CV 1
ASSI { 4438}
(( segid " " and resid 226 and name HG3 ))
(( segid " " and resid 226 and name HE2 ))
2.600 0.900 0.900 peak 4438 spectrum 1 weight 0.10000E+01 volume 0.50892E-02 ppm1 1.211 ppm2 2.915 CV 1
OR { 4438}
(( segid " " and resid 226 and name HG3 ))
(( segid " " and resid 226 and name HE3 ))
ASSI { 2913}
(( segid " " and resid 445 and name HB2 ))
(( segid " " and resid 446 and name H ))
3.900 1.900 1.900 peak 2913 spectrum 1 weight 0.10000E+01 volume 0.21569E-02 ppm1 2.044 ppm2 7.626 CV 1
ASSI { 107}
(( segid " " and resid 316 and name HA ))
( segid " " and resid 316 and name HD1%)
3.200 1.300 1.300 peak 107 spectrum 1 weight 0.10000E+01 volume 0.23768E-02 ppm1 3.575 ppm2 0.802 CV 1
OR { 107}
(( segid " " and resid 316 and name HA ))
( segid " " and resid 316 and name HD2%)
ASSI { 2945}
( segid " " and resid 230 and name HG2%)
(( segid " " and resid 335 and name HB ))
3.300 1.400 1.400 peak 2945 spectrum 1 weight 0.10000E+01 volume 0.25178E-02 ppm1 0.950 ppm2 4.176 CV 1
ASSI { 3275}
( segid " " and resid 342 and name HD1%)
( segid " " and resid 337 and name HE% )
2.100 0.600 0.600 peak 3275 spectrum 1 weight 0.10000E+01 volume 0.10697E-01 ppm1 0.658 ppm2 1.796 CV 1
ASSI { 2718}
(( segid " " and resid 420 and name HG13))
( segid " " and resid 420 and name HD1%)
1.900 0.500 0.500 peak 2718 spectrum 1 weight 0.10000E+01 volume 0.32650E-01 ppm1 1.382 ppm2 0.784 CV 1
OR { 2718}
(( segid " " and resid 420 and name HG13))
( segid " " and resid 420 and name HG2%)
ASSI { 1634}
( segid " " and resid 357 and name HD1%)
(( segid " " and resid 360 and name H ))
5.100 3.200 0.900 peak 1634 spectrum 1 weight 0.10000E+01 volume 0.98681E-03 ppm1 0.672 ppm2 7.300 CV 1
ASSI { 3124}
( segid " " and resid 367 and name HD1%)
( segid " " and resid 359 and name HG2%)
2.700 2.700 3.300 peak 3124 spectrum 1 weight 0.10000E+01 volume 0.82893E-03 ppm1 0.663 ppm2 -0.447 CV 1
ASSI { 3852}
(( segid " " and resid 187 and name HG3 ))
(( segid " " and resid 187 and name HE3 ))
2.200 0.600 0.600 peak 3852 spectrum 1 weight 0.10000E+01 volume 0.20207E-01 ppm1 1.343 ppm2 2.918 CV 1
OR { 3852}
(( segid " " and resid 187 and name HG3 ))
(( segid " " and resid 187 and name HE2 ))
ASSI { 4423}
(( segid " " and resid 311 and name HD3 ))
(( segid " " and resid 311 and name HD2 ))
2.500 0.800 0.800 peak 4423 spectrum 1 weight 0.10000E+01 volume 0.51033E-03 ppm1 3.102 ppm2 4.050 CV 1
ASSI { 3951}
(( segid " " and resid 390 and name HB ))
(( segid " " and resid 391 and name H ))
4.000 2.000 2.000 peak 3951 spectrum 1 weight 0.10000E+01 volume 0.17904E-02 ppm1 3.853 ppm2 8.191 CV 1
ASSI { 4474}
(( segid " " and resid 358 and name HA ))
(( segid " " and resid 358 and name H ))
3.100 1.200 1.200 peak 4474 spectrum 1 weight 0.10000E+01 volume 0.12631E-02 ppm1 4.003 ppm2 8.550 CV 1
ASSI { 3726}
(( segid " " and resid 446 and name HA ))
( segid " " and resid 446 and name HB% )
1.800 0.400 0.400 peak 3726 spectrum 1 weight 0.10000E+01 volume 0.49309E-01 ppm1 4.043 ppm2 1.262 CV 1
ASSI { 1651}
( segid " " and resid 371 and name HG2%)
( segid " " and resid 368 and name HD% )
2.900 1.100 1.100 peak 1651 spectrum 1 weight 0.10000E+01 volume 0.38880E-02 ppm1 0.962 ppm2 7.167 CV 1
ASSI { 1762}
( segid " " and resid 195 and name HB% )
(( segid " " and resid 196 and name HB2 ))
4.900 3.000 1.100 peak 1762 spectrum 1 weight 0.10000E+01 volume 0.69641E-03 ppm1 1.359 ppm2 2.598 CV 1
ASSI { 2920}
(( segid " " and resid 188 and name HB3 ))
(( segid " " and resid 188 and name HA ))
3.000 1.100 1.100 peak 2920 spectrum 1 weight 0.10000E+01 volume 0.83457E-03 ppm1 2.201 ppm2 4.700 CV 1
ASSI { 2848}
(( segid " " and resid 240 and name HA ))
(( segid " " and resid 243 and name HB3 ))
4.700 2.800 1.300 peak 2848 spectrum 1 weight 0.10000E+01 volume 0.63157E-03 ppm1 3.226 ppm2 1.249 CV 1
ASSI { 3478}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 317 and name HB2 ))
2.400 0.700 0.700 peak 3478 spectrum 1 weight 0.10000E+01 volume 0.38852E-02 ppm1 0.170 ppm2 1.353 CV 1
ASSI { 2318}
(( segid " " and resid 400 and name HG2 ))
(( segid " " and resid 401 and name H ))
3.700 1.800 1.800 peak 2318 spectrum 1 weight 0.10000E+01 volume 0.35386E-02 ppm1 2.340 ppm2 7.813 CV 1
ASSI { 4113}
(( segid " " and resid 436 and name HB3 ))
(( segid " " and resid 433 and name HA ))
3.100 1.200 1.200 peak 4113 spectrum 1 weight 0.10000E+01 volume 0.60901E-03 ppm1 2.029 ppm2 4.010 CV 1
ASSI { 1915}
( segid " " and resid 306 and name HD2%)
( segid " " and resid 306 and name HD1%)
2.100 0.500 0.500 peak 1915 spectrum 1 weight 0.10000E+01 volume 0.90449E-02 ppm1 -0.358 ppm2 0.377 CV 1
ASSI { 523}
( segid " " and resid 323 and name HG2%)
( segid " " and resid 364 and name HG1%)
2.400 0.700 0.700 peak 523 spectrum 1 weight 0.10000E+01 volume 0.25827E-02 ppm1 0.435 ppm2 1.083 CV 1
ASSI { 3743}
( segid " " and resid 307 and name HD1%)
(( segid " " and resid 368 and name HZ ))
3.500 1.600 1.600 peak 3743 spectrum 1 weight 0.10000E+01 volume 0.15451E-02 ppm1 1.211 ppm2 6.297 CV 1
ASSI { 2753}
(( segid " " and resid 306 and name HB2 ))
(( segid " " and resid 306 and name HA ))
4.100 2.100 1.900 peak 2753 spectrum 1 weight 0.10000E+01 volume 0.20582E-03 ppm1 0.954 ppm2 3.651 CV 1
ASSI { 2713}
(( segid " " and resid 336 and name HB3 ))
(( segid " " and resid 336 and name HG3 ))
2.800 1.000 1.000 peak 2713 spectrum 1 weight 0.10000E+01 volume 0.15423E-02 ppm1 1.975 ppm2 1.350 CV 1
ASSI { 435}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 213 and name HZ ))
2.700 0.900 0.900 peak 435 spectrum 1 weight 0.10000E+01 volume 0.31437E-02 ppm1 -0.047 ppm2 6.322 CV 1
ASSI { 3409}
(( segid " " and resid 232 and name HG3 ))
(( segid " " and resid 232 and name H ))
4.700 2.800 1.300 peak 3409 spectrum 1 weight 0.10000E+01 volume 0.44267E-03 ppm1 1.493 ppm2 8.766 CV 1
OR { 3409}
(( segid " " and resid 232 and name HG2 ))
(( segid " " and resid 232 and name H ))
ASSI { 1767}
(( segid " " and resid 328 and name HA ))
( segid " " and resid 328 and name HG1%)
2.500 0.800 0.800 peak 1767 spectrum 1 weight 0.10000E+01 volume 0.38118E-02 ppm1 3.446 ppm2 0.766 CV 1
OR { 1767}
(( segid " " and resid 328 and name HA ))
( segid " " and resid 328 and name HG2%)
ASSI { 1994}
(( segid " " and resid 406 and name HG3 ))
( segid " " and resid 436 and name HD1%)
3.000 1.100 1.100 peak 1994 spectrum 1 weight 0.10000E+01 volume 0.12828E-02 ppm1 2.093 ppm2 1.018 CV 1
ASSI { 2299}
(( segid " " and resid 305 and name HD2 ))
(( segid " " and resid 306 and name H ))
3.000 1.100 1.100 peak 2299 spectrum 1 weight 0.10000E+01 volume 0.17509E-02 ppm1 3.143 ppm2 8.000 CV 1
ASSI { 2972}
( segid " " and resid 230 and name HD1%)
(( segid " " and resid 227 and name HB3 ))
2.400 0.700 0.700 peak 2972 spectrum 1 weight 0.10000E+01 volume 0.28336E-02 ppm1 0.651 ppm2 2.817 CV 1
ASSI { 1000}
(( segid " " and resid 324 and name HE1 ))
( segid " " and resid 220 and name HG1%)
3.700 1.800 1.800 peak 1000 spectrum 1 weight 0.10000E+01 volume 0.58644E-03 ppm1 7.257 ppm2 1.121 CV 1
OR { 1000}
(( segid " " and resid 324 and name HE1 ))
( segid " " and resid 220 and name HG2%)
ASSI { 4211}
(( segid " " and resid 226 and name HG3 ))
(( segid " " and resid 226 and name HB3 ))
2.900 1.000 1.000 peak 4211 spectrum 1 weight 0.10000E+01 volume 0.49256E-02 ppm1 1.210 ppm2 1.957 CV 1
ASSI { 3336}
(( segid " " and resid 298 and name HG2 ))
(( segid " " and resid 299 and name H ))
3.700 1.700 1.700 peak 3336 spectrum 1 weight 0.10000E+01 volume 0.90505E-03 ppm1 2.171 ppm2 7.489 CV 1
ASSI { 4678}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 224 and name H ))
2.800 2.800 3.200 peak 4678 spectrum 1 weight 0.10000E+01 volume 0.79509E-03 ppm1 1.912 ppm2 9.043 CV 1
ASSI { 3356}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 322 and name H ))
3.400 1.400 1.400 peak 3356 spectrum 1 weight 0.10000E+01 volume 0.26277E-02 ppm1 -0.167 ppm2 8.208 CV 1
ASSI { 2455}
(( segid " " and resid 283 and name HB2 ))
(( segid " " and resid 283 and name HA ))
3.900 1.900 1.900 peak 2455 spectrum 1 weight 0.10000E+01 volume 0.32706E-03 ppm1 2.324 ppm2 4.525 CV 1
ASSI { 3799}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 277 and name HD22))
3.000 1.100 1.100 peak 3799 spectrum 1 weight 0.10000E+01 volume 0.75564E-02 ppm1 2.151 ppm2 6.124 CV 1
ASSI { 1723}
( segid " " and resid 247 and name HE% )
( segid " " and resid 247 and name HD% )
3.000 1.100 1.100 peak 1723 spectrum 1 weight 0.10000E+01 volume 0.15705E-02 ppm1 6.477 ppm2 7.319 CV 1
ASSI { 2163}
( segid " " and resid 342 and name HG2%)
( segid " " and resid 361 and name HE% )
3.200 1.300 1.300 peak 2163 spectrum 1 weight 0.10000E+01 volume 0.31691E-02 ppm1 0.514 ppm2 7.055 CV 1
ASSI { 2831}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 218 and name H ))
4.300 2.300 1.700 peak 2831 spectrum 1 weight 0.10000E+01 volume 0.12998E-02 ppm1 -0.047 ppm2 7.966 CV 1
ASSI { 1959}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 399 and name H ))
3.500 1.500 1.500 peak 1959 spectrum 1 weight 0.10000E+01 volume 0.13308E-02 ppm1 0.806 ppm2 8.328 CV 1
ASSI { 3325}
(( segid " " and resid 258 and name HA ))
(( segid " " and resid 258 and name H ))
3.300 1.300 1.300 peak 3325 spectrum 1 weight 0.10000E+01 volume 0.93325E-03 ppm1 4.409 ppm2 8.134 CV 1
ASSI { 2403}
( segid " " and resid 255 and name HD1%)
( segid " " and resid 263 and name HG1%)
2.300 0.700 0.700 peak 2403 spectrum 1 weight 0.10000E+01 volume 0.79198E-02 ppm1 0.599 ppm2 0.032 CV 1
ASSI { 34}
(( segid " " and resid 242 and name HB3 ))
(( segid " " and resid 241 and name H ))
5.200 3.400 0.800 peak 34 spectrum 1 weight 0.10000E+01 volume 0.46520E-03 ppm1 2.202 ppm2 8.371 CV 1
ASSI { 4243}
(( segid " " and resid 318 and name HG12))
(( segid " " and resid 318 and name HA ))
4.300 2.300 1.700 peak 4243 spectrum 1 weight 0.10000E+01 volume 0.71051E-03 ppm1 0.985 ppm2 3.387 CV 1
ASSI { 2282}
( segid " " and resid 247 and name HE% )
(( segid " " and resid 212 and name HA ))
3.700 1.700 1.700 peak 2282 spectrum 1 weight 0.10000E+01 volume 0.46520E-03 ppm1 6.468 ppm2 3.235 CV 1
ASSI { 1998}
( segid " " and resid 339 and name HG2%)
(( segid " " and resid 339 and name HA ))
2.300 0.600 0.600 peak 1998 spectrum 1 weight 0.10000E+01 volume 0.56194E-02 ppm1 0.706 ppm2 3.004 CV 1
ASSI { 165}
( segid " " and resid 223 and name HE% )
(( segid " " and resid 256 and name HG3 ))
3.400 1.400 1.400 peak 165 spectrum 1 weight 0.10000E+01 volume 0.15676E-02 ppm1 6.643 ppm2 2.332 CV 1
OR { 165}
( segid " " and resid 223 and name HE% )
(( segid " " and resid 256 and name HG2 ))
ASSI { 1814}
(( segid " " and resid 293 and name HD2 ))
(( segid " " and resid 293 and name HA ))
2.500 2.500 3.500 peak 1814 spectrum 1 weight 0.10000E+01 volume 0.23176E-02 ppm1 3.075 ppm2 4.283 CV 1
ASSI { 1879}
(( segid " " and resid 316 and name HA ))
(( segid " " and resid 316 and name HB3 ))
3.400 1.400 1.400 peak 1879 spectrum 1 weight 0.10000E+01 volume 0.78098E-03 ppm1 3.574 ppm2 1.601 CV 1
OR { 1879}
(( segid " " and resid 316 and name HA ))
(( segid " " and resid 316 and name HB2 ))
OR { 1879}
(( segid " " and resid 316 and name HA ))
(( segid " " and resid 316 and name HG ))
ASSI { 386}
( segid " " and resid 438 and name HB% )
(( segid " " and resid 440 and name H ))
5.000 3.100 1.000 peak 386 spectrum 1 weight 0.10000E+01 volume 0.49058E-03 ppm1 1.600 ppm2 8.450 CV 1
ASSI { 3005}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 402 and name H ))
3.800 1.800 1.800 peak 3005 spectrum 1 weight 0.10000E+01 volume 0.18806E-02 ppm1 0.704 ppm2 8.717 CV 1
ASSI { 2869}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 339 and name HA ))
3.800 1.800 1.800 peak 2869 spectrum 1 weight 0.10000E+01 volume 0.18750E-02 ppm1 0.514 ppm2 2.992 CV 1
ASSI { 2849}
( segid " " and resid 258 and name HE% )
( segid " " and resid 243 and name HD1%)
3.900 1.900 1.900 peak 2849 spectrum 1 weight 0.10000E+01 volume 0.77816E-03 ppm1 6.637 ppm2 0.022 CV 1
ASSI { 4469}
( segid " " and resid 186 and name HD2%)
(( segid " " and resid 186 and name H ))
2.900 1.000 1.000 peak 4469 spectrum 1 weight 0.10000E+01 volume 0.20639E-02 ppm1 0.830 ppm2 8.041 CV 1
ASSI { 3803}
(( segid " " and resid 198 and name HA ))
( segid " " and resid 198 and name HG2%)
2.600 0.800 0.800 peak 3803 spectrum 1 weight 0.10000E+01 volume 0.40629E-02 ppm1 2.889 ppm2 0.596 CV 1
OR { 3803}
(( segid " " and resid 198 and name HA ))
( segid " " and resid 198 and name HG1%)
ASSI { 3281}
(( segid " " and resid 272 and name HB3 ))
(( segid " " and resid 272 and name H ))
3.700 1.700 1.700 peak 3281 spectrum 1 weight 0.10000E+01 volume 0.16353E-02 ppm1 1.962 ppm2 8.498 CV 1
ASSI { 2076}
(( segid " " and resid 361 and name HB2 ))
(( segid " " and resid 361 and name HA ))
4.200 2.200 1.800 peak 2076 spectrum 1 weight 0.10000E+01 volume 0.29323E-03 ppm1 3.089 ppm2 4.201 CV 1
ASSI { 3655}
( segid " " and resid 377 and name HE% )
(( segid " " and resid 377 and name H ))
4.100 2.100 1.900 peak 3655 spectrum 1 weight 0.10000E+01 volume 0.14887E-02 ppm1 1.995 ppm2 8.232 CV 1
ASSI { 4188}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 217 and name HA ))
2.900 1.000 1.000 peak 4188 spectrum 1 weight 0.10000E+01 volume 0.28872E-02 ppm1 0.463 ppm2 2.968 CV 1
ASSI { 519}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 279 and name HG ))
3.800 1.800 1.800 peak 519 spectrum 1 weight 0.10000E+01 volume 0.23627E-02 ppm1 2.586 ppm2 1.416 CV 1
OR { 519}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 279 and name HB3 ))
OR { 519}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 279 and name HG ))
OR { 519}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 279 and name HB3 ))
ASSI { 4541}
(( segid " " and resid 333 and name HB2 ))
(( segid " " and resid 334 and name H ))
3.000 1.100 1.100 peak 4541 spectrum 1 weight 0.10000E+01 volume 0.15366E-02 ppm1 1.618 ppm2 8.113 CV 1
ASSI { 4400}
( segid " " and resid 443 and name HD2%)
(( segid " " and resid 443 and name HA ))
2.600 0.800 0.800 peak 4400 spectrum 1 weight 0.10000E+01 volume 0.78916E-02 ppm1 0.785 ppm2 4.135 CV 1
ASSI { 4597}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 350 and name HB ))
2.400 0.700 0.700 peak 4597 spectrum 1 weight 0.10000E+01 volume 0.29210E-02 ppm1 0.730 ppm2 2.489 CV 1
ASSI { 2561}
( segid " " and resid 359 and name HG2%)
( segid " " and resid 359 and name HG1%)
2.200 0.600 0.600 peak 2561 spectrum 1 weight 0.10000E+01 volume 0.11250E-01 ppm1 -0.458 ppm2 0.890 CV 1
ASSI { 1972}
(( segid " " and resid 287 and name HA ))
(( segid " " and resid 288 and name H ))
4.000 2.000 2.000 peak 1972 spectrum 1 weight 0.10000E+01 volume 0.54417E-03 ppm1 3.502 ppm2 7.455 CV 1
ASSI { 1752}
(( segid " " and resid 366 and name HG3 ))
( segid " " and resid 300 and name HG2%)
3.800 1.800 1.800 peak 1752 spectrum 1 weight 0.10000E+01 volume 0.19624E-02 ppm1 2.211 ppm2 0.533 CV 1
ASSI { 1707}
(( segid " " and resid 379 and name HD3 ))
(( segid " " and resid 378 and name HA ))
3.300 1.400 1.400 peak 1707 spectrum 1 weight 0.10000E+01 volume 0.60055E-03 ppm1 3.826 ppm2 4.428 CV 1
ASSI { 1787}
(( segid " " and resid 417 and name HA ))
(( segid " " and resid 417 and name HG3 ))
2.700 0.900 0.900 peak 1787 spectrum 1 weight 0.10000E+01 volume 0.55856E-02 ppm1 4.118 ppm2 2.368 CV 1
OR { 1787}
(( segid " " and resid 417 and name HA ))
(( segid " " and resid 417 and name HG2 ))
ASSI { 2828}
(( segid " " and resid 302 and name HG2 ))
( segid " " and resid 306 and name HD1%)
3.800 1.800 1.800 peak 2828 spectrum 1 weight 0.10000E+01 volume 0.11137E-02 ppm1 2.250 ppm2 0.383 CV 1
ASSI { 3624}
( segid " " and resid 267 and name HD1%)
( segid " " and resid 217 and name HD1%)
2.500 0.800 0.800 peak 3624 spectrum 1 weight 0.10000E+01 volume 0.51851E-02 ppm1 0.916 ppm2 -0.044 CV 1
ASSI { 3812}
( segid " " and resid 303 and name HD% )
( segid " " and resid 290 and name HB% )
2.600 0.800 0.800 peak 3812 spectrum 1 weight 0.10000E+01 volume 0.26870E-02 ppm1 7.084 ppm2 1.528 CV 1
ASSI { 4421}
( segid " " and resid 243 and name HD1%)
(( segid " " and resid 244 and name H ))
5.000 3.100 1.000 peak 4421 spectrum 1 weight 0.10000E+01 volume 0.65413E-03 ppm1 0.011 ppm2 8.539 CV 1
ASSI { 1157}
( segid " " and resid 307 and name HD2%)
(( segid " " and resid 304 and name HG2 ))
3.900 1.900 1.900 peak 1157 spectrum 1 weight 0.10000E+01 volume 0.10150E-02 ppm1 1.027 ppm2 2.435 CV 1
ASSI { 4503}
(( segid " " and resid 294 and name HA ))
(( segid " " and resid 294 and name HB ))
2.500 0.800 0.800 peak 4503 spectrum 1 weight 0.10000E+01 volume 0.59716E-02 ppm1 3.897 ppm2 4.297 CV 1
ASSI { 3834}
(( segid " " and resid 228 and name HG3 ))
(( segid " " and resid 228 and name HA ))
3.100 1.200 1.200 peak 3834 spectrum 1 weight 0.10000E+01 volume 0.15507E-02 ppm1 1.966 ppm2 4.003 CV 1
ASSI { 2795}
(( segid " " and resid 222 and name HG2 ))
(( segid " " and resid 222 and name HG3 ))
1.500 0.300 0.700 peak 2795 spectrum 1 weight 0.10000E+01 volume 0.92028E-02 ppm1 0.383 ppm2 0.964 CV 1
ASSI { 2353}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 209 and name HB3 ))
4.200 2.200 1.800 peak 2353 spectrum 1 weight 0.10000E+01 volume 0.60337E-03 ppm1 0.184 ppm2 1.885 CV 1
ASSI { 1760}
(( segid " " and resid 334 and name HA ))
(( segid " " and resid 334 and name HB2 ))
3.300 1.300 1.300 peak 1760 spectrum 1 weight 0.10000E+01 volume 0.10432E-02 ppm1 4.424 ppm2 1.955 CV 1
OR { 1760}
(( segid " " and resid 334 and name HA ))
(( segid " " and resid 334 and name HB3 ))
ASSI { 2994}
(( segid " " and resid 443 and name HG ))
(( segid " " and resid 443 and name H ))
3.500 1.500 1.500 peak 2994 spectrum 1 weight 0.10000E+01 volume 0.21851E-02 ppm1 1.636 ppm2 7.637 CV 1
ASSI { 1415}
(( segid " " and resid 226 and name HA ))
(( segid " " and resid 334 and name HG3 ))
3.600 1.600 1.600 peak 1415 spectrum 1 weight 0.10000E+01 volume 0.10658E-02 ppm1 4.383 ppm2 2.175 CV 1
OR { 1415}
(( segid " " and resid 226 and name HA ))
(( segid " " and resid 334 and name HG2 ))
ASSI { 2955}
(( segid " " and resid 187 and name HB3 ))
(( segid " " and resid 188 and name HD2 ))
4.000 2.000 2.000 peak 2955 spectrum 1 weight 0.10000E+01 volume 0.13928E-02 ppm1 1.681 ppm2 3.478 CV 1
OR { 2955}
(( segid " " and resid 187 and name HB3 ))
(( segid " " and resid 188 and name HD3 ))
ASSI { 338}
(( segid " " and resid 409 and name HA ))
( segid " " and resid 432 and name HG2%)
3.500 1.600 1.600 peak 338 spectrum 1 weight 0.10000E+01 volume 0.94736E-03 ppm1 3.686 ppm2 1.087 CV 1
OR { 338}
(( segid " " and resid 409 and name HA ))
( segid " " and resid 432 and name HG1%)
ASSI { 4220}
( segid " " and resid 349 and name HG2%)
(( segid " " and resid 349 and name HA ))
2.700 0.900 0.900 peak 4220 spectrum 1 weight 0.10000E+01 volume 0.36680E-02 ppm1 1.253 ppm2 3.952 CV 1
ASSI { 3675}
( segid " " and resid 219 and name HE% )
(( segid " " and resid 260 and name HA ))
3.100 1.200 1.200 peak 3675 spectrum 1 weight 0.10000E+01 volume 0.77534E-03 ppm1 6.392 ppm2 4.328 CV 1
ASSI { 2605}
(( segid " " and resid 282 and name HB2 ))
(( segid " " and resid 283 and name H ))
2.900 1.000 1.000 peak 2605 spectrum 1 weight 0.10000E+01 volume 0.13082E-02 ppm1 1.853 ppm2 7.311 CV 1
ASSI { 4254}
( segid " " and resid 192 and name HD1%)
(( segid " " and resid 189 and name HA ))
2.500 0.800 0.800 peak 4254 spectrum 1 weight 0.10000E+01 volume 0.22499E-02 ppm1 0.870 ppm2 4.365 CV 1
ASSI { 1759}
(( segid " " and resid 248 and name HB3 ))
(( segid " " and resid 245 and name HA ))
3.500 1.600 1.600 peak 1759 spectrum 1 weight 0.10000E+01 volume 0.62311E-03 ppm1 2.919 ppm2 3.966 CV 1
ASSI { 3565}
( segid " " and resid 303 and name HD% )
( segid " " and resid 303 and name HE% )
2.300 0.700 0.700 peak 3565 spectrum 1 weight 0.10000E+01 volume 0.57037E-02 ppm1 7.084 ppm2 6.803 CV 1
ASSI { 2387}
( segid " " and resid 420 and name HD1%)
(( segid " " and resid 420 and name H ))
4.000 2.000 2.000 peak 2387 spectrum 1 weight 0.10000E+01 volume 0.34792E-02 ppm1 0.770 ppm2 7.500 CV 1
ASSI { 2672}
(( segid " " and resid 222 and name HD3 ))
(( segid " " and resid 222 and name H ))
4.300 2.300 1.700 peak 2672 spectrum 1 weight 0.10000E+01 volume 0.12462E-02 ppm1 1.281 ppm2 7.246 CV 1
OR { 2672}
(( segid " " and resid 222 and name HD2 ))
(( segid " " and resid 222 and name H ))
ASSI { 3227}
(( segid " " and resid 430 and name HZ2 ))
( segid " " and resid 429 and name HD2%)
3.100 3.100 2.900 peak 3227 spectrum 1 weight 0.10000E+01 volume 0.38626E-03 ppm1 7.301 ppm2 0.634 CV 1
ASSI { 2796}
(( segid " " and resid 223 and name HB3 ))
(( segid " " and resid 223 and name HA ))
3.500 1.500 1.500 peak 2796 spectrum 1 weight 0.10000E+01 volume 0.55827E-03 ppm1 2.928 ppm2 4.665 CV 1
ASSI { 2846}
(( segid " " and resid 230 and name HB ))
(( segid " " and resid 227 and name HB2 ))
4.700 2.800 1.300 peak 2846 spectrum 1 weight 0.10000E+01 volume 0.41729E-03 ppm1 1.834 ppm2 3.146 CV 1
ASSI { 1412}
( segid " " and resid 371 and name HG2%)
( segid " " and resid 371 and name HG1%)
2.000 0.500 0.500 peak 1412 spectrum 1 weight 0.10000E+01 volume 0.17599E-01 ppm1 0.964 ppm2 0.372 CV 1
ASSI { 4797}
(( segid " " and resid 238 and name HA ))
(( segid " " and resid 238 and name HB3 ))
3.100 1.200 1.200 peak 4797 spectrum 1 weight 0.10000E+01 volume 0.21343E-02 ppm1 4.137 ppm2 3.845 CV 1
OR { 4797}
(( segid " " and resid 238 and name HA ))
(( segid " " and resid 238 and name HB2 ))
ASSI { 2555}
( segid " " and resid 437 and name HG2%)
(( segid " " and resid 437 and name HA ))
2.500 0.800 0.800 peak 2555 spectrum 1 weight 0.10000E+01 volume 0.91097E-02 ppm1 1.186 ppm2 3.783 CV 1
ASSI { 2710}
(( segid " " and resid 247 and name HA ))
( segid " " and resid 247 and name HE% )
5.000 3.100 1.000 peak 2710 spectrum 1 weight 0.10000E+01 volume 0.57234E-03 ppm1 4.102 ppm2 6.483 CV 1
ASSI { 2513}
(( segid " " and resid 285 and name HB3 ))
(( segid " " and resid 285 and name HB2 ))
1.800 0.400 0.400 peak 2513 spectrum 1 weight 0.10000E+01 volume 0.67553E-02 ppm1 1.763 ppm2 2.296 CV 1
ASSI { 2724}
(( segid " " and resid 188 and name HB2 ))
(( segid " " and resid 188 and name HA ))
3.700 1.700 1.700 peak 2724 spectrum 1 weight 0.10000E+01 volume 0.60901E-03 ppm1 2.141 ppm2 4.703 CV 1
ASSI { 923}
(( segid " " and resid 340 and name HG3 ))
(( segid " " and resid 344 and name HG12))
3.400 1.400 1.400 peak 923 spectrum 1 weight 0.10000E+01 volume 0.32480E-02 ppm1 2.314 ppm2 1.631 CV 1
OR { 923}
(( segid " " and resid 340 and name HG2 ))
(( segid " " and resid 344 and name HG12))
ASSI { 2309}
( segid " " and resid 212 and name HG2%)
( segid " " and resid 212 and name HG1%)
2.500 0.800 0.800 peak 2309 spectrum 1 weight 0.10000E+01 volume 0.73702E-02 ppm1 -0.167 ppm2 -0.344 CV 1
ASSI { 1816}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 345 and name HA ))
2.400 0.700 0.700 peak 1816 spectrum 1 weight 0.10000E+01 volume 0.11035E-01 ppm1 1.009 ppm2 3.990 CV 1
ASSI { 4775}
(( segid " " and resid 374 and name HG3 ))
(( segid " " and resid 374 and name H ))
2.700 0.900 0.900 peak 4775 spectrum 1 weight 0.10000E+01 volume 0.21118E-02 ppm1 1.363 ppm2 6.321 CV 1
OR { 4775}
(( segid " " and resid 374 and name HG2 ))
(( segid " " and resid 374 and name H ))
ASSI { 4041}
( segid " " and resid 344 and name HD1%)
(( segid " " and resid 344 and name HG13))
1.900 0.400 0.400 peak 4041 spectrum 1 weight 0.10000E+01 volume 0.19395E-01 ppm1 0.818 ppm2 1.216 CV 1
ASSI { 3376}
(( segid " " and resid 267 and name HB3 ))
( segid " " and resid 267 and name HD2%)
3.600 1.600 1.600 peak 3376 spectrum 1 weight 0.10000E+01 volume 0.53853E-03 ppm1 2.269 ppm2 0.918 CV 1
OR { 3376}
(( segid " " and resid 267 and name HB3 ))
( segid " " and resid 267 and name HD1%)
ASSI { 3585}
(( segid " " and resid 249 and name HD3 ))
(( segid " " and resid 249 and name H ))
5.200 3.400 0.800 peak 3585 spectrum 1 weight 0.10000E+01 volume 0.46238E-03 ppm1 3.022 ppm2 7.313 CV 1
ASSI { 348}
(( segid " " and resid 344 and name HG12))
(( segid " " and resid 345 and name H ))
4.900 3.000 1.100 peak 348 spectrum 1 weight 0.10000E+01 volume 0.69641E-03 ppm1 1.660 ppm2 6.994 CV 1
ASSI { 1724}
( segid " " and resid 233 and name HG1%)
(( segid " " and resid 261 and name H ))
4.700 2.700 1.300 peak 1724 spectrum 1 weight 0.10000E+01 volume 0.66260E-03 ppm1 0.869 ppm2 8.905 CV 1
ASSI { 4610}
( segid " " and resid 219 and name HE% )
( segid " " and resid 219 and name HD% )
3.000 1.100 1.100 peak 4610 spectrum 1 weight 0.10000E+01 volume 0.12434E-02 ppm1 6.390 ppm2 6.868 CV 1
ASSI { 4789}
(( segid " " and resid 303 and name HA ))
( segid " " and resid 303 and name HD% )
3.100 1.200 1.200 peak 4789 spectrum 1 weight 0.10000E+01 volume 0.12237E-02 ppm1 3.818 ppm2 7.083 CV 1
ASSI { 3111}
(( segid " " and resid 411 and name HA ))
(( segid " " and resid 411 and name HB3 ))
3.800 1.800 1.800 peak 3111 spectrum 1 weight 0.10000E+01 volume 0.62029E-03 ppm1 3.823 ppm2 3.008 CV 1
ASSI { 2317}
(( segid " " and resid 192 and name HG12))
(( segid " " and resid 192 and name HG13))
1.100 0.200 1.100 peak 2317 spectrum 1 weight 0.10000E+01 volume 0.57904E-01 ppm1 1.341 ppm2 1.614 CV 1
ASSI { 4620}
(( segid " " and resid 302 and name HA ))
(( segid " " and resid 302 and name HG3 ))
3.000 1.100 1.100 peak 4620 spectrum 1 weight 0.10000E+01 volume 0.19793E-02 ppm1 4.319 ppm2 2.092 CV 1
OR { 4620}
(( segid " " and resid 302 and name HA ))
(( segid " " and resid 302 and name HB3 ))
ASSI { 3042}
( segid " " and resid 310 and name HD1%)
(( segid " " and resid 310 and name HG ))
2.200 0.600 0.600 peak 3042 spectrum 1 weight 0.10000E+01 volume 0.54643E-02 ppm1 1.079 ppm2 2.137 CV 1
ASSI { 2524}
(( segid " " and resid 292 and name HA3 ))
(( segid " " and resid 292 and name HA2 ))
2.600 0.800 0.800 peak 2524 spectrum 1 weight 0.10000E+01 volume 0.13252E-02 ppm1 4.180 ppm2 3.721 CV 1
ASSI { 4426}
( segid " " and resid 373 and name HD2%)
(( segid " " and resid 373 and name H ))
2.600 0.900 0.900 peak 4426 spectrum 1 weight 0.10000E+01 volume 0.22866E-02 ppm1 0.513 ppm2 8.228 CV 1
ASSI { 2071}
( segid " " and resid 310 and name HD2%)
(( segid " " and resid 310 and name HG ))
2.100 0.600 0.600 peak 2071 spectrum 1 weight 0.10000E+01 volume 0.51597E-02 ppm1 1.088 ppm2 2.119 CV 1
ASSI { 2553}
(( segid " " and resid 232 and name HB2 ))
(( segid " " and resid 233 and name H ))
4.400 2.400 1.600 peak 2553 spectrum 1 weight 0.10000E+01 volume 0.40883E-03 ppm1 1.510 ppm2 8.000 CV 1
ASSI { 2808}
( segid " " and resid 373 and name HD2%)
( segid " " and resid 373 and name HD1%)
2.300 0.700 0.700 peak 2808 spectrum 1 weight 0.10000E+01 volume 0.70910E-02 ppm1 0.511 ppm2 -0.192 CV 1
ASSI { 562}
( segid " " and resid 436 and name HD1%)
(( segid " " and resid 440 and name HE2 ))
4.100 2.100 1.900 peak 562 spectrum 1 weight 0.10000E+01 volume 0.13421E-02 ppm1 1.012 ppm2 2.846 CV 1
ASSI { 2175}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 317 and name HA ))
3.100 1.200 1.200 peak 2175 spectrum 1 weight 0.10000E+01 volume 0.21541E-02 ppm1 0.170 ppm2 3.133 CV 1
ASSI { 4093}
(( segid " " and resid 283 and name HB2 ))
(( segid " " and resid 280 and name HG1 ))
4.200 2.200 1.800 peak 4093 spectrum 1 weight 0.10000E+01 volume 0.34116E-03 ppm1 2.324 ppm2 7.558 CV 1
ASSI { 3301}
(( segid " " and resid 244 and name HE3 ))
(( segid " " and resid 244 and name HG3 ))
3.800 1.800 1.800 peak 3301 spectrum 1 weight 0.10000E+01 volume 0.99809E-03 ppm1 2.562 ppm2 -0.543 CV 1
OR { 3301}
(( segid " " and resid 244 and name HE2 ))
(( segid " " and resid 244 and name HG3 ))
ASSI { 4286}
(( segid " " and resid 408 and name HB2 ))
(( segid " " and resid 408 and name HA ))
3.300 1.300 1.300 peak 4286 spectrum 1 weight 0.10000E+01 volume 0.80073E-03 ppm1 1.921 ppm2 3.971 CV 1
ASSI { 3120}
(( segid " " and resid 390 and name HB ))
( segid " " and resid 380 and name HD2%)
2.800 2.800 3.200 peak 3120 spectrum 1 weight 0.10000E+01 volume 0.68794E-03 ppm1 3.860 ppm2 0.769 CV 1
OR { 3120}
(( segid " " and resid 390 and name HB ))
( segid " " and resid 380 and name HD1%)
ASSI { 353}
( segid " " and resid 344 and name HG2%)
(( segid " " and resid 344 and name HG13))
3.000 1.100 1.100 peak 353 spectrum 1 weight 0.10000E+01 volume 0.94143E-02 ppm1 0.895 ppm2 1.222 CV 1
ASSI { 4126}
(( segid " " and resid 440 and name HD3 ))
(( segid " " and resid 440 and name H ))
4.600 2.600 1.400 peak 4126 spectrum 1 weight 0.10000E+01 volume 0.76970E-03 ppm1 1.594 ppm2 8.457 CV 1
OR { 4126}
(( segid " " and resid 440 and name HD2 ))
(( segid " " and resid 440 and name H ))
ASSI { 4085}
( segid " " and resid 197 and name HB% )
( segid " " and resid 270 and name HE% )
4.700 2.700 1.300 peak 4085 spectrum 1 weight 0.10000E+01 volume 0.37216E-03 ppm1 1.454 ppm2 6.047 CV 1
ASSI { 4485}
(( segid " " and resid 297 and name HA ))
(( segid " " and resid 300 and name HB ))
4.800 2.900 1.200 peak 4485 spectrum 1 weight 0.10000E+01 volume 0.11926E-02 ppm1 3.729 ppm2 1.734 CV 1
ASSI { 1487}
(( segid " " and resid 336 and name HD3 ))
(( segid " " and resid 335 and name H ))
4.700 2.800 1.300 peak 1487 spectrum 1 weight 0.10000E+01 volume 0.52725E-03 ppm1 1.568 ppm2 8.881 CV 1
ASSI { 171}
( segid " " and resid 240 and name HG2%)
( segid " " and resid 243 and name HD2%)
5.100 3.200 0.900 peak 171 spectrum 1 weight 0.10000E+01 volume 0.86560E-03 ppm1 0.771 ppm2 0.156 CV 1
ASSI { 1393}
( segid " " and resid 335 and name HG2%)
(( segid " " and resid 227 and name H ))
2.900 1.000 1.000 peak 1393 spectrum 1 weight 0.10000E+01 volume 0.22923E-02 ppm1 1.246 ppm2 7.139 CV 1
ASSI { 3605}
( segid " " and resid 253 and name HG2%)
(( segid " " and resid 253 and name H ))
2.800 1.000 1.000 peak 3605 spectrum 1 weight 0.10000E+01 volume 0.50581E-02 ppm1 0.613 ppm2 8.245 CV 1
ASSI { 3412}
(( segid " " and resid 318 and name HG13))
(( segid " " and resid 319 and name H ))
3.900 1.900 1.900 peak 3412 spectrum 1 weight 0.10000E+01 volume 0.56388E-03 ppm1 0.612 ppm2 7.854 CV 1
ASSI { 4717}
(( segid " " and resid 272 and name HB3 ))
(( segid " " and resid 272 and name HD2 ))
3.100 1.200 1.200 peak 4717 spectrum 1 weight 0.10000E+01 volume 0.26757E-02 ppm1 1.964 ppm2 3.228 CV 1
OR { 4717}
(( segid " " and resid 272 and name HB3 ))
(( segid " " and resid 272 and name HD3 ))
ASSI { 3243}
(( segid " " and resid 200 and name HD3 ))
( segid " " and resid 189 and name HD1%)
2.600 0.800 0.800 peak 3243 spectrum 1 weight 0.10000E+01 volume 0.35555E-02 ppm1 3.230 ppm2 0.746 CV 1
OR { 3243}
(( segid " " and resid 200 and name HD2 ))
( segid " " and resid 189 and name HD1%)
ASSI { 4632}
( segid " " and resid 243 and name HD2%)
(( segid " " and resid 243 and name HA ))
2.500 0.800 0.800 peak 4632 spectrum 1 weight 0.10000E+01 volume 0.48917E-02 ppm1 0.164 ppm2 3.891 CV 1
ASSI { 2589}
(( segid " " and resid 276 and name HB2 ))
(( segid " " and resid 276 and name HA ))
2.900 1.000 1.000 peak 2589 spectrum 1 weight 0.10000E+01 volume 0.22330E-02 ppm1 1.826 ppm2 4.433 CV 1
OR { 2589}
(( segid " " and resid 276 and name HB3 ))
(( segid " " and resid 276 and name HA ))
ASSI { 1830}
(( segid " " and resid 221 and name HA ))
(( segid " " and resid 222 and name H ))
3.600 1.600 1.600 peak 1830 spectrum 1 weight 0.10000E+01 volume 0.62593E-03 ppm1 3.891 ppm2 7.236 CV 1
ASSI { 3609}
( segid " " and resid 295 and name HG2%)
(( segid " " and resid 297 and name H ))
2.500 0.800 0.800 peak 3609 spectrum 1 weight 0.10000E+01 volume 0.17142E-02 ppm1 1.183 ppm2 8.050 CV 1
ASSI { 949}
( segid " " and resid 396 and name HB% )
(( segid " " and resid 399 and name H ))
4.500 2.500 1.500 peak 949 spectrum 1 weight 0.10000E+01 volume 0.10489E-02 ppm1 1.346 ppm2 8.331 CV 1
ASSI { 2523}
(( segid " " and resid 411 and name HB3 ))
(( segid " " and resid 411 and name HB2 ))
2.700 0.900 0.900 peak 2523 spectrum 1 weight 0.10000E+01 volume 0.70769E-03 ppm1 2.967 ppm2 2.809 CV 1
ASSI { 110}
(( segid " " and resid 413 and name HB3 ))
( segid " " and resid 409 and name HD2%)
4.600 2.700 1.400 peak 110 spectrum 1 weight 0.10000E+01 volume 0.61183E-03 ppm1 2.979 ppm2 0.760 CV 1
OR { 110}
(( segid " " and resid 413 and name HB3 ))
( segid " " and resid 409 and name HD1%)
ASSI { 3048}
( segid " " and resid 346 and name HD2%)
(( segid " " and resid 325 and name HG2 ))
2.300 0.600 0.600 peak 3048 spectrum 1 weight 0.10000E+01 volume 0.32678E-02 ppm1 0.746 ppm2 2.399 CV 1
ASSI { 3214}
(( segid " " and resid 184 and name HB2 ))
(( segid " " and resid 184 and name HA ))
2.200 0.600 0.600 peak 3214 spectrum 1 weight 0.10000E+01 volume 0.20407E-01 ppm1 2.210 ppm2 4.304 CV 1
ASSI { 1685}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 360 and name HB2 ))
5.200 3.400 0.800 peak 1685 spectrum 1 weight 0.10000E+01 volume 0.52725E-03 ppm1 0.381 ppm2 2.785 CV 1
ASSI { 2384}
(( segid " " and resid 230 and name HA ))
( segid " " and resid 230 and name HG2%)
3.500 1.600 1.600 peak 2384 spectrum 1 weight 0.10000E+01 volume 0.20780E-02 ppm1 3.906 ppm2 0.941 CV 1
ASSI { 2435}
( segid " " and resid 391 and name HD2%)
( segid " " and resid 391 and name HD1%)
2.100 0.500 0.500 peak 2435 spectrum 1 weight 0.10000E+01 volume 0.19164E-01 ppm1 0.531 ppm2 0.739 CV 1
ASSI { 2103}
(( segid " " and resid 222 and name HE2 ))
(( segid " " and resid 223 and name H ))
5.100 3.200 0.900 peak 2103 spectrum 1 weight 0.10000E+01 volume 0.78663E-03 ppm1 2.682 ppm2 8.414 CV 1
OR { 2103}
(( segid " " and resid 222 and name HE3 ))
(( segid " " and resid 223 and name H ))
ASSI { 3579}
( segid " " and resid 307 and name HD1%)
( segid " " and resid 315 and name HE% )
3.600 1.600 1.600 peak 3579 spectrum 1 weight 0.10000E+01 volume 0.49792E-02 ppm1 1.210 ppm2 6.864 CV 1
ASSI { 1252}
(( segid " " and resid 395 and name HG3 ))
( segid " " and resid 446 and name HB% )
4.300 2.300 1.700 peak 1252 spectrum 1 weight 0.10000E+01 volume 0.13759E-02 ppm1 2.443 ppm2 1.270 CV 1
ASSI { 2101}
(( segid " " and resid 425 and name HD3 ))
(( segid " " and resid 425 and name H ))
4.100 2.100 1.900 peak 2101 spectrum 1 weight 0.10000E+01 volume 0.12744E-02 ppm1 1.603 ppm2 7.762 CV 1
OR { 2101}
(( segid " " and resid 425 and name HD2 ))
(( segid " " and resid 425 and name H ))
ASSI { 2447}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 317 and name H ))
4.500 2.500 1.500 peak 2447 spectrum 1 weight 0.10000E+01 volume 0.60619E-03 ppm1 0.551 ppm2 7.531 CV 1
ASSI { 1676}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 322 and name HG13))
2.300 0.700 0.700 peak 1676 spectrum 1 weight 0.10000E+01 volume 0.33524E-02 ppm1 -0.165 ppm2 0.206 CV 1
ASSI { 2298}
(( segid " " and resid 315 and name HA ))
(( segid " " and resid 315 and name HB2 ))
3.300 1.400 1.400 peak 2298 spectrum 1 weight 0.10000E+01 volume 0.45677E-03 ppm1 3.786 ppm2 3.129 CV 1
ASSI { 857}
( segid " " and resid 316 and name HD1%)
( segid " " and resid 315 and name HE% )
3.200 1.300 1.300 peak 857 spectrum 1 weight 0.10000E+01 volume 0.33890E-02 ppm1 0.823 ppm2 6.873 CV 1
ASSI { 2030}
(( segid " " and resid 421 and name HA ))
(( segid " " and resid 421 and name HG3 ))
3.300 1.400 1.400 peak 2030 spectrum 1 weight 0.10000E+01 volume 0.28618E-02 ppm1 4.294 ppm2 1.307 CV 1
OR { 2030}
(( segid " " and resid 421 and name HA ))
(( segid " " and resid 421 and name HG2 ))
ASSI { 1705}
( segid " " and resid 195 and name HB% )
( segid " " and resid 194 and name HD1%)
4.000 2.000 2.000 peak 1705 spectrum 1 weight 0.10000E+01 volume 0.32875E-02 ppm1 1.355 ppm2 0.751 CV 1
ASSI { 1206}
(( segid " " and resid 257 and name HB3 ))
( segid " " and resid 258 and name HE% )
4.200 2.200 1.800 peak 1206 spectrum 1 weight 0.10000E+01 volume 0.35244E-03 ppm1 2.355 ppm2 6.636 CV 1
ASSI { 1913}
(( segid " " and resid 256 and name HG2 ))
(( segid " " and resid 254 and name HD22))
4.400 2.500 1.600 peak 1913 spectrum 1 weight 0.10000E+01 volume 0.12208E-02 ppm1 2.312 ppm2 6.853 CV 1
ASSI { 3950}
(( segid " " and resid 233 and name HA ))
( segid " " and resid 233 and name HG2%)
2.800 1.000 1.000 peak 3950 spectrum 1 weight 0.10000E+01 volume 0.46097E-02 ppm1 3.835 ppm2 0.905 CV 1
OR { 3950}
(( segid " " and resid 233 and name HA ))
( segid " " and resid 233 and name HG1%)
ASSI { 1435}
(( segid " " and resid 344 and name HG12))
( segid " " and resid 344 and name HD1%)
2.100 0.600 0.600 peak 1435 spectrum 1 weight 0.10000E+01 volume 0.10782E-01 ppm1 1.657 ppm2 0.846 CV 1
OR { 1435}
(( segid " " and resid 344 and name HG12))
( segid " " and resid 344 and name HG2%)
ASSI { 4262}
(( segid " " and resid 226 and name HB2 ))
(( segid " " and resid 226 and name HE2 ))
4.100 2.100 1.900 peak 4262 spectrum 1 weight 0.10000E+01 volume 0.16297E-02 ppm1 1.505 ppm2 2.916 CV 1
OR { 4262}
(( segid " " and resid 226 and name HB2 ))
(( segid " " and resid 226 and name HE3 ))
ASSI { 4816}
(( segid " " and resid 351 and name HG2 ))
(( segid " " and resid 351 and name HE22))
4.100 2.100 1.900 peak 4816 spectrum 1 weight 0.10000E+01 volume 0.23825E-02 ppm1 2.170 ppm2 7.564 CV 1
ASSI { 560}
( segid " " and resid 368 and name HE% )
( segid " " and resid 368 and name HD% )
2.900 1.000 1.000 peak 560 spectrum 1 weight 0.10000E+01 volume 0.10714E-02 ppm1 6.742 ppm2 7.098 CV 1
ASSI { 4518}
( segid " " and resid 189 and name HD1%)
( segid " " and resid 212 and name HG1%)
4.900 3.000 1.100 peak 4518 spectrum 1 weight 0.10000E+01 volume 0.54417E-03 ppm1 0.735 ppm2 -0.344 CV 1
ASSI { 3283}
(( segid " " and resid 358 and name HA ))
(( segid " " and resid 358 and name HB2 ))
2.900 1.100 1.100 peak 3283 spectrum 1 weight 0.10000E+01 volume 0.11391E-02 ppm1 4.004 ppm2 3.274 CV 1
ASSI { 1822}
( segid " " and resid 356 and name HG2%)
( segid " " and resid 360 and name HD% )
3.800 1.800 1.800 peak 1822 spectrum 1 weight 0.10000E+01 volume 0.51456E-02 ppm1 0.385 ppm2 7.068 CV 1
OR { 1822}
( segid " " and resid 356 and name HG2%)
( segid " " and resid 360 and name HE% )
ASSI { 2600}
(( segid " " and resid 297 and name HA ))
( segid " " and resid 300 and name HG2%)
3.000 1.100 1.100 peak 2600 spectrum 1 weight 0.10000E+01 volume 0.12237E-02 ppm1 3.731 ppm2 0.535 CV 1
ASSI { 884}
( segid " " and resid 420 and name HD1%)
(( segid " " and resid 416 and name HA ))
3.400 1.400 1.400 peak 884 spectrum 1 weight 0.10000E+01 volume 0.20272E-02 ppm1 0.771 ppm2 4.267 CV 1
ASSI { 4458}
(( segid " " and resid 398 and name HA ))
(( segid " " and resid 398 and name HG12))
3.200 1.300 1.300 peak 4458 spectrum 1 weight 0.10000E+01 volume 0.11870E-02 ppm1 3.428 ppm2 0.558 CV 1
OR { 4458}
(( segid " " and resid 398 and name HA ))
( segid " " and resid 398 and name HD1%)
ASSI { 2153}
(( segid " " and resid 368 and name HZ ))
( segid " " and resid 367 and name HD2%)
4.600 2.600 1.400 peak 2153 spectrum 1 weight 0.10000E+01 volume 0.28759E-03 ppm1 6.267 ppm2 0.754 CV 1
ASSI { 4647}
(( segid " " and resid 359 and name HA ))
(( segid " " and resid 359 and name H ))
3.500 1.500 1.500 peak 4647 spectrum 1 weight 0.10000E+01 volume 0.44549E-03 ppm1 3.321 ppm2 7.192 CV 1
ASSI { 2786}
(( segid " " and resid 296 and name HB3 ))
( segid " " and resid 300 and name HG1%)
4.700 2.700 1.300 peak 2786 spectrum 1 weight 0.10000E+01 volume 0.55545E-03 ppm1 1.977 ppm2 0.074 CV 1
ASSI { 2248}
(( segid " " and resid 336 and name HG2 ))
(( segid " " and resid 336 and name H ))
3.800 1.800 1.800 peak 2248 spectrum 1 weight 0.10000E+01 volume 0.65131E-03 ppm1 1.168 ppm2 9.121 CV 1
ASSI { 2233}
(( segid " " and resid 256 and name HG2 ))
( segid " " and resid 219 and name HE% )
3.700 1.700 1.700 peak 2233 spectrum 1 weight 0.10000E+01 volume 0.16494E-02 ppm1 2.311 ppm2 6.399 CV 1
ASSI { 4339}
(( segid " " and resid 259 and name HG3 ))
(( segid " " and resid 259 and name H ))
3.700 1.700 1.700 peak 4339 spectrum 1 weight 0.10000E+01 volume 0.99527E-03 ppm1 2.452 ppm2 8.457 CV 1
ASSI { 3110}
(( segid " " and resid 369 and name HA2 ))
(( segid " " and resid 365 and name HG3 ))
3.000 3.000 3.000 peak 3110 spectrum 1 weight 0.10000E+01 volume 0.51597E-03 ppm1 3.832 ppm2 2.340 CV 1
OR { 3110}
(( segid " " and resid 369 and name HA2 ))
(( segid " " and resid 365 and name HG2 ))
ASSI { 1402}
(( segid " " and resid 336 and name HE2 ))
(( segid " " and resid 337 and name H ))
3.000 3.000 3.000 peak 1402 spectrum 1 weight 0.10000E+01 volume 0.44267E-03 ppm1 2.864 ppm2 7.302 CV 1
OR { 1402}
(( segid " " and resid 336 and name HE3 ))
(( segid " " and resid 337 and name H ))
ASSI { 2800}
( segid " " and resid 344 and name HD1%)
(( segid " " and resid 341 and name HA ))
2.300 0.700 0.700 peak 2800 spectrum 1 weight 0.10000E+01 volume 0.76857E-02 ppm1 0.819 ppm2 4.410 CV 1
ASSI { 4260}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 209 and name HG ))
2.400 0.700 0.700 peak 4260 spectrum 1 weight 0.10000E+01 volume 0.53289E-02 ppm1 -0.905 ppm2 0.753 CV 1
ASSI { 2289}
( segid " " and resid 270 and name HE% )
( segid " " and resid 189 and name HD1%)
3.000 1.100 1.100 peak 2289 spectrum 1 weight 0.10000E+01 volume 0.50751E-03 ppm1 6.058 ppm2 0.734 CV 1
ASSI { 3546}
( segid " " and resid 372 and name HG2%)
(( segid " " and resid 320 and name HE1 ))
5.300 3.500 0.700 peak 3546 spectrum 1 weight 0.10000E+01 volume 0.39472E-03 ppm1 0.745 ppm2 10.117 CV 1
ASSI { 3921}
(( segid " " and resid 222 and name HD2 ))
(( segid " " and resid 219 and name HA ))
4.400 2.500 1.600 peak 3921 spectrum 1 weight 0.10000E+01 volume 0.73307E-03 ppm1 1.302 ppm2 4.108 CV 1
ASSI { 4237}
(( segid " " and resid 285 and name HB2 ))
(( segid " " and resid 285 and name HD2 ))
4.200 2.200 1.800 peak 4237 spectrum 1 weight 0.10000E+01 volume 0.12096E-02 ppm1 2.302 ppm2 3.558 CV 1
ASSI { 2651}
( segid " " and resid 202 and name HE% )
(( segid " " and resid 207 and name H ))
3.300 1.400 1.400 peak 2651 spectrum 1 weight 0.10000E+01 volume 0.29041E-02 ppm1 1.864 ppm2 6.890 CV 1
ASSI { 538}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 218 and name H ))
4.300 2.300 1.700 peak 538 spectrum 1 weight 0.10000E+01 volume 0.85432E-03 ppm1 2.223 ppm2 7.927 CV 1
ASSI { 2532}
(( segid " " and resid 411 and name HA ))
(( segid " " and resid 411 and name H ))
3.500 1.600 1.600 peak 2532 spectrum 1 weight 0.10000E+01 volume 0.73589E-03 ppm1 3.815 ppm2 7.701 CV 1
ASSI { 3509}
( segid " " and resid 225 and name HE% )
( segid " " and resid 373 and name HD1%)
5.200 3.400 0.800 peak 3509 spectrum 1 weight 0.10000E+01 volume 0.42857E-03 ppm1 1.917 ppm2 -0.195 CV 1
ASSI { 1734}
(( segid " " and resid 312 and name HG3 ))
(( segid " " and resid 312 and name HA ))
3.000 1.100 1.100 peak 1734 spectrum 1 weight 0.10000E+01 volume 0.29887E-02 ppm1 2.072 ppm2 4.025 CV 1
ASSI { 4251}
(( segid " " and resid 281 and name HB2 ))
(( segid " " and resid 282 and name H ))
2.400 0.700 0.700 peak 4251 spectrum 1 weight 0.10000E+01 volume 0.28477E-02 ppm1 1.757 ppm2 8.694 CV 1
ASSI { 4742}
( segid " " and resid 203 and name HE% )
( segid " " and resid 212 and name HG2%)
5.700 4.100 0.300 peak 4742 spectrum 1 weight 0.10000E+01 volume 0.40036E-03 ppm1 2.218 ppm2 -0.168 CV 1
ASSI { 1050}
( segid " " and resid 258 and name HD% )
(( segid " " and resid 255 and name HA ))
3.300 1.300 1.300 peak 1050 spectrum 1 weight 0.10000E+01 volume 0.58080E-03 ppm1 7.080 ppm2 3.953 CV 1
ASSI { 3490}
( segid " " and resid 316 and name HD2%)
(( segid " " and resid 320 and name HE1 ))
3.600 1.600 1.600 peak 3490 spectrum 1 weight 0.10000E+01 volume 0.13082E-02 ppm1 0.746 ppm2 10.113 CV 1
ASSI { 759}
( segid " " and resid 436 and name HD2%)
(( segid " " and resid 436 and name HB2 ))
2.500 0.800 0.800 peak 759 spectrum 1 weight 0.10000E+01 volume 0.43336E-02 ppm1 0.865 ppm2 1.436 CV 1
ASSI { 3940}
(( segid " " and resid 199 and name HG2 ))
( segid " " and resid 198 and name HG1%)
3.200 1.300 1.300 peak 3940 spectrum 1 weight 0.10000E+01 volume 0.47084E-02 ppm1 2.281 ppm2 0.606 CV 1
OR { 3940}
(( segid " " and resid 199 and name HG3 ))
( segid " " and resid 198 and name HG1%)
OR { 3940}
(( segid " " and resid 199 and name HG2 ))
( segid " " and resid 198 and name HG2%)
OR { 3940}
(( segid " " and resid 199 and name HG3 ))
( segid " " and resid 198 and name HG2%)
ASSI { 3783}
(( segid " " and resid 185 and name HB3 ))
(( segid " " and resid 186 and name HB3 ))
5.400 3.600 0.600 peak 3783 spectrum 1 weight 0.10000E+01 volume 0.91633E-03 ppm1 2.659 ppm2 1.527 CV 1
OR { 3783}
(( segid " " and resid 185 and name HB3 ))
(( segid " " and resid 186 and name HB2 ))
ASSI { 4174}
(( segid " " and resid 314 and name HB3 ))
(( segid " " and resid 314 and name HA ))
2.900 1.000 1.000 peak 4174 spectrum 1 weight 0.10000E+01 volume 0.10178E-02 ppm1 2.757 ppm2 3.857 CV 1
ASSI { 2268}
( segid " " and resid 358 and name HD% )
(( segid " " and resid 358 and name HB2 ))
2.800 0.900 0.900 peak 2268 spectrum 1 weight 0.10000E+01 volume 0.20921E-02 ppm1 7.013 ppm2 3.276 CV 1
ASSI { 3779}
(( segid " " and resid 272 and name HD2 ))
(( segid " " and resid 269 and name HE22))
3.000 1.100 1.100 peak 3779 spectrum 1 weight 0.10000E+01 volume 0.38626E-02 ppm1 3.228 ppm2 6.856 CV 1
OR { 3779}
(( segid " " and resid 272 and name HD3 ))
(( segid " " and resid 269 and name HE22))
ASSI { 4754}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 303 and name HA ))
2.600 0.800 0.800 peak 4754 spectrum 1 weight 0.10000E+01 volume 0.19511E-02 ppm1 -0.357 ppm2 3.818 CV 1
ASSI { 2964}
(( segid " " and resid 293 and name HD2 ))
(( segid " " and resid 293 and name HG2 ))
2.400 0.700 0.700 peak 2964 spectrum 1 weight 0.10000E+01 volume 0.34285E-02 ppm1 3.076 ppm2 1.542 CV 1
ASSI { 4671}
(( segid " " and resid 421 and name HE3 ))
(( segid " " and resid 421 and name HA ))
3.400 1.500 1.500 peak 4671 spectrum 1 weight 0.10000E+01 volume 0.60901E-02 ppm1 2.887 ppm2 4.284 CV 1
OR { 4671}
(( segid " " and resid 421 and name HE2 ))
(( segid " " and resid 421 and name HA ))
ASSI { 2583}
(( segid " " and resid 296 and name HG2 ))
(( segid " " and resid 296 and name HB3 ))
2.700 0.900 0.900 peak 2583 spectrum 1 weight 0.10000E+01 volume 0.33073E-02 ppm1 2.409 ppm2 1.975 CV 1
OR { 2583}
(( segid " " and resid 296 and name HG3 ))
(( segid " " and resid 296 and name HB3 ))
ASSI { 2212}
( segid " " and resid 436 and name HD1%)
(( segid " " and resid 436 and name H ))
4.200 2.200 1.800 peak 2212 spectrum 1 weight 0.10000E+01 volume 0.13477E-02 ppm1 1.011 ppm2 8.927 CV 1
ASSI { 368}
(( segid " " and resid 222 and name HE2 ))
( segid " " and resid 223 and name HD% )
4.200 2.200 1.800 peak 368 spectrum 1 weight 0.10000E+01 volume 0.10432E-02 ppm1 2.682 ppm2 6.432 CV 1
OR { 368}
(( segid " " and resid 222 and name HE3 ))
( segid " " and resid 223 and name HD% )
ASSI { 2423}
( segid " " and resid 317 and name HD1%)
( segid " " and resid 213 and name HD% )
3.300 1.300 1.300 peak 2423 spectrum 1 weight 0.10000E+01 volume 0.95582E-03 ppm1 0.170 ppm2 6.695 CV 1
ASSI { 344}
( segid " " and resid 240 and name HG2%)
(( segid " " and resid 239 and name HE2 ))
4.600 2.700 1.400 peak 344 spectrum 1 weight 0.10000E+01 volume 0.76692E-03 ppm1 0.769 ppm2 2.965 CV 1
OR { 344}
( segid " " and resid 240 and name HG2%)
(( segid " " and resid 239 and name HE3 ))
ASSI { 2610}
(( segid " " and resid 419 and name HA2 ))
(( segid " " and resid 420 and name HG12))
5.900 4.300 0.100 peak 2610 spectrum 1 weight 0.10000E+01 volume 0.34680E-03 ppm1 3.770 ppm2 1.117 CV 1
ASSI { 2460}
(( segid " " and resid 413 and name HB3 ))
(( segid " " and resid 413 and name HA ))
3.400 1.500 1.500 peak 2460 spectrum 1 weight 0.10000E+01 volume 0.13336E-02 ppm1 2.994 ppm2 4.189 CV 1
ASSI { 1962}
(( segid " " and resid 421 and name HB2 ))
( segid " " and resid 420 and name HG2%)
3.500 1.600 1.600 peak 1962 spectrum 1 weight 0.10000E+01 volume 0.39331E-02 ppm1 1.670 ppm2 0.813 CV 1
ASSI { 4664}
( segid " " and resid 223 and name HD% )
(( segid " " and resid 219 and name HA ))
4.300 2.300 1.700 peak 4664 spectrum 1 weight 0.10000E+01 volume 0.41447E-03 ppm1 6.430 ppm2 4.131 CV 1
ASSI { 2592}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 213 and name HB2 ))
3.600 1.700 1.700 peak 2592 spectrum 1 weight 0.10000E+01 volume 0.52725E-03 ppm1 0.171 ppm2 2.246 CV 1
ASSI { 2622}
(( segid " " and resid 336 and name HE2 ))
(( segid " " and resid 336 and name H ))
3.800 1.800 1.800 peak 2622 spectrum 1 weight 0.10000E+01 volume 0.12716E-02 ppm1 2.865 ppm2 9.111 CV 1
ASSI { 1963}
(( segid " " and resid 307 and name HB3 ))
(( segid " " and resid 308 and name H ))
3.700 1.700 1.700 peak 1963 spectrum 1 weight 0.10000E+01 volume 0.40883E-03 ppm1 1.641 ppm2 7.045 CV 1
ASSI { 1812}
(( segid " " and resid 222 and name HB2 ))
(( segid " " and resid 222 and name HB3 ))
1.800 0.400 0.400 peak 1812 spectrum 1 weight 0.10000E+01 volume 0.24191E-02 ppm1 1.215 ppm2 0.811 CV 1
ASSI { 3023}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 339 and name HA ))
3.600 1.700 1.700 peak 3023 spectrum 1 weight 0.10000E+01 volume 0.17368E-02 ppm1 0.746 ppm2 3.014 CV 1
ASSI { 388}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 442 and name HE3 ))
2.800 1.000 1.000 peak 388 spectrum 1 weight 0.10000E+01 volume 0.30676E-02 ppm1 0.557 ppm2 2.883 CV 1
OR { 388}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 442 and name HE2 ))
ASSI { 4655}
(( segid " " and resid 281 and name HD3 ))
(( segid " " and resid 281 and name HA ))
2.500 0.800 0.800 peak 4655 spectrum 1 weight 0.10000E+01 volume 0.38231E-02 ppm1 1.662 ppm2 3.978 CV 1
OR { 4655}
(( segid " " and resid 281 and name HD2 ))
(( segid " " and resid 281 and name HA ))
ASSI { 2312}
(( segid " " and resid 308 and name HG2 ))
(( segid " " and resid 308 and name H ))
1.800 0.400 0.400 peak 2312 spectrum 1 weight 0.10000E+01 volume 0.46943E-02 ppm1 1.550 ppm2 7.089 CV 1
ASSI { 3781}
( segid " " and resid 429 and name HD2%)
(( segid " " and resid 429 and name H ))
3.700 1.700 1.700 peak 3781 spectrum 1 weight 0.10000E+01 volume 0.42321E-02 ppm1 0.642 ppm2 8.097 CV 1
ASSI { 866}
( segid " " and resid 352 and name HD1%)
( segid " " and resid 284 and name HE% )
2.600 0.800 0.800 peak 866 spectrum 1 weight 0.10000E+01 volume 0.16917E-02 ppm1 0.602 ppm2 2.153 CV 1
ASSI { 2688}
(( segid " " and resid 421 and name HB2 ))
(( segid " " and resid 422 and name H ))
4.500 2.500 1.500 peak 2688 spectrum 1 weight 0.10000E+01 volume 0.13026E-02 ppm1 1.673 ppm2 8.199 CV 1
ASSI { 3790}
( segid " " and resid 350 and name HG1%)
( segid " " and resid 349 and name HG2%)
2.900 1.100 1.100 peak 3790 spectrum 1 weight 0.10000E+01 volume 0.45057E-02 ppm1 0.716 ppm2 1.252 CV 1
ASSI { 1995}
(( segid " " and resid 425 and name HG3 ))
(( segid " " and resid 425 and name HG2 ))
1.800 0.400 0.400 peak 1995 spectrum 1 weight 0.10000E+01 volume 0.31606E-02 ppm1 1.236 ppm2 1.472 CV 1
ASSI { 3738}
( segid " " and resid 217 and name HD1%)
( segid " " and resid 213 and name HD% )
3.300 1.400 1.400 peak 3738 spectrum 1 weight 0.10000E+01 volume 0.12434E-02 ppm1 -0.046 ppm2 6.715 CV 1
ASSI { 2787}
(( segid " " and resid 333 and name HB2 ))
(( segid " " and resid 333 and name H ))
2.200 0.600 0.600 peak 2787 spectrum 1 weight 0.10000E+01 volume 0.42377E-02 ppm1 1.620 ppm2 8.645 CV 1
ASSI { 2465}
( segid " " and resid 339 and name HG2%)
(( segid " " and resid 340 and name HG3 ))
3.800 1.800 1.800 peak 2465 spectrum 1 weight 0.10000E+01 volume 0.35862E-02 ppm1 0.706 ppm2 2.316 CV 1
OR { 2465}
( segid " " and resid 339 and name HG2%)
(( segid " " and resid 340 and name HG2 ))
ASSI { 2628}
(( segid " " and resid 227 and name HB2 ))
( segid " " and resid 230 and name HD1%)
3.400 1.500 1.500 peak 2628 spectrum 1 weight 0.10000E+01 volume 0.15789E-02 ppm1 3.137 ppm2 0.650 CV 1
ASSI { 396}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 331 and name HD3 ))
3.500 1.500 1.500 peak 396 spectrum 1 weight 0.10000E+01 volume 0.41390E-02 ppm1 1.913 ppm2 1.618 CV 1
OR { 396}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 331 and name HD2 ))
ASSI { 3007}
( segid " " and resid 279 and name HD1%)
( segid " " and resid 310 and name HD1%)
2.200 0.600 0.600 peak 3007 spectrum 1 weight 0.10000E+01 volume 0.90702E-02 ppm1 0.168 ppm2 1.079 CV 1
OR { 3007}
( segid " " and resid 279 and name HD1%)
( segid " " and resid 310 and name HD2%)
ASSI { 733}
( segid " " and resid 317 and name HD2%)
(( segid " " and resid 321 and name H ))
3.800 1.800 1.800 peak 733 spectrum 1 weight 0.10000E+01 volume 0.11334E-02 ppm1 0.343 ppm2 8.566 CV 1
ASSI { 1900}
(( segid " " and resid 420 and name HB ))
(( segid " " and resid 420 and name HG13))
2.100 0.500 0.500 peak 1900 spectrum 1 weight 0.10000E+01 volume 0.80186E-02 ppm1 1.767 ppm2 1.384 CV 1
ASSI { 779}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 322 and name HG12))
2.300 0.700 0.700 peak 779 spectrum 1 weight 0.10000E+01 volume 0.53317E-02 ppm1 -0.166 ppm2 1.377 CV 1
OR { 779}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 322 and name HB ))
ASSI { 2461}
(( segid " " and resid 246 and name HA ))
( segid " " and resid 246 and name HB% )
2.700 0.900 0.900 peak 2461 spectrum 1 weight 0.10000E+01 volume 0.39416E-02 ppm1 3.834 ppm2 1.174 CV 1
ASSI { 2313}
( segid " " and resid 391 and name HD2%)
(( segid " " and resid 391 and name H ))
3.400 1.400 1.400 peak 2313 spectrum 1 weight 0.10000E+01 volume 0.25375E-02 ppm1 0.532 ppm2 8.193 CV 1
ASSI { 2429}
(( segid " " and resid 403 and name HG3 ))
(( segid " " and resid 403 and name HG2 ))
1.500 0.300 0.700 peak 2429 spectrum 1 weight 0.10000E+01 volume 0.98145E-02 ppm1 1.878 ppm2 1.622 CV 1
ASSI { 4144}
(( segid " " and resid 331 and name HG3 ))
(( segid " " and resid 331 and name HA ))
3.800 1.800 1.800 peak 4144 spectrum 1 weight 0.10000E+01 volume 0.86842E-03 ppm1 1.464 ppm2 4.526 CV 1
ASSI { 2772}
(( segid " " and resid 318 and name HB ))
(( segid " " and resid 315 and name HA ))
4.100 2.100 1.900 peak 2772 spectrum 1 weight 0.10000E+01 volume 0.91069E-03 ppm1 1.355 ppm2 3.791 CV 1
ASSI { 4534}
(( segid " " and resid 199 and name HA ))
(( segid " " and resid 199 and name HB3 ))
2.300 0.700 0.700 peak 4534 spectrum 1 weight 0.10000E+01 volume 0.64257E-02 ppm1 3.799 ppm2 2.078 CV 1
ASSI { 4141}
( segid " " and resid 372 and name HG1%)
(( segid " " and resid 374 and name HG2 ))
2.500 0.800 0.800 peak 4141 spectrum 1 weight 0.10000E+01 volume 0.58278E-02 ppm1 0.644 ppm2 1.353 CV 1
OR { 4141}
( segid " " and resid 372 and name HG1%)
(( segid " " and resid 374 and name HG3 ))
ASSI { 146}
(( segid " " and resid 333 and name HB3 ))
(( segid " " and resid 334 and name HG2 ))
4.000 2.000 2.000 peak 146 spectrum 1 weight 0.10000E+01 volume 0.21879E-02 ppm1 1.503 ppm2 2.170 CV 1
OR { 146}
(( segid " " and resid 333 and name HB3 ))
(( segid " " and resid 334 and name HG3 ))
ASSI { 1304}
(( segid " " and resid 309 and name HG2 ))
( segid " " and resid 283 and name HD2%)
3.700 1.700 1.700 peak 1304 spectrum 1 weight 0.10000E+01 volume 0.35159E-02 ppm1 2.297 ppm2 0.895 CV 1
ASSI { 2366}
(( segid " " and resid 421 and name HA ))
(( segid " " and resid 421 and name HB2 ))
2.400 0.700 0.700 peak 2366 spectrum 1 weight 0.10000E+01 volume 0.66623E-02 ppm1 4.293 ppm2 1.648 CV 1
OR { 2366}
(( segid " " and resid 421 and name HA ))
(( segid " " and resid 421 and name HB3 ))
ASSI { 2549}
(( segid " " and resid 223 and name HB3 ))
( segid " " and resid 223 and name HD% )
3.500 1.500 1.500 peak 2549 spectrum 1 weight 0.10000E+01 volume 0.95018E-03 ppm1 2.932 ppm2 6.428 CV 1
ASSI { 2232}
(( segid " " and resid 199 and name HG3 ))
(( segid " " and resid 199 and name H ))
2.300 0.700 0.700 peak 2232 spectrum 1 weight 0.10000E+01 volume 0.11069E-01 ppm1 2.282 ppm2 7.767 CV 1
OR { 2232}
(( segid " " and resid 199 and name HG2 ))
(( segid " " and resid 199 and name H ))
ASSI { 1655}
(( segid " " and resid 199 and name HG3 ))
(( segid " " and resid 198 and name H ))
4.100 2.100 1.900 peak 1655 spectrum 1 weight 0.10000E+01 volume 0.17453E-02 ppm1 2.282 ppm2 8.602 CV 1
OR { 1655}
(( segid " " and resid 199 and name HG2 ))
(( segid " " and resid 198 and name H ))
ASSI { 3268}
(( segid " " and resid 281 and name HD3 ))
(( segid " " and resid 282 and name H ))
4.300 2.300 1.700 peak 3268 spectrum 1 weight 0.10000E+01 volume 0.12406E-02 ppm1 1.662 ppm2 8.693 CV 1
OR { 3268}
(( segid " " and resid 281 and name HD2 ))
(( segid " " and resid 282 and name H ))
ASSI { 3489}
(( segid " " and resid 373 and name HA ))
(( segid " " and resid 373 and name HB3 ))
3.100 1.200 1.200 peak 3489 spectrum 1 weight 0.10000E+01 volume 0.65978E-03 ppm1 2.338 ppm2 1.344 CV 1
ASSI { 1303}
( segid " " and resid 420 and name HD1%)
(( segid " " and resid 425 and name HE3 ))
2.500 2.500 3.500 peak 1303 spectrum 1 weight 0.10000E+01 volume 0.15000E-02 ppm1 0.770 ppm2 2.884 CV 1
OR { 1303}
( segid " " and resid 420 and name HD1%)
(( segid " " and resid 425 and name HE2 ))
ASSI { 3985}
(( segid " " and resid 308 and name HE2 ))
(( segid " " and resid 308 and name HD3 ))
1.600 0.300 0.600 peak 3985 spectrum 1 weight 0.10000E+01 volume 0.85181E-01 ppm1 2.847 ppm2 1.540 CV 1
OR { 3985}
(( segid " " and resid 308 and name HE3 ))
(( segid " " and resid 308 and name HD2 ))
OR { 3985}
(( segid " " and resid 308 and name HE2 ))
(( segid " " and resid 308 and name HD2 ))
OR { 3985}
(( segid " " and resid 308 and name HE3 ))
(( segid " " and resid 308 and name HD3 ))
OR { 3985}
(( segid " " and resid 308 and name HE3 ))
(( segid " " and resid 308 and name HG2 ))
OR { 3985}
(( segid " " and resid 308 and name HE2 ))
(( segid " " and resid 308 and name HG2 ))
ASSI { 3776}
(( segid " " and resid 445 and name HB3 ))
( segid " " and resid 446 and name HB% )
3.700 1.700 1.700 peak 3776 spectrum 1 weight 0.10000E+01 volume 0.28195E-02 ppm1 1.872 ppm2 1.259 CV 1
ASSI { 1906}
( segid " " and resid 345 and name HG2%)
(( segid " " and resid 346 and name H ))
2.700 0.900 0.900 peak 1906 spectrum 1 weight 0.10000E+01 volume 0.27969E-02 ppm1 0.918 ppm2 8.974 CV 1
ASSI { 1763}
( segid " " and resid 263 and name HG1%)
(( segid " " and resid 263 and name HB ))
2.500 0.800 0.800 peak 1763 spectrum 1 weight 0.10000E+01 volume 0.34201E-02 ppm1 0.072 ppm2 1.542 CV 1
ASSI { 2790}
(( segid " " and resid 239 and name HD2 ))
( segid " " and resid 258 and name HE% )
3.700 1.700 1.700 peak 2790 spectrum 1 weight 0.10000E+01 volume 0.12237E-02 ppm1 1.751 ppm2 6.642 CV 1
ASSI { 3039}
( segid " " and resid 278 and name HD1%)
(( segid " " and resid 279 and name H ))
4.600 2.600 1.400 peak 3039 spectrum 1 weight 0.10000E+01 volume 0.67666E-03 ppm1 0.657 ppm2 9.018 CV 1
ASSI { 7}
(( segid " " and resid 437 and name HA ))
(( segid " " and resid 439 and name H ))
4.900 3.000 1.100 peak 7 spectrum 1 weight 0.10000E+01 volume 0.26221E-03 ppm1 3.796 ppm2 8.756 CV 1
ASSI { 2978}
(( segid " " and resid 299 and name HG3 ))
(( segid " " and resid 299 and name H ))
3.000 1.100 1.100 peak 2978 spectrum 1 weight 0.10000E+01 volume 0.42857E-03 ppm1 1.353 ppm2 7.478 CV 1
OR { 2978}
(( segid " " and resid 299 and name HG2 ))
(( segid " " and resid 299 and name H ))
ASSI { 4711}
(( segid " " and resid 247 and name HA ))
( segid " " and resid 247 and name HD% )
3.300 1.400 1.400 peak 4711 spectrum 1 weight 0.10000E+01 volume 0.12998E-02 ppm1 4.119 ppm2 7.319 CV 1
ASSI { 660}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 316 and name H ))
4.000 2.000 2.000 peak 660 spectrum 1 weight 0.10000E+01 volume 0.81483E-03 ppm1 0.348 ppm2 8.705 CV 1
ASSI { 1004}
( segid " " and resid 394 and name HG2%)
(( segid " " and resid 394 and name HB ))
2.700 0.900 0.900 peak 1004 spectrum 1 weight 0.10000E+01 volume 0.43111E-02 ppm1 1.230 ppm2 4.561 CV 1
OR { 1004}
( segid " " and resid 394 and name HG2%)
(( segid " " and resid 394 and name HA ))
ASSI { 2008}
(( segid " " and resid 293 and name HD3 ))
(( segid " " and resid 293 and name HG2 ))
2.200 0.600 0.600 peak 2008 spectrum 1 weight 0.10000E+01 volume 0.32706E-02 ppm1 3.164 ppm2 1.541 CV 1
ASSI { 4739}
(( segid " " and resid 183 and name HG3 ))
(( segid " " and resid 183 and name HB2 ))
2.000 0.500 0.500 peak 4739 spectrum 1 weight 0.10000E+01 volume 0.22672E-01 ppm1 2.446 ppm2 1.990 CV 1
ASSI { 2300}
(( segid " " and resid 368 and name HB2 ))
(( segid " " and resid 368 and name HB3 ))
2.600 0.800 0.800 peak 2300 spectrum 1 weight 0.10000E+01 volume 0.29605E-03 ppm1 3.286 ppm2 2.663 CV 1
ASSI { 358}
( segid " " and resid 201 and name HG2%)
( segid " " and resid 212 and name HG1%)
4.700 2.800 1.300 peak 358 spectrum 1 weight 0.10000E+01 volume 0.36088E-03 ppm1 1.294 ppm2 -0.347 CV 1
ASSI { 3396}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 213 and name H ))
4.700 2.800 1.300 peak 3396 spectrum 1 weight 0.10000E+01 volume 0.37780E-03 ppm1 -0.159 ppm2 5.882 CV 1
ASSI { 2164}
( segid " " and resid 329 and name HD1%)
(( segid " " and resid 329 and name HG12))
2.400 0.700 0.700 peak 2164 spectrum 1 weight 0.10000E+01 volume 0.21654E-02 ppm1 0.118 ppm2 1.357 CV 1
ASSI { 4547}
(( segid " " and resid 182 and name HD2 ))
(( segid " " and resid 182 and name HB2 ))
3.100 1.200 1.200 peak 4547 spectrum 1 weight 0.10000E+01 volume 0.27772E-02 ppm1 6.918 ppm2 2.952 CV 1
OR { 4547}
(( segid " " and resid 182 and name HD2 ))
(( segid " " and resid 182 and name HB3 ))
ASSI { 2902}
(( segid " " and resid 328 and name HA ))
( segid " " and resid 335 and name HG2%)
4.700 2.800 1.300 peak 2902 spectrum 1 weight 0.10000E+01 volume 0.83739E-03 ppm1 3.445 ppm2 1.243 CV 1
ASSI { 3496}
(( segid " " and resid 321 and name HB2 ))
( segid " " and resid 318 and name HD1%)
5.000 3.100 1.000 peak 3496 spectrum 1 weight 0.10000E+01 volume 0.38908E-03 ppm1 1.942 ppm2 0.379 CV 1
ASSI { 1156}
( segid " " and resid 310 and name HD2%)
(( segid " " and resid 311 and name HD2 ))
3.600 1.600 1.600 peak 1156 spectrum 1 weight 0.10000E+01 volume 0.20018E-02 ppm1 1.087 ppm2 4.032 CV 1
ASSI { 2823}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 300 and name HA ))
2.500 0.800 0.800 peak 2823 spectrum 1 weight 0.10000E+01 volume 0.55066E-02 ppm1 0.077 ppm2 2.906 CV 1
ASSI { 481}
(( segid " " and resid 443 and name HB2 ))
( segid " " and resid 398 and name HD1%)
4.200 2.200 1.800 peak 481 spectrum 1 weight 0.10000E+01 volume 0.77252E-03 ppm1 1.672 ppm2 0.570 CV 1
ASSI { 2588}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 338 and name HB2 ))
4.700 2.800 1.300 peak 2588 spectrum 1 weight 0.10000E+01 volume 0.14436E-02 ppm1 0.747 ppm2 2.818 CV 1
ASSI { 1587}
(( segid " " and resid 442 and name HE3 ))
(( segid " " and resid 442 and name H ))
4.000 2.000 2.000 peak 1587 spectrum 1 weight 0.10000E+01 volume 0.20328E-02 ppm1 2.886 ppm2 7.542 CV 1
OR { 1587}
(( segid " " and resid 442 and name HE2 ))
(( segid " " and resid 442 and name H ))
ASSI { 3405}
(( segid " " and resid 387 and name HB ))
(( segid " " and resid 387 and name HA ))
2.600 0.800 0.800 peak 3405 spectrum 1 weight 0.10000E+01 volume 0.63665E-02 ppm1 4.023 ppm2 4.291 CV 1
ASSI { 4352}
(( segid " " and resid 302 and name HA ))
(( segid " " and resid 302 and name HG2 ))
4.400 2.400 1.600 peak 4352 spectrum 1 weight 0.10000E+01 volume 0.61747E-03 ppm1 4.311 ppm2 2.255 CV 1
ASSI { 1588}
(( segid " " and resid 440 and name HE3 ))
( segid " " and resid 402 and name HG2%)
2.200 0.600 0.600 peak 1588 spectrum 1 weight 0.10000E+01 volume 0.45029E-02 ppm1 2.737 ppm2 0.776 CV 1
ASSI { 3522}
( segid " " and resid 412 and name HD1%)
(( segid " " and resid 412 and name HA ))
2.700 0.900 0.900 peak 3522 spectrum 1 weight 0.10000E+01 volume 0.70177E-02 ppm1 0.845 ppm2 3.979 CV 1
ASSI { 2594}
(( segid " " and resid 206 and name HA3 ))
(( segid " " and resid 206 and name H ))
3.800 1.900 1.900 peak 2594 spectrum 1 weight 0.10000E+01 volume 0.69077E-03 ppm1 3.831 ppm2 7.660 CV 1
ASSI { 2859}
( segid " " and resid 316 and name HD1%)
( segid " " and resid 209 and name HD2%)
3.300 1.300 1.300 peak 2859 spectrum 1 weight 0.10000E+01 volume 0.35862E-02 ppm1 0.825 ppm2 -0.909 CV 1
ASSI { 3614}
(( segid " " and resid 382 and name HZ3 ))
(( segid " " and resid 435 and name HA ))
4.500 2.500 1.500 peak 3614 spectrum 1 weight 0.10000E+01 volume 0.29323E-03 ppm1 6.867 ppm2 3.844 CV 1
ASSI { 3298}
( segid " " and resid 240 and name HG2%)
(( segid " " and resid 240 and name H ))
2.600 0.800 0.800 peak 3298 spectrum 1 weight 0.10000E+01 volume 0.27434E-02 ppm1 0.773 ppm2 8.010 CV 1
ASSI { 88}
( segid " " and resid 429 and name HD2%)
(( segid " " and resid 430 and name HA ))
3.800 1.800 1.800 peak 88 spectrum 1 weight 0.10000E+01 volume 0.18580E-02 ppm1 0.643 ppm2 4.369 CV 1
ASSI { 4437}
(( segid " " and resid 365 and name HG2 ))
(( segid " " and resid 365 and name H ))
1.900 0.400 0.400 peak 4437 spectrum 1 weight 0.10000E+01 volume 0.15871E-01 ppm1 2.344 ppm2 8.347 CV 1
OR { 4437}
(( segid " " and resid 365 and name HG3 ))
(( segid " " and resid 365 and name H ))
ASSI { 3719}
( segid " " and resid 356 and name HG2%)
( segid " " and resid 287 and name HD% )
4.200 2.200 1.800 peak 3719 spectrum 1 weight 0.10000E+01 volume 0.72179E-03 ppm1 0.380 ppm2 6.340 CV 1
ASSI { 2585}
(( segid " " and resid 305 and name HD2 ))
( segid " " and resid 306 and name HD2%)
3.100 1.200 1.200 peak 2585 spectrum 1 weight 0.10000E+01 volume 0.15169E-02 ppm1 3.146 ppm2 -0.355 CV 1
ASSI { 4357}
(( segid " " and resid 244 and name HD3 ))
(( segid " " and resid 244 and name HG2 ))
3.500 1.500 1.500 peak 4357 spectrum 1 weight 0.10000E+01 volume 0.74435E-03 ppm1 1.220 ppm2 0.418 CV 1
ASSI { 2562}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 198 and name HB ))
2.500 0.800 0.800 peak 2562 spectrum 1 weight 0.10000E+01 volume 0.38401E-02 ppm1 0.624 ppm2 2.048 CV 1
ASSI { 4345}
( segid " " and resid 373 and name HD2%)
(( segid " " and resid 373 and name HB3 ))
3.400 1.400 1.400 peak 4345 spectrum 1 weight 0.10000E+01 volume 0.28533E-02 ppm1 0.513 ppm2 1.341 CV 1
ASSI { 1903}
(( segid " " and resid 377 and name HG2 ))
(( segid " " and resid 377 and name H ))
3.000 1.100 1.100 peak 1903 spectrum 1 weight 0.10000E+01 volume 0.12321E-02 ppm1 2.520 ppm2 8.235 CV 1
ASSI { 1482}
( segid " " and resid 253 and name HG2%)
(( segid " " and resid 247 and name H ))
3.500 1.500 1.500 peak 1482 spectrum 1 weight 0.10000E+01 volume 0.11532E-02 ppm1 0.615 ppm2 8.418 CV 1
ASSI { 762}
( segid " " and resid 283 and name HD1%)
( segid " " and resid 287 and name HD% )
5.100 3.200 0.900 peak 762 spectrum 1 weight 0.10000E+01 volume 0.65131E-03 ppm1 0.721 ppm2 6.344 CV 1
ASSI { 3425}
( segid " " and resid 344 and name HD1%)
(( segid " " and resid 344 and name HG12))
1.900 0.500 0.500 peak 3425 spectrum 1 weight 0.10000E+01 volume 0.18439E-01 ppm1 0.819 ppm2 1.668 CV 1
ASSI { 3574}
(( segid " " and resid 278 and name HB3 ))
(( segid " " and resid 278 and name HB2 ))
1.900 0.400 0.400 peak 3574 spectrum 1 weight 0.10000E+01 volume 0.16381E-02 ppm1 1.515 ppm2 1.201 CV 1
ASSI { 981}
( segid " " and resid 364 and name HG2%)
( segid " " and resid 368 and name HE% )
2.500 0.800 0.800 peak 981 spectrum 1 weight 0.10000E+01 volume 0.22894E-02 ppm1 0.916 ppm2 6.766 CV 1
ASSI { 4346}
( segid " " and resid 279 and name HD1%)
( segid " " and resid 279 and name HD2%)
1.900 0.400 0.400 peak 4346 spectrum 1 weight 0.10000E+01 volume 0.19976E-01 ppm1 0.168 ppm2 0.371 CV 1
ASSI { 848}
(( segid " " and resid 412 and name HB3 ))
( segid " " and resid 412 and name HD2%)
3.400 1.500 1.500 peak 848 spectrum 1 weight 0.10000E+01 volume 0.93607E-03 ppm1 1.865 ppm2 0.665 CV 1
ASSI { 4450}
(( segid " " and resid 366 and name HB2 ))
(( segid " " and resid 366 and name H ))
3.100 1.200 1.200 peak 4450 spectrum 1 weight 0.10000E+01 volume 0.13477E-02 ppm1 1.865 ppm2 8.330 CV 1
OR { 4450}
(( segid " " and resid 366 and name HB3 ))
(( segid " " and resid 366 and name H ))
ASSI { 653}
( segid " " and resid 310 and name HD2%)
(( segid " " and resid 314 and name HB2 ))
3.800 1.800 1.800 peak 653 spectrum 1 weight 0.10000E+01 volume 0.16804E-02 ppm1 1.087 ppm2 2.828 CV 1
OR { 653}
( segid " " and resid 310 and name HD2%)
(( segid " " and resid 314 and name HB3 ))
ASSI { 2999}
(( segid " " and resid 351 and name HB2 ))
(( segid " " and resid 351 and name H ))
4.400 2.400 1.600 peak 2999 spectrum 1 weight 0.10000E+01 volume 0.36652E-03 ppm1 2.027 ppm2 7.873 CV 1
ASSI { 3756}
(( segid " " and resid 413 and name HB3 ))
(( segid " " and resid 413 and name H ))
3.400 1.400 1.400 peak 3756 spectrum 1 weight 0.10000E+01 volume 0.12519E-02 ppm1 2.997 ppm2 8.490 CV 1
ASSI { 147}
(( segid " " and resid 375 and name HB3 ))
( segid " " and resid 376 and name HG2%)
4.300 2.300 1.700 peak 147 spectrum 1 weight 0.10000E+01 volume 0.34369E-02 ppm1 1.846 ppm2 0.910 CV 1
OR { 147}
(( segid " " and resid 375 and name HB3 ))
( segid " " and resid 376 and name HG1%)
ASSI { 4520}
( segid " " and resid 315 and name HE% )
( segid " " and resid 315 and name HD% )
2.100 0.500 0.500 peak 4520 spectrum 1 weight 0.10000E+01 volume 0.16288E-01 ppm1 6.875 ppm2 7.034 CV 1
ASSI { 3360}
(( segid " " and resid 355 and name HD2 ))
(( segid " " and resid 356 and name H ))
2.800 2.800 3.200 peak 3360 spectrum 1 weight 0.10000E+01 volume 0.73589E-03 ppm1 3.092 ppm2 7.358 CV 1
ASSI { 2096}
(( segid " " and resid 358 and name HB2 ))
( segid " " and resid 339 and name HG2%)
4.400 2.400 1.600 peak 2096 spectrum 1 weight 0.10000E+01 volume 0.41447E-03 ppm1 3.271 ppm2 0.707 CV 1
ASSI { 3885}
(( segid " " and resid 421 and name HD2 ))
(( segid " " and resid 421 and name HA ))
2.000 0.500 0.500 peak 3885 spectrum 1 weight 0.10000E+01 volume 0.55912E-02 ppm1 1.594 ppm2 4.292 CV 1
ASSI { 285}
(( segid " " and resid 393 and name HG2 ))
(( segid " " and resid 442 and name HE2 ))
3.200 1.300 1.300 peak 285 spectrum 1 weight 0.10000E+01 volume 0.15310E-02 ppm1 2.161 ppm2 2.877 CV 1
OR { 285}
(( segid " " and resid 393 and name HG2 ))
(( segid " " and resid 442 and name HE3 ))
ASSI { 3634}
( segid " " and resid 409 and name HD2%)
(( segid " " and resid 410 and name H ))
3.900 1.900 1.900 peak 3634 spectrum 1 weight 0.10000E+01 volume 0.15874E-02 ppm1 0.742 ppm2 7.885 CV 1
ASSI { 1977}
(( segid " " and resid 228 and name HG3 ))
(( segid " " and resid 229 and name H ))
4.600 2.700 1.400 peak 1977 spectrum 1 weight 0.10000E+01 volume 0.60619E-03 ppm1 1.966 ppm2 9.603 CV 1
ASSI { 1701}
( segid " " and resid 346 and name HD2%)
(( segid " " and resid 361 and name HZ ))
2.900 1.000 1.000 peak 1701 spectrum 1 weight 0.10000E+01 volume 0.22274E-02 ppm1 0.751 ppm2 6.632 CV 1
ASSI { 987}
( segid " " and resid 339 and name HG2%)
( segid " " and resid 361 and name HD% )
2.400 0.700 0.700 peak 987 spectrum 1 weight 0.10000E+01 volume 0.45141E-02 ppm1 0.706 ppm2 7.110 CV 1
OR { 987}
( segid " " and resid 339 and name HG2%)
( segid " " and resid 361 and name HE% )
ASSI { 1918}
( segid " " and resid 380 and name HD1%)
(( segid " " and resid 381 and name H ))
3.400 1.400 1.400 peak 1918 spectrum 1 weight 0.10000E+01 volume 0.29097E-02 ppm1 0.760 ppm2 8.189 CV 1
ASSI { 3294}
(( segid " " and resid 348 and name HD2 ))
(( segid " " and resid 348 and name HA ))
3.900 1.900 1.900 peak 3294 spectrum 1 weight 0.10000E+01 volume 0.15282E-02 ppm1 3.568 ppm2 4.553 CV 1
ASSI { 3223}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 323 and name HA ))
2.300 0.700 0.700 peak 3223 spectrum 1 weight 0.10000E+01 volume 0.43421E-02 ppm1 0.436 ppm2 3.280 CV 1
ASSI { 3657}
(( segid " " and resid 184 and name HB3 ))
(( segid " " and resid 184 and name HB2 ))
1.200 0.200 1.000 peak 3657 spectrum 1 weight 0.10000E+01 volume 0.82608E-01 ppm1 1.812 ppm2 2.209 CV 1
ASSI { 3469}
( segid " " and resid 344 and name HG2%)
(( segid " " and resid 344 and name HG12))
2.200 0.600 0.600 peak 3469 spectrum 1 weight 0.10000E+01 volume 0.10686E-01 ppm1 0.895 ppm2 1.662 CV 1
ASSI { 4604}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 360 and name HZ ))
2.600 0.800 0.800 peak 4604 spectrum 1 weight 0.10000E+01 volume 0.28054E-02 ppm1 0.168 ppm2 6.605 CV 1
ASSI { 4810}
(( segid " " and resid 228 and name HG3 ))
(( segid " " and resid 336 and name HG2 ))
3.100 1.200 1.200 peak 4810 spectrum 1 weight 0.10000E+01 volume 0.12180E-02 ppm1 1.962 ppm2 1.167 CV 1
ASSI { 2376}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 324 and name H ))
3.800 1.800 1.800 peak 2376 spectrum 1 weight 0.10000E+01 volume 0.16127E-02 ppm1 0.435 ppm2 8.485 CV 1
ASSI { 1875}
( segid " " and resid 368 and name HD% )
(( segid " " and resid 368 and name HB3 ))
3.900 1.900 1.900 peak 1875 spectrum 1 weight 0.10000E+01 volume 0.27067E-03 ppm1 7.158 ppm2 2.700 CV 1
ASSI { 3537}
( segid " " and resid 283 and name HD1%)
( segid " " and resid 306 and name HD2%)
4.400 2.400 1.600 peak 3537 spectrum 1 weight 0.10000E+01 volume 0.24755E-02 ppm1 0.716 ppm2 -0.357 CV 1
ASSI { 3069}
(( segid " " and resid 372 and name HB ))
(( segid " " and resid 372 and name HA ))
2.600 0.900 0.900 peak 3069 spectrum 1 weight 0.10000E+01 volume 0.29717E-02 ppm1 1.705 ppm2 3.782 CV 1
ASSI { 1786}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 319 and name H ))
4.400 2.400 1.600 peak 1786 spectrum 1 weight 0.10000E+01 volume 0.12716E-02 ppm1 0.380 ppm2 7.846 CV 1
ASSI { 3178}
(( segid " " and resid 302 and name HG2 ))
( segid " " and resid 303 and name HD% )
4.800 2.900 1.200 peak 3178 spectrum 1 weight 0.10000E+01 volume 0.80637E-03 ppm1 2.244 ppm2 7.075 CV 1
ASSI { 4130}
( segid " " and resid 325 and name HE% )
( segid " " and resid 231 and name HE% )
2.200 2.200 3.800 peak 4130 spectrum 1 weight 0.10000E+01 volume 0.47761E-02 ppm1 0.929 ppm2 6.769 CV 1
OR { 4130}
( segid " " and resid 325 and name HE% )
( segid " " and resid 231 and name HD% )
ASSI { 324}
(( segid " " and resid 281 and name HE3 ))
(( segid " " and resid 281 and name HA ))
3.700 1.700 1.700 peak 324 spectrum 1 weight 0.10000E+01 volume 0.25939E-02 ppm1 2.969 ppm2 3.980 CV 1
OR { 324}
(( segid " " and resid 281 and name HE2 ))
(( segid " " and resid 281 and name HA ))
ASSI { 2607}
(( segid " " and resid 281 and name HG2 ))
(( segid " " and resid 281 and name HD3 ))
1.600 0.300 0.600 peak 2607 spectrum 1 weight 0.10000E+01 volume 0.53726E-01 ppm1 1.406 ppm2 1.661 CV 1
OR { 2607}
(( segid " " and resid 281 and name HG3 ))
(( segid " " and resid 281 and name HD2 ))
OR { 2607}
(( segid " " and resid 281 and name HG2 ))
(( segid " " and resid 281 and name HD2 ))
OR { 2607}
(( segid " " and resid 281 and name HG3 ))
(( segid " " and resid 281 and name HD3 ))
ASSI { 361}
(( segid " " and resid 244 and name HD3 ))
(( segid " " and resid 244 and name H ))
4.900 3.100 1.100 peak 361 spectrum 1 weight 0.10000E+01 volume 0.33552E-03 ppm1 1.225 ppm2 8.549 CV 1
ASSI { 3835}
( segid " " and resid 243 and name HD1%)
(( segid " " and resid 240 and name HA ))
3.000 1.100 1.100 peak 3835 spectrum 1 weight 0.10000E+01 volume 0.17030E-02 ppm1 0.013 ppm2 3.224 CV 1
ASSI { 3512}
(( segid " " and resid 222 and name HB2 ))
(( segid " " and resid 219 and name HA ))
3.300 1.300 1.300 peak 3512 spectrum 1 weight 0.10000E+01 volume 0.47366E-03 ppm1 1.213 ppm2 4.120 CV 1
ASSI { 3612}
(( segid " " and resid 207 and name HB ))
(( segid " " and resid 207 and name HA ))
3.800 1.800 1.800 peak 3612 spectrum 1 weight 0.10000E+01 volume 0.31860E-03 ppm1 1.614 ppm2 3.790 CV 1
ASSI { 4379}
(( segid " " and resid 327 and name HB3 ))
( segid " " and resid 225 and name HE% )
3.100 1.200 1.200 peak 4379 spectrum 1 weight 0.10000E+01 volume 0.16043E-02 ppm1 3.127 ppm2 1.896 CV 1
ASSI { 2967}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 319 and name HB3 ))
3.900 1.900 1.900 peak 2967 spectrum 1 weight 0.10000E+01 volume 0.23825E-02 ppm1 0.349 ppm2 3.100 CV 1
ASSI { 4078}
(( segid " " and resid 226 and name HB2 ))
(( segid " " and resid 226 and name HB3 ))
1.700 0.400 0.500 peak 4078 spectrum 1 weight 0.10000E+01 volume 0.76801E-02 ppm1 1.506 ppm2 1.957 CV 1
ASSI { 3400}
(( segid " " and resid 222 and name HE2 ))
(( segid " " and resid 219 and name HA ))
4.500 2.500 1.500 peak 3400 spectrum 1 weight 0.10000E+01 volume 0.12293E-02 ppm1 2.683 ppm2 4.095 CV 1
OR { 3400}
(( segid " " and resid 222 and name HE3 ))
(( segid " " and resid 219 and name HA ))
ASSI { 1172}
(( segid " " and resid 376 and name HA ))
( segid " " and resid 376 and name HG1%)
2.800 1.000 1.000 peak 1172 spectrum 1 weight 0.10000E+01 volume 0.48804E-02 ppm1 3.875 ppm2 0.898 CV 1
OR { 1172}
(( segid " " and resid 376 and name HA ))
( segid " " and resid 376 and name HG2%)
ASSI { 2813}
( segid " " and resid 344 and name HD1%)
(( segid " " and resid 340 and name HG3 ))
2.300 0.700 0.700 peak 2813 spectrum 1 weight 0.10000E+01 volume 0.12437E-01 ppm1 0.818 ppm2 2.314 CV 1
OR { 2813}
( segid " " and resid 344 and name HD1%)
(( segid " " and resid 340 and name HG2 ))
ASSI { 4381}
( segid " " and resid 409 and name HD2%)
(( segid " " and resid 433 and name HE21))
3.400 1.500 1.500 peak 4381 spectrum 1 weight 0.10000E+01 volume 0.19342E-02 ppm1 0.739 ppm2 6.963 CV 1
ASSI { 1329}
( segid " " and resid 377 and name HE% )
( segid " " and resid 407 and name HD% )
4.900 3.000 1.100 peak 1329 spectrum 1 weight 0.10000E+01 volume 0.52443E-03 ppm1 1.993 ppm2 7.284 CV 1
ASSI { 1872}
(( segid " " and resid 187 and name HB2 ))
(( segid " " and resid 187 and name H ))
3.200 1.300 1.300 peak 1872 spectrum 1 weight 0.10000E+01 volume 0.21767E-02 ppm1 1.721 ppm2 8.517 CV 1
ASSI { 3515}
(( segid " " and resid 287 and name HA ))
( segid " " and resid 287 and name HE% )
5.300 3.500 0.700 peak 3515 spectrum 1 weight 0.10000E+01 volume 0.33834E-03 ppm1 3.484 ppm2 6.990 CV 1
ASSI { 3470}
(( segid " " and resid 349 and name HA ))
(( segid " " and resid 350 and name H ))
3.900 1.900 1.900 peak 3470 spectrum 1 weight 0.10000E+01 volume 0.45113E-03 ppm1 3.934 ppm2 7.616 CV 1
ASSI { 4570}
( segid " " and resid 407 and name HD% )
(( segid " " and resid 407 and name HB2 ))
3.600 1.600 1.600 peak 4570 spectrum 1 weight 0.10000E+01 volume 0.50469E-03 ppm1 7.310 ppm2 3.291 CV 1
OR { 4570}
( segid " " and resid 407 and name HD% )
(( segid " " and resid 407 and name HB3 ))
ASSI { 2176}
( segid " " and resid 432 and name HG1%)
(( segid " " and resid 433 and name H ))
2.700 0.900 0.900 peak 2176 spectrum 1 weight 0.10000E+01 volume 0.36483E-02 ppm1 1.088 ppm2 8.338 CV 1
OR { 2176}
( segid " " and resid 432 and name HG2%)
(( segid " " and resid 433 and name H ))
ASSI { 4487}
(( segid " " and resid 433 and name HG3 ))
(( segid " " and resid 433 and name H ))
2.800 1.000 1.000 peak 4487 spectrum 1 weight 0.10000E+01 volume 0.15846E-02 ppm1 2.480 ppm2 8.318 CV 1
ASSI { 2843}
(( segid " " and resid 291 and name HB2 ))
(( segid " " and resid 291 and name HB3 ))
2.200 0.600 0.600 peak 2843 spectrum 1 weight 0.10000E+01 volume 0.18214E-02 ppm1 2.753 ppm2 3.100 CV 1
ASSI { 2646}
(( segid " " and resid 284 and name HG3 ))
( segid " " and resid 352 and name HD1%)
3.400 1.500 1.500 peak 2646 spectrum 1 weight 0.10000E+01 volume 0.14605E-02 ppm1 2.585 ppm2 0.626 CV 1
OR { 2646}
(( segid " " and resid 284 and name HG2 ))
( segid " " and resid 352 and name HD1%)
ASSI { 1766}
(( segid " " and resid 344 and name HB ))
(( segid " " and resid 341 and name HA ))
3.100 1.200 1.200 peak 1766 spectrum 1 weight 0.10000E+01 volume 0.10037E-02 ppm1 1.896 ppm2 4.408 CV 1
ASSI { 3770}
(( segid " " and resid 306 and name HB2 ))
(( segid " " and resid 306 and name H ))
3.000 1.200 1.200 peak 3770 spectrum 1 weight 0.10000E+01 volume 0.46520E-03 ppm1 0.964 ppm2 8.013 CV 1
ASSI { 3174}
(( segid " " and resid 421 and name HG2 ))
(( segid " " and resid 421 and name HA ))
3.400 1.400 1.400 peak 3174 spectrum 1 weight 0.10000E+01 volume 0.29210E-02 ppm1 1.284 ppm2 4.314 CV 1
ASSI { 3209}
(( segid " " and resid 186 and name HG ))
(( segid " " and resid 186 and name H ))
4.100 2.100 1.900 peak 3209 spectrum 1 weight 0.10000E+01 volume 0.23627E-02 ppm1 1.503 ppm2 8.044 CV 1
ASSI { 4148}
( segid " " and resid 373 and name HD2%)
(( segid " " and resid 320 and name HA ))
3.500 1.500 1.500 peak 4148 spectrum 1 weight 0.10000E+01 volume 0.17819E-02 ppm1 0.514 ppm2 3.842 CV 1
ASSI { 693}
( segid " " and resid 192 and name HG2%)
(( segid " " and resid 188 and name HD2 ))
3.000 1.100 1.100 peak 693 spectrum 1 weight 0.10000E+01 volume 0.91351E-03 ppm1 0.686 ppm2 3.492 CV 1
ASSI { 3335}
(( segid " " and resid 327 and name HD2 ))
( segid " " and resid 225 and name HE% )
3.200 3.200 2.800 peak 3335 spectrum 1 weight 0.10000E+01 volume 0.30732E-03 ppm1 7.209 ppm2 1.923 CV 1
ASSI { 1049}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 322 and name H ))
4.000 2.000 2.000 peak 1049 spectrum 1 weight 0.10000E+01 volume 0.11729E-02 ppm1 0.379 ppm2 8.217 CV 1
ASSI { 2036}
(( segid " " and resid 340 and name HG3 ))
(( segid " " and resid 340 and name H ))
3.500 1.500 1.500 peak 2036 spectrum 1 weight 0.10000E+01 volume 0.71982E-02 ppm1 2.317 ppm2 8.149 CV 1
OR { 2036}
(( segid " " and resid 340 and name HG2 ))
(( segid " " and resid 340 and name H ))
ASSI { 1748}
(( segid " " and resid 244 and name HA ))
(( segid " " and resid 244 and name HG2 ))
3.600 1.700 1.700 peak 1748 spectrum 1 weight 0.10000E+01 volume 0.47930E-03 ppm1 3.287 ppm2 0.410 CV 1
ASSI { 3187}
(( segid " " and resid 378 and name HG3 ))
(( segid " " and resid 378 and name HA ))
3.700 1.700 1.700 peak 3187 spectrum 1 weight 0.10000E+01 volume 0.99809E-03 ppm1 1.394 ppm2 4.437 CV 1
ASSI { 1953}
(( segid " " and resid 305 and name HA ))
(( segid " " and resid 308 and name HE2 ))
5.300 3.600 0.700 peak 1953 spectrum 1 weight 0.10000E+01 volume 0.86842E-03 ppm1 3.818 ppm2 2.855 CV 1
OR { 1953}
(( segid " " and resid 305 and name HA ))
(( segid " " and resid 308 and name HE3 ))
ASSI { 2722}
( segid " " and resid 203 and name HE% )
( segid " " and resid 212 and name HG1%)
6.000 4.500 0.000 peak 2722 spectrum 1 weight 0.10000E+01 volume 0.35244E-03 ppm1 2.219 ppm2 -0.344 CV 1
ASSI { 3981}
(( segid " " and resid 374 and name HB3 ))
(( segid " " and resid 374 and name HG2 ))
2.500 0.800 0.800 peak 3981 spectrum 1 weight 0.10000E+01 volume 0.43167E-02 ppm1 1.784 ppm2 1.358 CV 1
OR { 3981}
(( segid " " and resid 374 and name HB3 ))
(( segid " " and resid 374 and name HG3 ))
ASSI { 635}
(( segid " " and resid 395 and name HB2 ))
( segid " " and resid 398 and name HD1%)
4.700 2.700 1.300 peak 635 spectrum 1 weight 0.10000E+01 volume 0.94172E-03 ppm1 2.061 ppm2 0.539 CV 1
OR { 635}
(( segid " " and resid 395 and name HB3 ))
( segid " " and resid 398 and name HD1%)
OR { 635}
(( segid " " and resid 395 and name HB2 ))
(( segid " " and resid 398 and name HG12))
OR { 635}
(( segid " " and resid 395 and name HB3 ))
(( segid " " and resid 398 and name HG12))
ASSI { 1148}
(( segid " " and resid 254 and name HB2 ))
(( segid " " and resid 256 and name H ))
4.900 3.000 1.100 peak 1148 spectrum 1 weight 0.10000E+01 volume 0.31014E-03 ppm1 2.598 ppm2 8.239 CV 1
ASSI { 4417}
(( segid " " and resid 225 and name HG3 ))
(( segid " " and resid 221 and name HA ))
3.600 1.600 1.600 peak 4417 spectrum 1 weight 0.10000E+01 volume 0.35527E-03 ppm1 2.664 ppm2 3.902 CV 1
ASSI { 4022}
( segid " " and resid 342 and name HG2%)
( segid " " and resid 329 and name HD1%)
2.500 0.800 0.800 peak 4022 spectrum 1 weight 0.10000E+01 volume 0.44267E-02 ppm1 0.514 ppm2 0.117 CV 1
ASSI { 4414}
(( segid " " and resid 207 and name HB ))
( segid " " and resid 207 and name HG2%)
3.400 1.400 1.400 peak 4414 spectrum 1 weight 0.10000E+01 volume 0.70769E-03 ppm1 1.615 ppm2 0.465 CV 1
ASSI { 2956}
(( segid " " and resid 217 and name HG12))
(( segid " " and resid 217 and name HA ))
4.300 2.400 1.700 peak 2956 spectrum 1 weight 0.10000E+01 volume 0.62029E-03 ppm1 0.515 ppm2 2.981 CV 1
ASSI { 816}
(( segid " " and resid 430 and name HD1 ))
(( segid " " and resid 427 and name HA ))
4.500 2.600 1.500 peak 816 spectrum 1 weight 0.10000E+01 volume 0.45677E-03 ppm1 7.185 ppm2 3.935 CV 1
ASSI { 2773}
(( segid " " and resid 356 and name HA ))
( segid " " and resid 356 and name HG2%)
2.900 1.100 1.100 peak 2773 spectrum 1 weight 0.10000E+01 volume 0.15084E-02 ppm1 3.616 ppm2 0.378 CV 1
ASSI { 4025}
(( segid " " and resid 368 and name HA ))
(( segid " " and resid 368 and name HB2 ))
3.900 1.900 1.900 peak 4025 spectrum 1 weight 0.10000E+01 volume 0.51315E-03 ppm1 5.180 ppm2 3.265 CV 1
ASSI { 2034}
( segid " " and resid 284 and name HE% )
( segid " " and resid 279 and name HD1%)
3.700 1.700 1.700 peak 2034 spectrum 1 weight 0.10000E+01 volume 0.44352E-02 ppm1 2.151 ppm2 0.168 CV 1
ASSI { 2663}
( segid " " and resid 391 and name HD1%)
(( segid " " and resid 391 and name H ))
3.200 1.300 1.300 peak 2663 spectrum 1 weight 0.10000E+01 volume 0.31043E-02 ppm1 0.709 ppm2 8.191 CV 1
ASSI { 3778}
(( segid " " and resid 362 and name HA ))
(( segid " " and resid 362 and name HB ))
3.100 1.200 1.200 peak 3778 spectrum 1 weight 0.10000E+01 volume 0.14013E-02 ppm1 4.058 ppm2 3.777 CV 1
ASSI { 3475}
(( segid " " and resid 351 and name HB2 ))
(( segid " " and resid 351 and name HA ))
3.900 1.900 1.900 peak 3475 spectrum 1 weight 0.10000E+01 volume 0.67384E-03 ppm1 2.027 ppm2 3.856 CV 1
ASSI { 1838}
(( segid " " and resid 183 and name HB2 ))
(( segid " " and resid 184 and name HD2 ))
3.400 1.400 1.400 peak 1838 spectrum 1 weight 0.10000E+01 volume 0.53881E-02 ppm1 1.999 ppm2 3.627 CV 1
OR { 1838}
(( segid " " and resid 183 and name HB2 ))
(( segid " " and resid 184 and name HD3 ))
ASSI { 3341}
(( segid " " and resid 185 and name HA ))
(( segid " " and resid 185 and name HB3 ))
3.200 1.300 1.300 peak 3341 spectrum 1 weight 0.10000E+01 volume 0.13167E-02 ppm1 4.568 ppm2 2.692 CV 1
OR { 3341}
(( segid " " and resid 185 and name HA ))
(( segid " " and resid 185 and name HB2 ))
ASSI { 3715}
(( segid " " and resid 430 and name HE3 ))
(( segid " " and resid 430 and name HB2 ))
3.800 1.800 1.800 peak 3715 spectrum 1 weight 0.10000E+01 volume 0.52443E-03 ppm1 7.533 ppm2 3.297 CV 1
OR { 3715}
(( segid " " and resid 430 and name HE3 ))
(( segid " " and resid 430 and name HB3 ))
ASSI { 526}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 210 and name HD2 ))
4.300 2.300 1.700 peak 526 spectrum 1 weight 0.10000E+01 volume 0.93325E-03 ppm1 0.619 ppm2 3.299 CV 1
ASSI { 4214}
( segid " " and resid 339 and name HG2%)
(( segid " " and resid 340 and name H ))
3.100 1.200 1.200 peak 4214 spectrum 1 weight 0.10000E+01 volume 0.42180E-02 ppm1 0.706 ppm2 8.154 CV 1
ASSI { 3807}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 398 and name HA ))
2.800 1.000 1.000 peak 3807 spectrum 1 weight 0.10000E+01 volume 0.21654E-02 ppm1 0.808 ppm2 3.422 CV 1
ASSI { 3322}
(( segid " " and resid 231 and name HB3 ))
( segid " " and resid 231 and name HD% )
3.700 1.700 1.700 peak 3322 spectrum 1 weight 0.10000E+01 volume 0.37216E-03 ppm1 2.808 ppm2 6.789 CV 1
OR { 3322}
(( segid " " and resid 231 and name HB2 ))
( segid " " and resid 231 and name HD% )
ASSI { 3876}
( segid " " and resid 388 and name HE% )
( segid " " and resid 391 and name HD2%)
2.900 1.000 1.000 peak 3876 spectrum 1 weight 0.10000E+01 volume 0.10877E-01 ppm1 1.847 ppm2 0.531 CV 1
ASSI { 3095}
(( segid " " and resid 365 and name HG2 ))
(( segid " " and resid 365 and name HE22))
2.500 2.500 3.500 peak 3095 spectrum 1 weight 0.10000E+01 volume 0.95074E-02 ppm1 2.345 ppm2 7.582 CV 1
ASSI { 4383}
( segid " " and resid 420 and name HG2%)
(( segid " " and resid 422 and name HB2 ))
3.000 1.200 1.200 peak 4383 spectrum 1 weight 0.10000E+01 volume 0.17114E-02 ppm1 0.805 ppm2 2.420 CV 1
ASSI { 3389}
(( segid " " and resid 249 and name HB3 ))
(( segid " " and resid 249 and name H ))
4.500 2.600 1.500 peak 3389 spectrum 1 weight 0.10000E+01 volume 0.59491E-03 ppm1 1.756 ppm2 7.309 CV 1
ASSI { 2747}
(( segid " " and resid 302 and name HA ))
(( segid " " and resid 302 and name H ))
3.400 1.500 1.500 peak 2747 spectrum 1 weight 0.10000E+01 volume 0.68794E-03 ppm1 4.316 ppm2 7.998 CV 1
ASSI { 2180}
(( segid " " and resid 227 and name HB2 ))
( segid " " and resid 230 and name HG2%)
4.900 3.000 1.100 peak 2180 spectrum 1 weight 0.10000E+01 volume 0.17876E-02 ppm1 3.138 ppm2 0.940 CV 1
ASSI { 3631}
(( segid " " and resid 371 and name HA ))
(( segid " " and resid 371 and name HB ))
3.500 1.600 1.600 peak 3631 spectrum 1 weight 0.10000E+01 volume 0.64285E-03 ppm1 3.725 ppm2 1.935 CV 1
ASSI { 2792}
( segid " " and resid 344 and name HD1%)
(( segid " " and resid 341 and name H ))
2.400 2.400 3.600 peak 2792 spectrum 1 weight 0.10000E+01 volume 0.16917E-02 ppm1 0.818 ppm2 8.531 CV 1
ASSI { 3145}
(( segid " " and resid 210 and name HB2 ))
( segid " " and resid 212 and name HG1%)
3.700 1.700 1.700 peak 3145 spectrum 1 weight 0.10000E+01 volume 0.41447E-03 ppm1 1.612 ppm2 -0.346 CV 1
ASSI { 3833}
(( segid " " and resid 243 and name HB3 ))
( segid " " and resid 243 and name HD2%)
3.000 1.200 1.200 peak 3833 spectrum 1 weight 0.10000E+01 volume 0.11306E-02 ppm1 1.217 ppm2 0.159 CV 1
ASSI { 1207}
( segid " " and resid 189 and name HG2%)
(( segid " " and resid 248 and name HA ))
4.700 2.800 1.300 peak 1207 spectrum 1 weight 0.10000E+01 volume 0.71051E-03 ppm1 0.942 ppm2 4.858 CV 1
ASSI { 186}
( segid " " and resid 255 and name HD1%)
(( segid " " and resid 253 and name HB ))
3.400 1.400 1.400 peak 186 spectrum 1 weight 0.10000E+01 volume 0.10122E-02 ppm1 0.601 ppm2 3.526 CV 1
ASSI { 2852}
( segid " " and resid 246 and name HB% )
(( segid " " and resid 253 and name HB ))
4.900 2.900 1.100 peak 2852 spectrum 1 weight 0.10000E+01 volume 0.58644E-03 ppm1 1.181 ppm2 3.512 CV 1
ASSI { 3061}
(( segid " " and resid 323 and name HA ))
(( segid " " and resid 326 and name HB2 ))
3.600 1.600 1.600 peak 3061 spectrum 1 weight 0.10000E+01 volume 0.42575E-03 ppm1 3.286 ppm2 2.876 CV 1
ASSI { 1001}
(( segid " " and resid 252 and name HB3 ))
(( segid " " and resid 253 and name HA ))
3.600 1.600 1.600 peak 1001 spectrum 1 weight 0.10000E+01 volume 0.11447E-02 ppm1 3.674 ppm2 4.199 CV 1
ASSI { 2827}
(( segid " " and resid 282 and name HA ))
(( segid " " and resid 283 and name H ))
3.400 1.400 1.400 peak 2827 spectrum 1 weight 0.10000E+01 volume 0.15705E-02 ppm1 3.992 ppm2 7.318 CV 1
ASSI { 4796}
(( segid " " and resid 430 and name HE3 ))
(( segid " " and resid 427 and name HB3 ))
4.300 2.400 1.700 peak 4796 spectrum 1 weight 0.10000E+01 volume 0.43139E-03 ppm1 7.543 ppm2 1.991 CV 1
ASSI { 1664}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 318 and name HA ))
2.000 0.500 0.500 peak 1664 spectrum 1 weight 0.10000E+01 volume 0.73335E-02 ppm1 0.379 ppm2 3.368 CV 1
ASSI { 4355}
( segid " " and resid 255 and name HD2%)
(( segid " " and resid 247 and name HH ))
3.800 1.800 1.800 peak 4355 spectrum 1 weight 0.10000E+01 volume 0.60337E-03 ppm1 0.781 ppm2 9.426 CV 1
ASSI { 4029}
( segid " " and resid 323 and name HG1%)
(( segid " " and resid 323 and name H ))
3.200 1.300 1.300 peak 4029 spectrum 1 weight 0.10000E+01 volume 0.61521E-02 ppm1 0.781 ppm2 7.766 CV 1
ASSI { 312}
( segid " " and resid 192 and name HD1%)
(( segid " " and resid 197 and name H ))
3.300 1.400 1.400 peak 312 spectrum 1 weight 0.10000E+01 volume 0.13787E-02 ppm1 0.871 ppm2 8.035 CV 1
ASSI { 4676}
( segid " " and resid 300 and name HG1%)
( segid " " and resid 300 and name HG2%)
2.100 0.500 0.500 peak 4676 spectrum 1 weight 0.10000E+01 volume 0.18087E-01 ppm1 0.077 ppm2 0.539 CV 1
ASSI { 3952}
(( segid " " and resid 287 and name HB3 ))
(( segid " " and resid 287 and name HB2 ))
2.800 1.000 1.000 peak 3952 spectrum 1 weight 0.10000E+01 volume 0.35809E-03 ppm1 2.444 ppm2 3.046 CV 1
ASSI { 4791}
(( segid " " and resid 301 and name HG2 ))
(( segid " " and resid 301 and name H ))
2.100 0.500 0.500 peak 4791 spectrum 1 weight 0.10000E+01 volume 0.43336E-02 ppm1 2.485 ppm2 8.045 CV 1
ASSI { 1161}
( segid " " and resid 437 and name HG2%)
(( segid " " and resid 440 and name H ))
4.600 2.700 1.400 peak 1161 spectrum 1 weight 0.10000E+01 volume 0.60901E-03 ppm1 1.184 ppm2 8.445 CV 1
ASSI { 4456}
(( segid " " and resid 403 and name HB3 ))
( segid " " and resid 407 and name HE% )
5.100 3.200 0.900 peak 4456 spectrum 1 weight 0.10000E+01 volume 0.57798E-03 ppm1 1.969 ppm2 6.850 CV 1
ASSI { 1987}
( segid " " and resid 373 and name HD2%)
(( segid " " and resid 327 and name HE1 ))
3.300 1.400 1.400 peak 1987 spectrum 1 weight 0.10000E+01 volume 0.10291E-02 ppm1 0.515 ppm2 8.093 CV 1
ASSI { 4504}
(( segid " " and resid 202 and name HB2 ))
(( segid " " and resid 202 and name HA ))
3.700 1.700 1.700 peak 4504 spectrum 1 weight 0.10000E+01 volume 0.82893E-03 ppm1 2.037 ppm2 4.412 CV 1
ASSI { 3488}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 318 and name H ))
2.100 0.600 0.600 peak 3488 spectrum 1 weight 0.10000E+01 volume 0.61719E-02 ppm1 0.349 ppm2 8.039 CV 1
ASSI { 2291}
(( segid " " and resid 244 and name HG3 ))
(( segid " " and resid 244 and name HG2 ))
2.400 0.700 0.700 peak 2291 spectrum 1 weight 0.10000E+01 volume 0.69641E-03 ppm1 -0.543 ppm2 0.393 CV 1
ASSI { 1177}
( segid " " and resid 367 and name HD1%)
(( segid " " and resid 304 and name H ))
3.200 1.300 1.300 peak 1177 spectrum 1 weight 0.10000E+01 volume 0.25121E-02 ppm1 0.667 ppm2 8.685 CV 1
ASSI { 2181}
(( segid " " and resid 242 and name HB3 ))
(( segid " " and resid 242 and name H ))
2.500 0.800 0.800 peak 2181 spectrum 1 weight 0.10000E+01 volume 0.43139E-02 ppm1 2.229 ppm2 7.539 CV 1
OR { 2181}
(( segid " " and resid 242 and name HB2 ))
(( segid " " and resid 242 and name H ))
ASSI { 2856}
( segid " " and resid 195 and name HB% )
(( segid " " and resid 195 and name HA ))
2.200 0.600 0.600 peak 2856 spectrum 1 weight 0.10000E+01 volume 0.14238E-01 ppm1 1.358 ppm2 3.901 CV 1
ASSI { 4083}
(( segid " " and resid 297 and name HB ))
(( segid " " and resid 297 and name HA ))
2.700 0.900 0.900 peak 4083 spectrum 1 weight 0.10000E+01 volume 0.47310E-02 ppm1 3.942 ppm2 3.733 CV 1
ASSI { 2362}
(( segid " " and resid 252 and name HB3 ))
(( segid " " and resid 252 and name H ))
3.500 1.500 1.500 peak 2362 spectrum 1 weight 0.10000E+01 volume 0.13026E-02 ppm1 3.675 ppm2 8.402 CV 1
ASSI { 3241}
(( segid " " and resid 222 and name HG3 ))
( segid " " and resid 223 and name HE% )
5.900 4.400 0.100 peak 3241 spectrum 1 weight 0.10000E+01 volume 0.51879E-03 ppm1 0.970 ppm2 6.638 CV 1
ASSI { 812}
( segid " " and resid 373 and name HD2%)
(( segid " " and resid 324 and name HD2 ))
4.000 2.000 2.000 peak 812 spectrum 1 weight 0.10000E+01 volume 0.89095E-03 ppm1 0.515 ppm2 7.207 CV 1
ASSI { 1140}
(( segid " " and resid 374 and name HB2 ))
( segid " " and resid 372 and name HG1%)
4.300 2.300 1.700 peak 1140 spectrum 1 weight 0.10000E+01 volume 0.13562E-02 ppm1 1.627 ppm2 0.660 CV 1
ASSI { 3419}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 211 and name H ))
4.400 2.500 1.600 peak 3419 spectrum 1 weight 0.10000E+01 volume 0.16494E-02 ppm1 2.221 ppm2 7.461 CV 1
ASSI { 2572}
(( segid " " and resid 445 and name HB3 ))
(( segid " " and resid 445 and name HB2 ))
1.300 0.200 0.900 peak 2572 spectrum 1 weight 0.10000E+01 volume 0.42011E-01 ppm1 1.878 ppm2 2.036 CV 1
ASSI { 2949}
( segid " " and resid 344 and name HG2%)
(( segid " " and resid 344 and name H ))
3.400 1.500 1.500 peak 2949 spectrum 1 weight 0.10000E+01 volume 0.66764E-02 ppm1 0.895 ppm2 7.687 CV 1
ASSI { 4516}
( segid " " and resid 212 and name HG1%)
( segid " " and resid 211 and name HB% )
4.300 2.300 1.700 peak 4516 spectrum 1 weight 0.10000E+01 volume 0.17622E-02 ppm1 -0.342 ppm2 1.695 CV 1
ASSI { 2114}
(( segid " " and resid 281 and name HE3 ))
(( segid " " and resid 281 and name H ))
5.000 3.200 1.000 peak 2114 spectrum 1 weight 0.10000E+01 volume 0.44831E-03 ppm1 2.980 ppm2 9.170 CV 1
OR { 2114}
(( segid " " and resid 281 and name HE2 ))
(( segid " " and resid 281 and name H ))
ASSI { 3262}
(( segid " " and resid 444 and name HD3 ))
(( segid " " and resid 444 and name HA ))
2.100 0.600 0.600 peak 3262 spectrum 1 weight 0.10000E+01 volume 0.72348E-02 ppm1 3.151 ppm2 4.232 CV 1
OR { 3262}
(( segid " " and resid 444 and name HD2 ))
(( segid " " and resid 444 and name HA ))
ASSI { 1228}
( segid " " and resid 264 and name HB% )
(( segid " " and resid 231 and name HA ))
3.100 1.200 1.200 peak 1228 spectrum 1 weight 0.10000E+01 volume 0.15789E-02 ppm1 0.954 ppm2 3.547 CV 1
ASSI { 3296}
( segid " " and resid 436 and name HD2%)
(( segid " " and resid 436 and name H ))
2.400 2.400 3.600 peak 3296 spectrum 1 weight 0.10000E+01 volume 0.18439E-02 ppm1 0.856 ppm2 8.930 CV 1
ASSI { 3560}
(( segid " " and resid 228 and name HG3 ))
(( segid " " and resid 336 and name HG3 ))
3.500 1.600 1.600 peak 3560 spectrum 1 weight 0.10000E+01 volume 0.13534E-02 ppm1 1.970 ppm2 1.317 CV 1
ASSI { 4749}
(( segid " " and resid 388 and name HB2 ))
(( segid " " and resid 389 and name HD2 ))
5.300 3.600 0.700 peak 4749 spectrum 1 weight 0.10000E+01 volume 0.42575E-03 ppm1 1.540 ppm2 3.115 CV 1
ASSI { 3340}
(( segid " " and resid 409 and name HB3 ))
(( segid " " and resid 409 and name HG ))
3.200 1.300 1.300 peak 3340 spectrum 1 weight 0.10000E+01 volume 0.74717E-03 ppm1 1.928 ppm2 1.400 CV 1
ASSI { 1931}
(( segid " " and resid 192 and name HG13))
( segid " " and resid 192 and name HD1%)
2.000 0.500 0.500 peak 1931 spectrum 1 weight 0.10000E+01 volume 0.13455E-01 ppm1 1.590 ppm2 0.861 CV 1
ASSI { 2699}
( segid " " and resid 408 and name HD2%)
(( segid " " and resid 408 and name H ))
3.800 1.800 1.800 peak 2699 spectrum 1 weight 0.10000E+01 volume 0.34144E-02 ppm1 0.883 ppm2 7.470 CV 1
ASSI { 685}
( segid " " and resid 359 and name HG1%)
(( segid " " and resid 361 and name H ))
4.900 3.000 1.100 peak 685 spectrum 1 weight 0.10000E+01 volume 0.60901E-03 ppm1 0.899 ppm2 8.370 CV 1
ASSI { 524}
(( segid " " and resid 374 and name HD2 ))
(( segid " " and resid 320 and name HH2 ))
4.200 2.200 1.800 peak 524 spectrum 1 weight 0.10000E+01 volume 0.12800E-02 ppm1 1.599 ppm2 7.131 CV 1
OR { 524}
(( segid " " and resid 374 and name HD3 ))
(( segid " " and resid 320 and name HH2 ))
ASSI { 4367}
( segid " " and resid 373 and name HD2%)
(( segid " " and resid 373 and name HG ))
2.200 0.600 0.600 peak 4367 spectrum 1 weight 0.10000E+01 volume 0.52020E-02 ppm1 0.517 ppm2 1.088 CV 1
ASSI { 2109}
(( segid " " and resid 398 and name HB ))
(( segid " " and resid 398 and name HG13))
2.500 0.800 0.800 peak 2109 spectrum 1 weight 0.10000E+01 volume 0.23543E-02 ppm1 1.768 ppm2 1.610 CV 1
ASSI { 3658}
(( segid " " and resid 184 and name HD3 ))
(( segid " " and resid 184 and name HB2 ))
3.700 1.700 1.700 peak 3658 spectrum 1 weight 0.10000E+01 volume 0.39388E-02 ppm1 3.614 ppm2 2.214 CV 1
ASSI { 1902}
(( segid " " and resid 410 and name HA ))
(( segid " " and resid 410 and name HB2 ))
3.200 1.300 1.300 peak 1902 spectrum 1 weight 0.10000E+01 volume 0.13223E-02 ppm1 4.364 ppm2 2.757 CV 1
OR { 1902}
(( segid " " and resid 410 and name HA ))
(( segid " " and resid 410 and name HB3 ))
ASSI { 1824}
( segid " " and resid 377 and name HE% )
(( segid " " and resid 378 and name H ))
2.600 2.600 3.400 peak 1824 spectrum 1 weight 0.10000E+01 volume 0.10122E-02 ppm1 1.994 ppm2 8.547 CV 1
ASSI { 1968}
(( segid " " and resid 318 and name HG12))
(( segid " " and resid 315 and name HA ))
5.500 3.700 0.500 peak 1968 spectrum 1 weight 0.10000E+01 volume 0.38344E-03 ppm1 1.000 ppm2 3.795 CV 1
ASSI { 1501}
( segid " " and resid 386 and name HB% )
(( segid " " and resid 387 and name HA ))
4.400 2.400 1.600 peak 1501 spectrum 1 weight 0.10000E+01 volume 0.84586E-03 ppm1 1.450 ppm2 4.278 CV 1
ASSI { 3689}
( segid " " and resid 243 and name HD2%)
( segid " " and resid 258 and name HD% )
3.400 1.400 1.400 peak 3689 spectrum 1 weight 0.10000E+01 volume 0.12434E-02 ppm1 0.167 ppm2 7.086 CV 1
ASSI { 4522}
(( segid " " and resid 244 and name HA ))
(( segid " " and resid 244 and name HB3 ))
3.300 1.400 1.400 peak 4522 spectrum 1 weight 0.10000E+01 volume 0.54981E-03 ppm1 3.288 ppm2 1.523 CV 1
ASSI { 4649}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 213 and name HA ))
4.200 2.200 1.800 peak 4649 spectrum 1 weight 0.10000E+01 volume 0.51879E-03 ppm1 -0.162 ppm2 3.596 CV 1
ASSI { 3266}
( segid " " and resid 357 and name HD1%)
(( segid " " and resid 357 and name HG ))
2.300 0.700 0.700 peak 3266 spectrum 1 weight 0.10000E+01 volume 0.41334E-02 ppm1 0.677 ppm2 1.772 CV 1
OR { 3266}
( segid " " and resid 357 and name HD1%)
(( segid " " and resid 357 and name HB3 ))
ASSI { 4513}
(( segid " " and resid 360 and name HA ))
( segid " " and resid 360 and name HD% )
2.800 1.000 1.000 peak 4513 spectrum 1 weight 0.10000E+01 volume 0.20244E-02 ppm1 4.253 ppm2 7.081 CV 1
ASSI { 123}
( segid " " and resid 361 and name HD% )
( segid " " and resid 329 and name HD1%)
4.000 2.000 2.000 peak 123 spectrum 1 weight 0.10000E+01 volume 0.59773E-03 ppm1 7.145 ppm2 0.125 CV 1
ASSI { 2166}
(( segid " " and resid 308 and name HB2 ))
(( segid " " and resid 308 and name HE3 ))
3.000 1.100 1.100 peak 2166 spectrum 1 weight 0.10000E+01 volume 0.21118E-02 ppm1 1.832 ppm2 2.870 CV 1
OR { 2166}
(( segid " " and resid 308 and name HB2 ))
(( segid " " and resid 308 and name HE2 ))
OR { 2166}
(( segid " " and resid 308 and name HB3 ))
(( segid " " and resid 308 and name HE3 ))
OR { 2166}
(( segid " " and resid 308 and name HB3 ))
(( segid " " and resid 308 and name HE2 ))
ASSI { 4738}
(( segid " " and resid 319 and name HB3 ))
(( segid " " and resid 319 and name HA ))
3.200 1.300 1.300 peak 4738 spectrum 1 weight 0.10000E+01 volume 0.40883E-03 ppm1 3.086 ppm2 2.297 CV 1
ASSI { 3149}
(( segid " " and resid 282 and name HB2 ))
(( segid " " and resid 282 and name H ))
2.500 0.800 0.800 peak 3149 spectrum 1 weight 0.10000E+01 volume 0.25375E-02 ppm1 1.848 ppm2 8.694 CV 1
ASSI { 889}
(( segid " " and resid 367 and name HB2 ))
( segid " " and resid 367 and name HD1%)
3.000 1.100 1.100 peak 889 spectrum 1 weight 0.10000E+01 volume 0.11532E-02 ppm1 1.026 ppm2 0.661 CV 1
ASSI { 659}
(( segid " " and resid 309 and name HG2 ))
( segid " " and resid 283 and name HD1%)
3.500 1.500 1.500 peak 659 spectrum 1 weight 0.10000E+01 volume 0.29943E-02 ppm1 2.291 ppm2 0.719 CV 1
ASSI { 1688}
(( segid " " and resid 228 and name HG2 ))
(( segid " " and resid 228 and name H ))
4.500 2.500 1.500 peak 1688 spectrum 1 weight 0.10000E+01 volume 0.11052E-02 ppm1 2.060 ppm2 8.430 CV 1
ASSI { 3971}
(( segid " " and resid 187 and name HG3 ))
(( segid " " and resid 187 and name HA ))
3.100 1.200 1.200 peak 3971 spectrum 1 weight 0.10000E+01 volume 0.14520E-02 ppm1 1.332 ppm2 4.611 CV 1
ASSI { 2007}
(( segid " " and resid 444 and name HD3 ))
(( segid " " and resid 395 and name HE22))
4.100 2.100 1.900 peak 2007 spectrum 1 weight 0.10000E+01 volume 0.41165E-03 ppm1 3.150 ppm2 6.971 CV 1
OR { 2007}
(( segid " " and resid 444 and name HD2 ))
(( segid " " and resid 395 and name HE22))
ASSI { 754}
( segid " " and resid 359 and name HG2%)
(( segid " " and resid 359 and name HA ))
2.900 1.100 1.100 peak 754 spectrum 1 weight 0.10000E+01 volume 0.25883E-02 ppm1 -0.458 ppm2 3.323 CV 1
ASSI { 3363}
( segid " " and resid 329 and name HD1%)
(( segid " " and resid 342 and name HG12))
3.500 1.600 1.600 peak 3363 spectrum 1 weight 0.10000E+01 volume 0.14408E-02 ppm1 0.118 ppm2 1.058 CV 1
ASSI { 2906}
( segid " " and resid 344 and name HD1%)
(( segid " " and resid 340 and name HE21))
4.000 2.000 2.000 peak 2906 spectrum 1 weight 0.10000E+01 volume 0.41729E-03 ppm1 0.818 ppm2 6.778 CV 1
ASSI { 2244}
(( segid " " and resid 317 and name HG ))
(( segid " " and resid 317 and name H ))
5.000 3.200 1.000 peak 2244 spectrum 1 weight 0.10000E+01 volume 0.48494E-03 ppm1 0.414 ppm2 7.498 CV 1
ASSI { 597}
(( segid " " and resid 281 and name HE3 ))
(( segid " " and resid 277 and name H ))
3.500 1.500 1.500 peak 597 spectrum 1 weight 0.10000E+01 volume 0.72743E-03 ppm1 2.974 ppm2 8.688 CV 1
OR { 597}
(( segid " " and resid 281 and name HE2 ))
(( segid " " and resid 277 and name H ))
ASSI { 1395}
( segid " " and resid 364 and name HG2%)
( segid " " and resid 368 and name HD% )
2.000 0.500 0.500 peak 1395 spectrum 1 weight 0.10000E+01 volume 0.46379E-02 ppm1 0.908 ppm2 7.143 CV 1
ASSI { 3161}
(( segid " " and resid 272 and name HG3 ))
(( segid " " and resid 269 and name HE22))
4.600 2.600 1.400 peak 3161 spectrum 1 weight 0.10000E+01 volume 0.11250E-02 ppm1 1.800 ppm2 6.854 CV 1
OR { 3161}
(( segid " " and resid 272 and name HG2 ))
(( segid " " and resid 269 and name HE22))
ASSI { 4044}
(( segid " " and resid 351 and name HB2 ))
(( segid " " and resid 277 and name HD22))
3.800 1.800 1.800 peak 4044 spectrum 1 weight 0.10000E+01 volume 0.26785E-03 ppm1 2.007 ppm2 6.116 CV 1
ASSI { 2776}
( segid " " and resid 204 and name HD% )
(( segid " " and resid 204 and name HB3 ))
3.600 1.600 1.600 peak 2776 spectrum 1 weight 0.10000E+01 volume 0.64285E-03 ppm1 6.885 ppm2 2.649 CV 1
ASSI { 1738}
(( segid " " and resid 420 and name HG12))
( segid " " and resid 420 and name HD1%)
1.800 0.400 0.400 peak 1738 spectrum 1 weight 0.10000E+01 volume 0.32168E-01 ppm1 1.112 ppm2 0.792 CV 1
OR { 1738}
(( segid " " and resid 420 and name HG12))
( segid " " and resid 420 and name HG2%)
ASSI { 4634}
( segid " " and resid 194 and name HD2%)
( segid " " and resid 194 and name HD1%)
2.300 0.600 0.600 peak 4634 spectrum 1 weight 0.10000E+01 volume 0.13268E-01 ppm1 0.553 ppm2 0.741 CV 1
ASSI { 4560}
(( segid " " and resid 437 and name HA ))
( segid " " and resid 436 and name HD2%)
4.600 2.600 1.400 peak 4560 spectrum 1 weight 0.10000E+01 volume 0.65131E-03 ppm1 3.798 ppm2 0.860 CV 1
ASSI { 4639}
( segid " " and resid 233 and name HG2%)
(( segid " " and resid 233 and name HA ))
2.700 0.900 0.900 peak 4639 spectrum 1 weight 0.10000E+01 volume 0.76829E-02 ppm1 0.948 ppm2 3.820 CV 1
ASSI { 1778}
( segid " " and resid 435 and name HD1%)
(( segid " " and resid 436 and name H ))
3.000 3.000 3.000 peak 1778 spectrum 1 weight 0.10000E+01 volume 0.50187E-03 ppm1 0.868 ppm2 8.947 CV 1
ASSI { 1904}
(( segid " " and resid 318 and name HA ))
(( segid " " and resid 319 and name H ))
3.800 1.800 1.800 peak 1904 spectrum 1 weight 0.10000E+01 volume 0.40883E-03 ppm1 3.373 ppm2 7.845 CV 1
ASSI { 4255}
( segid " " and resid 420 and name HD1%)
(( segid " " and resid 420 and name HG13))
1.800 0.400 0.400 peak 4255 spectrum 1 weight 0.10000E+01 volume 0.29373E-01 ppm1 0.770 ppm2 1.383 CV 1
ASSI { 4124}
( segid " " and resid 307 and name HD1%)
(( segid " " and resid 307 and name H ))
3.100 1.200 1.200 peak 4124 spectrum 1 weight 0.10000E+01 volume 0.27800E-02 ppm1 1.210 ppm2 8.725 CV 1
ASSI { 539}
( segid " " and resid 303 and name HD% )
( segid " " and resid 359 and name HG2%)
4.200 2.200 1.800 peak 539 spectrum 1 weight 0.10000E+01 volume 0.79227E-03 ppm1 7.084 ppm2 -0.451 CV 1
ASSI { 4160}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 329 and name HA ))
2.400 0.700 0.700 peak 4160 spectrum 1 weight 0.10000E+01 volume 0.39670E-02 ppm1 0.748 ppm2 3.863 CV 1
ASSI { 2624}
( segid " " and resid 233 and name HG2%)
(( segid " " and resid 229 and name H ))
2.700 2.700 3.300 peak 2624 spectrum 1 weight 0.10000E+01 volume 0.92479E-03 ppm1 0.947 ppm2 9.607 CV 1
ASSI { 4728}
(( segid " " and resid 317 and name HG ))
(( segid " " and resid 317 and name HB2 ))
3.700 1.700 1.700 peak 4728 spectrum 1 weight 0.10000E+01 volume 0.43139E-03 ppm1 0.415 ppm2 1.358 CV 1
ASSI { 2273}
(( segid " " and resid 308 and name HE3 ))
(( segid " " and resid 308 and name HA ))
2.800 1.000 1.000 peak 2273 spectrum 1 weight 0.10000E+01 volume 0.61888E-02 ppm1 2.853 ppm2 3.971 CV 1
OR { 2273}
(( segid " " and resid 308 and name HE2 ))
(( segid " " and resid 308 and name HA ))
ASSI { 436}
( segid " " and resid 315 and name HE% )
(( segid " " and resid 319 and name HG ))
3.600 1.600 1.600 peak 436 spectrum 1 weight 0.10000E+01 volume 0.67948E-03 ppm1 6.877 ppm2 4.130 CV 1
ASSI { 2929}
(( segid " " and resid 252 and name HB3 ))
(( segid " " and resid 253 and name H ))
3.600 1.600 1.600 peak 2929 spectrum 1 weight 0.10000E+01 volume 0.27885E-02 ppm1 3.677 ppm2 8.247 CV 1
ASSI { 1230}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 211 and name HA ))
2.000 0.500 0.500 peak 1230 spectrum 1 weight 0.10000E+01 volume 0.83034E-02 ppm1 2.221 ppm2 3.836 CV 1
ASSI { 3763}
(( segid " " and resid 317 and name HG ))
(( segid " " and resid 317 and name HA ))
3.300 1.400 1.400 peak 3763 spectrum 1 weight 0.10000E+01 volume 0.58926E-03 ppm1 0.415 ppm2 3.125 CV 1
ASSI { 2777}
(( segid " " and resid 407 and name HA ))
(( segid " " and resid 407 and name HB3 ))
3.200 1.300 1.300 peak 2777 spectrum 1 weight 0.10000E+01 volume 0.80637E-03 ppm1 4.300 ppm2 3.283 CV 1
OR { 2777}
(( segid " " and resid 407 and name HA ))
(( segid " " and resid 407 and name HB2 ))
ASSI { 278}
(( segid " " and resid 348 and name HD2 ))
(( segid " " and resid 346 and name HB3 ))
3.700 1.700 1.700 peak 278 spectrum 1 weight 0.10000E+01 volume 0.12067E-02 ppm1 3.568 ppm2 1.498 CV 1
ASSI { 1764}
(( segid " " and resid 435 and name HB ))
( segid " " and resid 435 and name HG2%)
2.900 1.000 1.000 peak 1764 spectrum 1 weight 0.10000E+01 volume 0.23881E-02 ppm1 1.969 ppm2 0.880 CV 1
OR { 1764}
(( segid " " and resid 435 and name HB ))
( segid " " and resid 435 and name HD1%)
ASSI { 4470}
(( segid " " and resid 222 and name HD2 ))
(( segid " " and resid 223 and name H ))
6.000 4.800 0.000 peak 4470 spectrum 1 weight 0.10000E+01 volume 0.46802E-03 ppm1 1.305 ppm2 8.420 CV 1
ASSI { 2783}
( segid " " and resid 202 and name HE% )
( segid " " and resid 198 and name HG1%)
2.400 0.700 0.700 peak 2783 spectrum 1 weight 0.10000E+01 volume 0.11839E-01 ppm1 1.868 ppm2 0.603 CV 1
OR { 2783}
( segid " " and resid 202 and name HE% )
( segid " " and resid 198 and name HG2%)
ASSI { 1982}
(( segid " " and resid 242 and name HG2 ))
( segid " " and resid 243 and name HD2%)
4.700 2.700 1.300 peak 1982 spectrum 1 weight 0.10000E+01 volume 0.76970E-03 ppm1 2.248 ppm2 0.165 CV 1
ASSI { 3772}
(( segid " " and resid 305 and name HB2 ))
( segid " " and resid 306 and name HD2%)
3.800 1.800 1.800 peak 3772 spectrum 1 weight 0.10000E+01 volume 0.68794E-03 ppm1 1.832 ppm2 -0.351 CV 1
OR { 3772}
(( segid " " and resid 305 and name HB3 ))
( segid " " and resid 306 and name HD2%)
ASSI { 4484}
(( segid " " and resid 308 and name HB3 ))
(( segid " " and resid 308 and name H ))
3.300 1.400 1.400 peak 4484 spectrum 1 weight 0.10000E+01 volume 0.34990E-02 ppm1 1.856 ppm2 7.086 CV 1
ASSI { 3160}
(( segid " " and resid 342 and name HA ))
( segid " " and resid 342 and name HG2%)
3.000 1.200 1.200 peak 3160 spectrum 1 weight 0.10000E+01 volume 0.99245E-03 ppm1 3.916 ppm2 0.510 CV 1
ASSI { 4433}
(( segid " " and resid 376 and name HB ))
(( segid " " and resid 376 and name HA ))
3.000 1.100 1.100 peak 4433 spectrum 1 weight 0.10000E+01 volume 0.13646E-02 ppm1 2.031 ppm2 3.876 CV 1
ASSI { 1817}
(( segid " " and resid 227 and name HB2 ))
(( segid " " and resid 227 and name HB3 ))
2.000 0.500 0.500 peak 1817 spectrum 1 weight 0.10000E+01 volume 0.26390E-02 ppm1 3.135 ppm2 2.816 CV 1
ASSI { 1183}
(( segid " " and resid 429 and name HB2 ))
( segid " " and resid 429 and name HD2%)
3.000 1.100 1.100 peak 1183 spectrum 1 weight 0.10000E+01 volume 0.26052E-02 ppm1 1.423 ppm2 0.650 CV 1
ASSI { 2692}
( segid " " and resid 263 and name HG2%)
( segid " " and resid 219 and name HD% )
2.700 0.900 0.900 peak 2692 spectrum 1 weight 0.10000E+01 volume 0.20780E-02 ppm1 0.807 ppm2 6.853 CV 1
ASSI { 2401}
(( segid " " and resid 202 and name HB2 ))
( segid " " and resid 198 and name HG1%)
4.200 2.300 1.800 peak 2401 spectrum 1 weight 0.10000E+01 volume 0.16720E-02 ppm1 2.045 ppm2 0.616 CV 1
OR { 2401}
(( segid " " and resid 202 and name HB2 ))
( segid " " and resid 198 and name HG2%)
ASSI { 2601}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 344 and name H ))
3.800 1.800 1.800 peak 2601 spectrum 1 weight 0.10000E+01 volume 0.20469E-02 ppm1 1.009 ppm2 7.685 CV 1
ASSI { 4687}
(( segid " " and resid 297 and name HA ))
(( segid " " and resid 297 and name H ))
2.900 1.100 1.100 peak 4687 spectrum 1 weight 0.10000E+01 volume 0.12011E-02 ppm1 3.734 ppm2 8.051 CV 1
ASSI { 262}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 279 and name HG ))
2.900 1.100 1.100 peak 262 spectrum 1 weight 0.10000E+01 volume 0.73194E-02 ppm1 2.151 ppm2 1.432 CV 1
OR { 262}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 279 and name HB3 ))
ASSI { 713}
(( segid " " and resid 239 and name HD2 ))
( segid " " and resid 236 and name HD1%)
3.400 1.400 1.400 peak 713 spectrum 1 weight 0.10000E+01 volume 0.18552E-02 ppm1 1.754 ppm2 0.838 CV 1
ASSI { 1804}
(( segid " " and resid 429 and name HG ))
(( segid " " and resid 430 and name HD1 ))
4.600 2.600 1.400 peak 1804 spectrum 1 weight 0.10000E+01 volume 0.40600E-03 ppm1 1.392 ppm2 7.182 CV 1
ASSI { 4325}
( segid " " and resid 344 and name HD1%)
(( segid " " and resid 344 and name H ))
3.200 1.300 1.300 peak 4325 spectrum 1 weight 0.10000E+01 volume 0.76692E-02 ppm1 0.818 ppm2 7.687 CV 1
ASSI { 934}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 282 and name H ))
4.200 2.200 1.800 peak 934 spectrum 1 weight 0.10000E+01 volume 0.11165E-02 ppm1 0.902 ppm2 8.691 CV 1
ASSI { 3437}
(( segid " " and resid 246 and name HA ))
(( segid " " and resid 246 and name H ))
3.400 1.400 1.400 peak 3437 spectrum 1 weight 0.10000E+01 volume 0.11165E-02 ppm1 3.836 ppm2 7.440 CV 1
ASSI { 3291}
(( segid " " and resid 398 and name HB ))
( segid " " and resid 398 and name HD1%)
3.400 1.400 1.400 peak 3291 spectrum 1 weight 0.10000E+01 volume 0.95864E-03 ppm1 1.775 ppm2 0.543 CV 1
OR { 3291}
(( segid " " and resid 398 and name HB ))
(( segid " " and resid 398 and name HG12))
ASSI { 3471}
( segid " " and resid 352 and name HD1%)
( segid " " and resid 352 and name HG2%)
2.000 0.500 0.500 peak 3471 spectrum 1 weight 0.10000E+01 volume 0.90279E-02 ppm1 0.602 ppm2 0.895 CV 1
ASSI { 2209}
( segid " " and resid 385 and name HE% )
(( segid " " and resid 383 and name HB3 ))
3.900 1.900 1.900 peak 2209 spectrum 1 weight 0.10000E+01 volume 0.80073E-03 ppm1 1.914 ppm2 3.798 CV 1
ASSI { 3406}
(( segid " " and resid 324 and name HB2 ))
(( segid " " and resid 324 and name HB3 ))
2.600 0.800 0.800 peak 3406 spectrum 1 weight 0.10000E+01 volume 0.30732E-03 ppm1 2.897 ppm2 3.325 CV 1
ASSI { 301}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 373 and name HG ))
3.700 1.700 1.700 peak 301 spectrum 1 weight 0.10000E+01 volume 0.13562E-02 ppm1 0.368 ppm2 1.107 CV 1
ASSI { 2815}
(( segid " " and resid 322 and name HA ))
(( segid " " and resid 322 and name H ))
3.600 1.600 1.600 peak 2815 spectrum 1 weight 0.10000E+01 volume 0.33552E-03 ppm1 3.382 ppm2 8.210 CV 1
ASSI { 2422}
( segid " " and resid 386 and name HB% )
(( segid " " and resid 387 and name HB ))
4.300 2.300 1.700 peak 2422 spectrum 1 weight 0.10000E+01 volume 0.80073E-03 ppm1 1.450 ppm2 4.014 CV 1
ASSI { 2698}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 322 and name HA ))
2.400 0.700 0.700 peak 2698 spectrum 1 weight 0.10000E+01 volume 0.29351E-02 ppm1 0.397 ppm2 3.369 CV 1
ASSI { 2866}
(( segid " " and resid 420 and name HG12))
(( segid " " and resid 420 and name HG13))
1.200 0.200 1.000 peak 2866 spectrum 1 weight 0.10000E+01 volume 0.47169E-01 ppm1 1.111 ppm2 1.386 CV 1
ASSI { 4136}
(( segid " " and resid 327 and name HB2 ))
(( segid " " and resid 324 and name HA ))
3.400 1.400 1.400 peak 4136 spectrum 1 weight 0.10000E+01 volume 0.10291E-02 ppm1 3.149 ppm2 3.931 CV 1
OR { 4136}
(( segid " " and resid 327 and name HB3 ))
(( segid " " and resid 324 and name HA ))
ASSI { 1957}
(( segid " " and resid 286 and name HA ))
(( segid " " and resid 286 and name HD3 ))
3.900 1.900 1.900 peak 1957 spectrum 1 weight 0.10000E+01 volume 0.38344E-03 ppm1 4.114 ppm2 3.029 CV 1
ASSI { 1773}
(( segid " " and resid 223 and name HB2 ))
( segid " " and resid 223 and name HE% )
6.000 4.800 0.000 peak 1773 spectrum 1 weight 0.10000E+01 volume 0.26221E-03 ppm1 1.783 ppm2 6.658 CV 1
ASSI { 3622}
( segid " " and resid 420 and name HG2%)
(( segid " " and resid 422 and name H ))
3.200 1.300 1.300 peak 3622 spectrum 1 weight 0.10000E+01 volume 0.15479E-02 ppm1 0.805 ppm2 8.193 CV 1
ASSI { 4047}
(( segid " " and resid 320 and name HA ))
(( segid " " and resid 321 and name H ))
4.000 2.000 2.000 peak 4047 spectrum 1 weight 0.10000E+01 volume 0.40600E-03 ppm1 3.822 ppm2 8.589 CV 1
ASSI { 2040}
( segid " " and resid 386 and name HB% )
(( segid " " and resid 382 and name HD1 ))
3.800 1.800 1.800 peak 2040 spectrum 1 weight 0.10000E+01 volume 0.12800E-02 ppm1 1.452 ppm2 6.934 CV 1
ASSI { 85}
(( segid " " and resid 420 and name HA ))
( segid " " and resid 420 and name HG2%)
2.300 0.700 0.700 peak 85 spectrum 1 weight 0.10000E+01 volume 0.14974E-01 ppm1 3.978 ppm2 0.795 CV 1
OR { 85}
(( segid " " and resid 420 and name HA ))
( segid " " and resid 420 and name HD1%)
ASSI { 4267}
(( segid " " and resid 429 and name HB3 ))
(( segid " " and resid 429 and name HB2 ))
2.200 0.600 0.600 peak 4267 spectrum 1 weight 0.10000E+01 volume 0.16297E-02 ppm1 1.789 ppm2 1.397 CV 1
OR { 4267}
(( segid " " and resid 429 and name HB3 ))
(( segid " " and resid 429 and name HG ))
ASSI { 4783}
(( segid " " and resid 440 and name HA ))
(( segid " " and resid 440 and name HE2 ))
5.100 3.300 0.900 peak 4783 spectrum 1 weight 0.10000E+01 volume 0.62029E-03 ppm1 3.768 ppm2 2.865 CV 1
ASSI { 4050}
(( segid " " and resid 363 and name HA ))
(( segid " " and resid 366 and name H ))
3.400 1.400 1.400 peak 4050 spectrum 1 weight 0.10000E+01 volume 0.77816E-03 ppm1 5.090 ppm2 8.330 CV 1
ASSI { 3643}
(( segid " " and resid 364 and name HA ))
( segid " " and resid 368 and name HD% )
3.800 1.800 1.800 peak 3643 spectrum 1 weight 0.10000E+01 volume 0.92761E-03 ppm1 3.662 ppm2 7.162 CV 1
ASSI { 799}
(( segid " " and resid 374 and name HE2 ))
( segid " " and resid 372 and name HG1%)
3.100 1.200 1.200 peak 799 spectrum 1 weight 0.10000E+01 volume 0.30197E-02 ppm1 2.972 ppm2 0.649 CV 1
OR { 799}
(( segid " " and resid 374 and name HE3 ))
( segid " " and resid 372 and name HG1%)
ASSI { 3387}
( segid " " and resid 278 and name HD2%)
(( segid " " and resid 314 and name HD21))
3.700 1.700 1.700 peak 3387 spectrum 1 weight 0.10000E+01 volume 0.18214E-02 ppm1 0.746 ppm2 7.360 CV 1
ASSI { 4334}
( segid " " and resid 212 and name HG1%)
(( segid " " and resid 212 and name HB ))
2.700 0.900 0.900 peak 4334 spectrum 1 weight 0.10000E+01 volume 0.25855E-02 ppm1 -0.343 ppm2 1.177 CV 1
ASSI { 3464}
(( segid " " and resid 365 and name HG2 ))
(( segid " " and resid 365 and name HA ))
2.400 0.700 0.700 peak 3464 spectrum 1 weight 0.10000E+01 volume 0.14563E-01 ppm1 2.344 ppm2 3.875 CV 1
OR { 3464}
(( segid " " and resid 365 and name HG3 ))
(( segid " " and resid 365 and name HA ))
ASSI { 2104}
(( segid " " and resid 336 and name HD2 ))
(( segid " " and resid 337 and name H ))
4.900 3.000 1.100 peak 2104 spectrum 1 weight 0.10000E+01 volume 0.54981E-03 ppm1 1.465 ppm2 7.304 CV 1
ASSI { 1932}
(( segid " " and resid 183 and name HG2 ))
(( segid " " and resid 183 and name HB3 ))
2.100 2.100 3.900 peak 1932 spectrum 1 weight 0.10000E+01 volume 0.19705E-01 ppm1 2.522 ppm2 1.855 CV 1
ASSI { 2892}
(( segid " " and resid 232 and name HB2 ))
(( segid " " and resid 232 and name HD2 ))
4.000 2.000 2.000 peak 2892 spectrum 1 weight 0.10000E+01 volume 0.60055E-03 ppm1 1.491 ppm2 3.167 CV 1
ASSI { 3287}
( segid " " and resid 323 and name HG1%)
( segid " " and resid 373 and name HD1%)
3.400 1.400 1.400 peak 3287 spectrum 1 weight 0.10000E+01 volume 0.25093E-02 ppm1 0.779 ppm2 -0.176 CV 1
ASSI { 1680}
(( segid " " and resid 390 and name HA ))
( segid " " and resid 390 and name HG2%)
3.300 1.400 1.400 peak 1680 spectrum 1 weight 0.10000E+01 volume 0.49566E-02 ppm1 3.868 ppm2 1.076 CV 1
ASSI { 1871}
(( segid " " and resid 254 and name HB2 ))
(( segid " " and resid 254 and name HB3 ))
1.900 0.500 0.500 peak 1871 spectrum 1 weight 0.10000E+01 volume 0.59970E-02 ppm1 2.611 ppm2 2.949 CV 1
ASSI { 2402}
(( segid " " and resid 425 and name HB2 ))
(( segid " " and resid 426 and name H ))
3.200 1.300 1.300 peak 2402 spectrum 1 weight 0.10000E+01 volume 0.40318E-03 ppm1 1.641 ppm2 7.998 CV 1
ASSI { 1382}
(( segid " " and resid 345 and name HB ))
( segid " " and resid 345 and name HG2%)
2.300 0.700 0.700 peak 1382 spectrum 1 weight 0.10000E+01 volume 0.60196E-02 ppm1 2.138 ppm2 0.944 CV 1
ASSI { 2767}
(( segid " " and resid 325 and name HG3 ))
(( segid " " and resid 325 and name HG2 ))
2.000 0.500 0.500 peak 2767 spectrum 1 weight 0.10000E+01 volume 0.12885E-02 ppm1 2.701 ppm2 2.412 CV 1
ASSI { 3486}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 214 and name HA ))
4.000 2.000 2.000 peak 3486 spectrum 1 weight 0.10000E+01 volume 0.99527E-03 ppm1 -0.046 ppm2 3.558 CV 1
ASSI { 1975}
(( segid " " and resid 278 and name HG ))
(( segid " " and resid 278 and name HA ))
2.700 0.900 0.900 peak 1975 spectrum 1 weight 0.10000E+01 volume 0.21033E-02 ppm1 1.728 ppm2 3.820 CV 1
ASSI { 1696}
(( segid " " and resid 222 and name HB2 ))
(( segid " " and resid 222 and name HG2 ))
3.300 1.400 1.400 peak 1696 spectrum 1 weight 0.10000E+01 volume 0.15141E-02 ppm1 1.209 ppm2 0.389 CV 1
ASSI { 3549}
( segid " " and resid 330 and name HB% )
( segid " " and resid 329 and name HD1%)
5.400 3.700 0.600 peak 3549 spectrum 1 weight 0.10000E+01 volume 0.95300E-03 ppm1 1.555 ppm2 0.119 CV 1
ASSI { 1706}
(( segid " " and resid 300 and name HB ))
(( segid " " and resid 300 and name HA ))
2.900 1.100 1.100 peak 1706 spectrum 1 weight 0.10000E+01 volume 0.82893E-03 ppm1 1.738 ppm2 2.909 CV 1
ASSI { 2199}
( segid " " and resid 339 and name HG2%)
(( segid " " and resid 339 and name H ))
3.600 1.700 1.700 peak 2199 spectrum 1 weight 0.10000E+01 volume 0.42293E-02 ppm1 0.706 ppm2 8.367 CV 1
ASSI { 599}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 329 and name H ))
4.500 2.500 1.500 peak 599 spectrum 1 weight 0.10000E+01 volume 0.11250E-02 ppm1 1.914 ppm2 7.950 CV 1
ASSI { 2414}
( segid " " and resid 192 and name HG2%)
( segid " " and resid 192 and name HD1%)
2.300 0.700 0.700 peak 2414 spectrum 1 weight 0.10000E+01 volume 0.83824E-02 ppm1 0.684 ppm2 0.866 CV 1
ASSI { 3784}
(( segid " " and resid 308 and name HG2 ))
(( segid " " and resid 308 and name HB3 ))
2.000 0.500 0.500 peak 3784 spectrum 1 weight 0.10000E+01 volume 0.10683E-01 ppm1 1.541 ppm2 1.837 CV 1
OR { 3784}
(( segid " " and resid 308 and name HG2 ))
(( segid " " and resid 308 and name HB2 ))
ASSI { 2396}
(( segid " " and resid 430 and name HH2 ))
(( segid " " and resid 430 and name HE3 ))
5.100 3.200 0.900 peak 2396 spectrum 1 weight 0.10000E+01 volume 0.62875E-03 ppm1 6.989 ppm2 7.538 CV 1
ASSI { 4063}
(( segid " " and resid 232 and name HB2 ))
(( segid " " and resid 232 and name H ))
3.500 1.500 1.500 peak 4063 spectrum 1 weight 0.10000E+01 volume 0.52161E-03 ppm1 1.503 ppm2 8.781 CV 1
ASSI { 4001}
( segid " " and resid 253 and name HG2%)
( segid " " and resid 243 and name HD2%)
2.200 0.600 0.600 peak 4001 spectrum 1 weight 0.10000E+01 volume 0.15736E-01 ppm1 0.616 ppm2 0.162 CV 1
ASSI { 204}
( segid " " and resid 186 and name HD2%)
(( segid " " and resid 185 and name HA ))
4.100 2.100 1.900 peak 204 spectrum 1 weight 0.10000E+01 volume 0.71615E-03 ppm1 0.831 ppm2 4.595 CV 1
ASSI { 2443}
(( segid " " and resid 358 and name HA ))
(( segid " " and resid 358 and name HB3 ))
3.300 1.400 1.400 peak 2443 spectrum 1 weight 0.10000E+01 volume 0.12744E-02 ppm1 4.006 ppm2 2.957 CV 1
ASSI { 2985}
(( segid " " and resid 336 and name HB2 ))
(( segid " " and resid 336 and name HE3 ))
5.100 3.200 0.900 peak 2985 spectrum 1 weight 0.10000E+01 volume 0.97553E-03 ppm1 2.055 ppm2 2.862 CV 1
OR { 2985}
(( segid " " and resid 336 and name HB2 ))
(( segid " " and resid 336 and name HE2 ))
ASSI { 1674}
( segid " " and resid 360 and name HE% )
(( segid " " and resid 368 and name HZ ))
4.000 2.000 2.000 peak 1674 spectrum 1 weight 0.10000E+01 volume 0.44267E-03 ppm1 7.081 ppm2 6.301 CV 1
OR { 1674}
( segid " " and resid 360 and name HD% )
(( segid " " and resid 368 and name HZ ))
ASSI { 2853}
( segid " " and resid 323 and name HG2%)
( segid " " and resid 373 and name HD1%)
3.400 1.500 1.500 peak 2853 spectrum 1 weight 0.10000E+01 volume 0.48156E-02 ppm1 0.433 ppm2 -0.191 CV 1
ASSI { 3050}
(( segid " " and resid 228 and name HG2 ))
(( segid " " and resid 336 and name HG2 ))
3.200 1.300 1.300 peak 3050 spectrum 1 weight 0.10000E+01 volume 0.14661E-02 ppm1 2.084 ppm2 1.174 CV 1
ASSI { 2596}
( segid " " and resid 233 and name HG1%)
(( segid " " and resid 233 and name HA ))
2.600 0.800 0.800 peak 2596 spectrum 1 weight 0.10000E+01 volume 0.64962E-02 ppm1 0.871 ppm2 3.829 CV 1
ASSI { 4082}
(( segid " " and resid 317 and name HG ))
( segid " " and resid 209 and name HD2%)
5.200 3.400 0.800 peak 4082 spectrum 1 weight 0.10000E+01 volume 0.31860E-03 ppm1 0.403 ppm2 -0.891 CV 1
ASSI { 768}
(( segid " " and resid 256 and name HG2 ))
(( segid " " and resid 254 and name HB3 ))
5.100 3.200 0.900 peak 768 spectrum 1 weight 0.10000E+01 volume 0.47084E-03 ppm1 2.317 ppm2 2.944 CV 1
ASSI { 4086}
(( segid " " and resid 187 and name HD3 ))
(( segid " " and resid 188 and name HD2 ))
2.700 2.700 3.300 peak 4086 spectrum 1 weight 0.10000E+01 volume 0.80637E-03 ppm1 1.596 ppm2 3.475 CV 1
OR { 4086}
(( segid " " and resid 187 and name HD3 ))
(( segid " " and resid 188 and name HD3 ))
ASSI { 2661}
(( segid " " and resid 278 and name HB2 ))
(( segid " " and resid 278 and name HG ))
2.800 1.000 1.000 peak 2661 spectrum 1 weight 0.10000E+01 volume 0.14943E-02 ppm1 1.200 ppm2 1.698 CV 1
ASSI { 3208}
(( segid " " and resid 373 and name HB2 ))
(( segid " " and resid 373 and name H ))
3.300 1.300 1.300 peak 3208 spectrum 1 weight 0.10000E+01 volume 0.40600E-03 ppm1 0.434 ppm2 8.230 CV 1
ASSI { 1923}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 371 and name HA ))
2.800 0.900 0.900 peak 1923 spectrum 1 weight 0.10000E+01 volume 0.46774E-02 ppm1 0.365 ppm2 3.721 CV 1
ASSI { 1693}
(( segid " " and resid 281 and name HB2 ))
(( segid " " and resid 281 and name HA ))
2.600 0.800 0.800 peak 1693 spectrum 1 weight 0.10000E+01 volume 0.79819E-02 ppm1 1.758 ppm2 3.978 CV 1
ASSI { 1540}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 360 and name HZ ))
4.200 2.200 1.800 peak 1540 spectrum 1 weight 0.10000E+01 volume 0.21061E-02 ppm1 0.349 ppm2 6.641 CV 1
ASSI { 570}
(( segid " " and resid 373 and name HA ))
(( segid " " and resid 374 and name HB2 ))
5.200 3.400 0.800 peak 570 spectrum 1 weight 0.10000E+01 volume 0.49058E-03 ppm1 2.341 ppm2 1.621 CV 1
OR { 570}
(( segid " " and resid 373 and name HA ))
(( segid " " and resid 374 and name HD2 ))
OR { 570}
(( segid " " and resid 373 and name HA ))
(( segid " " and resid 374 and name HD3 ))
ASSI { 4581}
( segid " " and resid 263 and name HG2%)
( segid " " and resid 219 and name HE% )
3.900 1.900 1.900 peak 4581 spectrum 1 weight 0.10000E+01 volume 0.10150E-02 ppm1 0.811 ppm2 6.405 CV 1
ASSI { 2614}
( segid " " and resid 240 and name HG2%)
( segid " " and resid 240 and name HG1%)
2.300 0.600 0.600 peak 2614 spectrum 1 weight 0.10000E+01 volume 0.14047E-01 ppm1 0.774 ppm2 1.032 CV 1
ASSI { 1147}
( segid " " and resid 245 and name HB% )
(( segid " " and resid 248 and name HB2 ))
4.100 2.100 1.900 peak 1147 spectrum 1 weight 0.10000E+01 volume 0.14746E-02 ppm1 1.329 ppm2 2.511 CV 1
ASSI { 2428}
(( segid " " and resid 366 and name HG3 ))
( segid " " and resid 300 and name HG1%)
3.600 1.700 1.700 peak 2428 spectrum 1 weight 0.10000E+01 volume 0.96146E-03 ppm1 2.211 ppm2 0.071 CV 1
ASSI { 4818}
(( segid " " and resid 268 and name HG3 ))
(( segid " " and resid 268 and name HA ))
3.300 1.300 1.300 peak 4818 spectrum 1 weight 0.10000E+01 volume 0.27264E-02 ppm1 1.253 ppm2 3.695 CV 1
OR { 4818}
(( segid " " and resid 268 and name HG2 ))
(( segid " " and resid 268 and name HA ))
ASSI { 4311}
( segid " " and resid 391 and name HD2%)
(( segid " " and resid 438 and name H ))
4.900 3.000 1.100 peak 4311 spectrum 1 weight 0.10000E+01 volume 0.57234E-03 ppm1 0.536 ppm2 7.568 CV 1
ASSI { 3514}
(( segid " " and resid 259 and name HG2 ))
(( segid " " and resid 259 and name H ))
3.200 1.300 1.300 peak 3514 spectrum 1 weight 0.10000E+01 volume 0.12349E-02 ppm1 2.389 ppm2 8.459 CV 1
ASSI { 1894}
(( segid " " and resid 350 and name HB ))
( segid " " and resid 350 and name HG2%)
2.300 0.700 0.700 peak 1894 spectrum 1 weight 0.10000E+01 volume 0.47874E-02 ppm1 2.487 ppm2 0.715 CV 1
OR { 1894}
(( segid " " and resid 350 and name HB ))
( segid " " and resid 350 and name HG1%)
ASSI { 4161}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 395 and name HA ))
2.800 1.000 1.000 peak 4161 spectrum 1 weight 0.10000E+01 volume 0.30930E-02 ppm1 0.557 ppm2 3.759 CV 1
ASSI { 1397}
( segid " " and resid 310 and name HD2%)
( segid " " and resid 279 and name HD1%)
3.600 1.600 1.600 peak 1397 spectrum 1 weight 0.10000E+01 volume 0.26306E-02 ppm1 1.084 ppm2 0.164 CV 1
ASSI { 321}
(( segid " " and resid 272 and name HD2 ))
(( segid " " and resid 269 and name HE21))
3.800 1.800 1.800 peak 321 spectrum 1 weight 0.10000E+01 volume 0.16832E-02 ppm1 3.228 ppm2 8.095 CV 1
OR { 321}
(( segid " " and resid 272 and name HD3 ))
(( segid " " and resid 269 and name HE21))
ASSI { 3516}
(( segid " " and resid 202 and name HG3 ))
(( segid " " and resid 202 and name HB2 ))
2.800 1.000 1.000 peak 3516 spectrum 1 weight 0.10000E+01 volume 0.17396E-02 ppm1 2.771 ppm2 2.044 CV 1
ASSI { 3284}
( segid " " and resid 202 and name HE% )
(( segid " " and resid 208 and name HD2 ))
2.900 1.000 1.000 peak 3284 spectrum 1 weight 0.10000E+01 volume 0.38711E-02 ppm1 1.866 ppm2 3.085 CV 1
ASSI { 215}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 342 and name H ))
2.800 2.800 3.200 peak 215 spectrum 1 weight 0.10000E+01 volume 0.67948E-03 ppm1 1.006 ppm2 8.637 CV 1
ASSI { 3556}
(( segid " " and resid 299 and name HB2 ))
(( segid " " and resid 299 and name HA ))
3.300 1.400 1.400 peak 3556 spectrum 1 weight 0.10000E+01 volume 0.95864E-03 ppm1 1.465 ppm2 3.767 CV 1
ASSI { 1698}
(( segid " " and resid 299 and name HB3 ))
( segid " " and resid 359 and name HG2%)
3.800 1.800 1.800 peak 1698 spectrum 1 weight 0.10000E+01 volume 0.34680E-03 ppm1 1.724 ppm2 -0.459 CV 1
ASSI { 3698}
(( segid " " and resid 352 and name HB ))
(( segid " " and resid 352 and name HA ))
3.800 1.800 1.800 peak 3698 spectrum 1 weight 0.10000E+01 volume 0.44831E-03 ppm1 1.140 ppm2 4.163 CV 1
ASSI { 3013}
( segid " " and resid 212 and name HG2%)
( segid " " and resid 190 and name HD% )
5.100 3.300 0.900 peak 3013 spectrum 1 weight 0.10000E+01 volume 0.42011E-03 ppm1 -0.162 ppm2 7.870 CV 1
ASSI { 2834}
( segid " " and resid 385 and name HE% )
(( segid " " and resid 382 and name HD1 ))
4.400 2.400 1.600 peak 2834 spectrum 1 weight 0.10000E+01 volume 0.73589E-03 ppm1 1.911 ppm2 6.909 CV 1
ASSI { 1910}
(( segid " " and resid 226 and name HG3 ))
(( segid " " and resid 227 and name H ))
4.600 2.600 1.400 peak 1910 spectrum 1 weight 0.10000E+01 volume 0.77252E-03 ppm1 1.210 ppm2 7.124 CV 1
ASSI { 4644}
( segid " " and resid 306 and name HD1%)
( segid " " and resid 290 and name HB% )
3.400 1.400 1.400 peak 4644 spectrum 1 weight 0.10000E+01 volume 0.33044E-02 ppm1 0.379 ppm2 1.540 CV 1
ASSI { 4766}
(( segid " " and resid 282 and name HG3 ))
(( segid " " and resid 282 and name H ))
2.900 1.100 1.100 peak 4766 spectrum 1 weight 0.10000E+01 volume 0.30620E-02 ppm1 2.179 ppm2 8.694 CV 1
ASSI { 4580}
( segid " " and resid 325 and name HE% )
(( segid " " and resid 213 and name HZ ))
2.000 2.000 4.000 peak 4580 spectrum 1 weight 0.10000E+01 volume 0.48692E-02 ppm1 0.929 ppm2 6.323 CV 1
ASSI { 2167}
(( segid " " and resid 443 and name HA ))
( segid " " and resid 398 and name HD1%)
3.400 1.500 1.500 peak 2167 spectrum 1 weight 0.10000E+01 volume 0.80355E-03 ppm1 4.137 ppm2 0.549 CV 1
ASSI { 40}
( segid " " and resid 325 and name HE% )
( segid " " and resid 361 and name HE% )
4.400 2.400 1.600 peak 40 spectrum 1 weight 0.10000E+01 volume 0.18298E-02 ppm1 0.929 ppm2 7.090 CV 1
OR { 40}
( segid " " and resid 325 and name HE% )
( segid " " and resid 361 and name HD% )
ASSI { 4184}
(( segid " " and resid 392 and name HD2 ))
(( segid " " and resid 391 and name HB3 ))
3.200 1.300 1.300 peak 4184 spectrum 1 weight 0.10000E+01 volume 0.49622E-03 ppm1 3.168 ppm2 1.489 CV 1
ASSI { 2130}
(( segid " " and resid 403 and name HD3 ))
(( segid " " and resid 403 and name HA ))
3.600 1.600 1.600 peak 2130 spectrum 1 weight 0.10000E+01 volume 0.37611E-02 ppm1 3.236 ppm2 4.096 CV 1
OR { 2130}
(( segid " " and resid 403 and name HD2 ))
(( segid " " and resid 403 and name HA ))
ASSI { 2536}
(( segid " " and resid 425 and name HG3 ))
(( segid " " and resid 425 and name HB3 ))
2.800 1.000 1.000 peak 2536 spectrum 1 weight 0.10000E+01 volume 0.12208E-02 ppm1 1.239 ppm2 1.807 CV 1
ASSI { 2541}
(( segid " " and resid 202 and name HG2 ))
(( segid " " and resid 202 and name H ))
3.500 1.600 1.600 peak 2541 spectrum 1 weight 0.10000E+01 volume 0.12490E-02 ppm1 2.316 ppm2 8.194 CV 1
ASSI { 3625}
(( segid " " and resid 293 and name HD3 ))
( segid " " and resid 294 and name HG2%)
5.000 3.100 1.000 peak 3625 spectrum 1 weight 0.10000E+01 volume 0.72179E-03 ppm1 3.162 ppm2 1.214 CV 1
ASSI { 4215}
( segid " " and resid 364 and name HG1%)
(( segid " " and resid 326 and name HB2 ))
2.500 0.800 0.800 peak 4215 spectrum 1 weight 0.10000E+01 volume 0.31832E-02 ppm1 1.067 ppm2 2.866 CV 1
ASSI { 3493}
(( segid " " and resid 324 and name HB2 ))
( segid " " and resid 217 and name HD1%)
4.900 3.000 1.100 peak 3493 spectrum 1 weight 0.10000E+01 volume 0.25093E-03 ppm1 2.896 ppm2 -0.043 CV 1
ASSI { 2038}
(( segid " " and resid 342 and name HB ))
(( segid " " and resid 339 and name HA ))
3.300 1.300 1.300 peak 2038 spectrum 1 weight 0.10000E+01 volume 0.40600E-03 ppm1 1.714 ppm2 2.986 CV 1
ASSI { 4139}
(( segid " " and resid 286 and name HA ))
(( segid " " and resid 286 and name HD2 ))
4.200 2.200 1.800 peak 4139 spectrum 1 weight 0.10000E+01 volume 0.35809E-03 ppm1 4.114 ppm2 3.145 CV 1
ASSI { 2665}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 341 and name HB3 ))
3.300 1.400 1.400 peak 2665 spectrum 1 weight 0.10000E+01 volume 0.28308E-02 ppm1 0.658 ppm2 2.811 CV 1
OR { 2665}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 341 and name HB2 ))
ASSI { 2198}
( segid " " and resid 303 and name HD% )
(( segid " " and resid 303 and name HB3 ))
3.200 1.200 1.200 peak 2198 spectrum 1 weight 0.10000E+01 volume 0.69359E-03 ppm1 7.079 ppm2 2.597 CV 1
ASSI { 1239}
(( segid " " and resid 367 and name HA ))
(( segid " " and resid 304 and name HG3 ))
4.300 2.300 1.700 peak 1239 spectrum 1 weight 0.10000E+01 volume 0.12208E-02 ppm1 4.033 ppm2 2.274 CV 1
OR { 1239}
(( segid " " and resid 367 and name HA ))
(( segid " " and resid 304 and name HB2 ))
ASSI { 4275}
(( segid " " and resid 406 and name HA ))
(( segid " " and resid 406 and name H ))
3.700 1.700 1.700 peak 4275 spectrum 1 weight 0.10000E+01 volume 0.43703E-03 ppm1 4.086 ppm2 9.253 CV 1
ASSI { 1032}
( segid " " and resid 420 and name HD1%)
(( segid " " and resid 415 and name HB3 ))
3.200 1.200 1.200 peak 1032 spectrum 1 weight 0.10000E+01 volume 0.12321E-02 ppm1 0.770 ppm2 2.633 CV 1
ASSI { 2510}
(( segid " " and resid 400 and name HG3 ))
(( segid " " and resid 400 and name H ))
2.300 0.600 0.600 peak 2510 spectrum 1 weight 0.10000E+01 volume 0.63890E-02 ppm1 2.198 ppm2 7.993 CV 1
ASSI { 3272}
(( segid " " and resid 293 and name HD3 ))
(( segid " " and resid 293 and name HG3 ))
2.500 0.800 0.800 peak 3272 spectrum 1 weight 0.10000E+01 volume 0.27998E-02 ppm1 3.165 ppm2 2.018 CV 1
ASSI { 2566}
(( segid " " and resid 183 and name HG2 ))
(( segid " " and resid 184 and name HD2 ))
4.200 2.200 1.800 peak 2566 spectrum 1 weight 0.10000E+01 volume 0.16663E-02 ppm1 2.521 ppm2 3.635 CV 1
OR { 2566}
(( segid " " and resid 183 and name HG2 ))
(( segid " " and resid 184 and name HD3 ))
ASSI { 4712}
(( segid " " and resid 422 and name HB2 ))
(( segid " " and resid 422 and name HA ))
4.200 2.200 1.800 peak 4712 spectrum 1 weight 0.10000E+01 volume 0.29605E-03 ppm1 2.427 ppm2 4.568 CV 1
ASSI { 309}
( segid " " and resid 310 and name HD2%)
(( segid " " and resid 314 and name HD21))
3.800 1.800 1.800 peak 309 spectrum 1 weight 0.10000E+01 volume 0.12772E-02 ppm1 1.087 ppm2 7.348 CV 1
OR { 309}
( segid " " and resid 310 and name HD2%)
(( segid " " and resid 314 and name H ))
ASSI { 517}
( segid " " and resid 307 and name HD1%)
(( segid " " and resid 307 and name HB3 ))
3.000 1.200 1.200 peak 517 spectrum 1 weight 0.10000E+01 volume 0.22105E-02 ppm1 1.211 ppm2 1.631 CV 1
OR { 517}
( segid " " and resid 307 and name HD1%)
(( segid " " and resid 307 and name HB2 ))
ASSI { 3708}
(( segid " " and resid 410 and name HB3 ))
(( segid " " and resid 411 and name H ))
3.900 1.900 1.900 peak 3708 spectrum 1 weight 0.10000E+01 volume 0.11870E-02 ppm1 2.684 ppm2 7.713 CV 1
ASSI { 3440}
(( segid " " and resid 208 and name HA ))
(( segid " " and resid 208 and name H ))
3.700 1.700 1.700 peak 3440 spectrum 1 weight 0.10000E+01 volume 0.28195E-03 ppm1 3.864 ppm2 8.276 CV 1
ASSI { 3344}
(( segid " " and resid 356 and name HA ))
( segid " " and resid 359 and name HG1%)
2.500 0.800 0.800 peak 3344 spectrum 1 weight 0.10000E+01 volume 0.26447E-02 ppm1 3.625 ppm2 0.872 CV 1
ASSI { 3947}
( segid " " and resid 335 and name HG2%)
(( segid " " and resid 335 and name HB ))
2.400 0.700 0.700 peak 3947 spectrum 1 weight 0.10000E+01 volume 0.55545E-02 ppm1 1.248 ppm2 4.176 CV 1
OR { 3947}
( segid " " and resid 335 and name HG2%)
(( segid " " and resid 335 and name HA ))
ASSI { 2885}
(( segid " " and resid 304 and name HG2 ))
(( segid " " and resid 304 and name H ))
3.400 1.400 1.400 peak 2885 spectrum 1 weight 0.10000E+01 volume 0.24755E-02 ppm1 2.451 ppm2 8.674 CV 1
ASSI { 4043}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 317 and name H ))
3.500 1.500 1.500 peak 4043 spectrum 1 weight 0.10000E+01 volume 0.13336E-02 ppm1 0.187 ppm2 7.513 CV 1
ASSI { 1785}
(( segid " " and resid 379 and name HB3 ))
(( segid " " and resid 379 and name HD3 ))
3.900 1.900 1.900 peak 1785 spectrum 1 weight 0.10000E+01 volume 0.98399E-03 ppm1 1.615 ppm2 3.840 CV 1
ASSI { 3604}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 325 and name HG3 ))
2.700 0.900 0.900 peak 3604 spectrum 1 weight 0.10000E+01 volume 0.97553E-03 ppm1 0.514 ppm2 2.721 CV 1
ASSI { 2215}
( segid " " and resid 233 and name HG1%)
(( segid " " and resid 233 and name H ))
3.200 1.300 1.300 peak 2215 spectrum 1 weight 0.10000E+01 volume 0.32283E-02 ppm1 0.869 ppm2 7.988 CV 1
ASSI { 2306}
(( segid " " and resid 217 and name HG12))
(( segid " " and resid 217 and name HB ))
2.700 0.900 0.900 peak 2306 spectrum 1 weight 0.10000E+01 volume 0.10460E-02 ppm1 0.536 ppm2 1.633 CV 1
ASSI { 2501}
( segid " " and resid 230 and name HD1%)
( segid " " and resid 219 and name HE% )
4.700 2.700 1.300 peak 2501 spectrum 1 weight 0.10000E+01 volume 0.57234E-03 ppm1 0.648 ppm2 6.403 CV 1
ASSI { 43}
(( segid " " and resid 312 and name HA ))
(( segid " " and resid 315 and name HB2 ))
3.900 1.900 1.900 peak 43 spectrum 1 weight 0.10000E+01 volume 0.65131E-03 ppm1 4.035 ppm2 3.097 CV 1
ASSI { 1356}
( segid " " and resid 349 and name HG2%)
(( segid " " and resid 350 and name H ))
3.400 1.400 1.400 peak 1356 spectrum 1 weight 0.10000E+01 volume 0.17932E-02 ppm1 1.252 ppm2 7.644 CV 1
ASSI { 1308}
( segid " " and resid 342 and name HG2%)
( segid " " and resid 322 and name HD1%)
4.700 2.700 1.300 peak 1308 spectrum 1 weight 0.10000E+01 volume 0.78381E-03 ppm1 0.516 ppm2 -0.162 CV 1
ASSI { 4229}
(( segid " " and resid 241 and name HA ))
(( segid " " and resid 241 and name HB3 ))
3.400 1.400 1.400 peak 4229 spectrum 1 weight 0.10000E+01 volume 0.13844E-02 ppm1 4.122 ppm2 2.586 CV 1
ASSI { 4259}
(( segid " " and resid 419 and name HA2 ))
(( segid " " and resid 420 and name HG13))
5.500 3.800 0.500 peak 4259 spectrum 1 weight 0.10000E+01 volume 0.27913E-03 ppm1 3.787 ppm2 1.347 CV 1
ASSI { 3019}
(( segid " " and resid 257 and name HB2 ))
(( segid " " and resid 258 and name H ))
5.500 3.800 0.500 peak 3019 spectrum 1 weight 0.10000E+01 volume 0.29323E-03 ppm1 2.436 ppm2 8.115 CV 1
ASSI { 1439}
( segid " " and resid 245 and name HB% )
( segid " " and resid 243 and name HD2%)
5.800 4.100 0.200 peak 1439 spectrum 1 weight 0.10000E+01 volume 0.36652E-03 ppm1 1.330 ppm2 0.182 CV 1
ASSI { 1222}
( segid " " and resid 253 and name HG2%)
( segid " " and resid 247 and name HD% )
2.400 2.400 3.600 peak 1222 spectrum 1 weight 0.10000E+01 volume 0.18863E-02 ppm1 0.614 ppm2 7.332 CV 1
ASSI { 3381}
( segid " " and resid 202 and name HE% )
(( segid " " and resid 206 and name HA3 ))
2.900 1.000 1.000 peak 3381 spectrum 1 weight 0.10000E+01 volume 0.12947E-01 ppm1 1.868 ppm2 3.830 CV 1
ASSI { 2194}
( segid " " and resid 263 and name HG2%)
(( segid " " and resid 263 and name H ))
2.700 0.900 0.900 peak 2194 spectrum 1 weight 0.10000E+01 volume 0.17960E-02 ppm1 0.806 ppm2 7.116 CV 1
ASSI { 4068}
( segid " " and resid 358 and name HE% )
(( segid " " and resid 340 and name HG2 ))
2.700 2.700 3.300 peak 4068 spectrum 1 weight 0.10000E+01 volume 0.88249E-03 ppm1 6.700 ppm2 2.320 CV 1
OR { 4068}
( segid " " and resid 358 and name HE% )
(( segid " " and resid 340 and name HG3 ))
ASSI { 1809}
( segid " " and resid 367 and name HD1%)
(( segid " " and resid 368 and name H ))
2.700 2.700 3.300 peak 1809 spectrum 1 weight 0.10000E+01 volume 0.95018E-03 ppm1 0.663 ppm2 8.198 CV 1
ASSI { 4561}
(( segid " " and resid 426 and name HG2 ))
(( segid " " and resid 426 and name HA ))
2.800 1.000 1.000 peak 4561 spectrum 1 weight 0.10000E+01 volume 0.18186E-02 ppm1 2.260 ppm2 3.684 CV 1
ASSI { 3593}
( segid " " and resid 280 and name HG2%)
(( segid " " and resid 280 and name HB ))
2.400 0.700 0.700 peak 3593 spectrum 1 weight 0.10000E+01 volume 0.46999E-02 ppm1 1.132 ppm2 4.543 CV 1
ASSI { 3786}
( segid " " and resid 233 and name HG1%)
(( segid " " and resid 233 and name HB ))
2.200 0.600 0.600 peak 3786 spectrum 1 weight 0.10000E+01 volume 0.11230E-01 ppm1 0.869 ppm2 1.774 CV 1
ASSI { 1612}
( segid " " and resid 335 and name HG2%)
(( segid " " and resid 335 and name HG1 ))
2.800 1.000 1.000 peak 1612 spectrum 1 weight 0.10000E+01 volume 0.25460E-02 ppm1 1.247 ppm2 3.550 CV 1
ASSI { 3701}
(( segid " " and resid 336 and name HD2 ))
(( segid " " and resid 336 and name HE3 ))
2.400 0.700 0.700 peak 3701 spectrum 1 weight 0.10000E+01 volume 0.84332E-02 ppm1 1.464 ppm2 2.863 CV 1
OR { 3701}
(( segid " " and resid 336 and name HD2 ))
(( segid " " and resid 336 and name HE2 ))
ASSI { 3354}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 217 and name HB ))
2.400 0.700 0.700 peak 3354 spectrum 1 weight 0.10000E+01 volume 0.50158E-02 ppm1 -0.047 ppm2 1.624 CV 1
ASSI { 2901}
(( segid " " and resid 421 and name HG2 ))
(( segid " " and resid 422 and name H ))
5.000 3.100 1.000 peak 2901 spectrum 1 weight 0.10000E+01 volume 0.10291E-02 ppm1 1.286 ppm2 8.192 CV 1
ASSI { 1895}
(( segid " " and resid 225 and name HG3 ))
(( segid " " and resid 225 and name HA ))
4.700 2.700 1.300 peak 1895 spectrum 1 weight 0.10000E+01 volume 0.41447E-03 ppm1 2.674 ppm2 4.363 CV 1
ASSI { 3961}
(( segid " " and resid 444 and name HB3 ))
(( segid " " and resid 444 and name HA ))
2.200 0.600 0.600 peak 3961 spectrum 1 weight 0.10000E+01 volume 0.72292E-02 ppm1 1.757 ppm2 4.234 CV 1
ASSI { 4410}
(( segid " " and resid 374 and name HB2 ))
( segid " " and resid 207 and name HD1%)
2.900 1.000 1.000 peak 4410 spectrum 1 weight 0.10000E+01 volume 0.23289E-02 ppm1 1.624 ppm2 0.881 CV 1
ASSI { 1849}
(( segid " " and resid 306 and name HB3 ))
(( segid " " and resid 306 and name H ))
4.700 2.800 1.300 peak 1849 spectrum 1 weight 0.10000E+01 volume 0.27631E-03 ppm1 0.249 ppm2 8.021 CV 1
ASSI { 3107}
(( segid " " and resid 208 and name HD2 ))
( segid " " and resid 198 and name HG1%)
3.100 1.200 1.200 peak 3107 spectrum 1 weight 0.10000E+01 volume 0.28674E-02 ppm1 3.076 ppm2 0.601 CV 1
OR { 3107}
(( segid " " and resid 208 and name HD2 ))
( segid " " and resid 198 and name HG2%)
ASSI { 3714}
( segid " " and resid 243 and name HD2%)
( segid " " and resid 243 and name HD1%)
2.200 0.600 0.600 peak 3714 spectrum 1 weight 0.10000E+01 volume 0.12569E-01 ppm1 0.166 ppm2 0.014 CV 1
ASSI { 4360}
( segid " " and resid 438 and name HB% )
(( segid " " and resid 439 and name HB2 ))
4.200 2.200 1.800 peak 4360 spectrum 1 weight 0.10000E+01 volume 0.12208E-02 ppm1 1.602 ppm2 2.222 CV 1
ASSI { 3722}
( segid " " and resid 267 and name HD1%)
(( segid " " and resid 216 and name H ))
3.100 1.200 1.200 peak 3722 spectrum 1 weight 0.10000E+01 volume 0.31550E-02 ppm1 0.916 ppm2 7.640 CV 1
ASSI { 4809}
(( segid " " and resid 403 and name HB2 ))
(( segid " " and resid 403 and name HD2 ))
3.300 1.300 1.300 peak 4809 spectrum 1 weight 0.10000E+01 volume 0.15112E-02 ppm1 2.023 ppm2 3.234 CV 1
OR { 4809}
(( segid " " and resid 403 and name HB2 ))
(( segid " " and resid 403 and name HD3 ))
ASSI { 3265}
(( segid " " and resid 392 and name HA ))
(( segid " " and resid 393 and name H ))
3.200 1.300 1.300 peak 3265 spectrum 1 weight 0.10000E+01 volume 0.79791E-03 ppm1 4.298 ppm2 8.251 CV 1
ASSI { 2511}
(( segid " " and resid 437 and name HA ))
(( segid " " and resid 440 and name HG3 ))
3.700 1.700 1.700 peak 2511 spectrum 1 weight 0.10000E+01 volume 0.58644E-03 ppm1 3.784 ppm2 1.350 CV 1
OR { 2511}
(( segid " " and resid 437 and name HA ))
(( segid " " and resid 440 and name HG2 ))
ASSI { 4625}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 337 and name HA ))
4.600 2.700 1.400 peak 4625 spectrum 1 weight 0.10000E+01 volume 0.10855E-02 ppm1 1.799 ppm2 4.986 CV 1
ASSI { 3380}
(( segid " " and resid 331 and name HB2 ))
(( segid " " and resid 331 and name H ))
3.300 1.400 1.400 peak 3380 spectrum 1 weight 0.10000E+01 volume 0.39190E-03 ppm1 2.539 ppm2 7.170 CV 1
ASSI { 4246}
( segid " " and resid 345 and name HG2%)
(( segid " " and resid 345 and name HA ))
2.800 1.000 1.000 peak 4246 spectrum 1 weight 0.10000E+01 volume 0.92366E-02 ppm1 0.919 ppm2 3.996 CV 1
ASSI { 2988}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 278 and name HG ))
3.400 1.500 1.500 peak 2988 spectrum 1 weight 0.10000E+01 volume 0.24078E-02 ppm1 0.379 ppm2 1.719 CV 1
ASSI { 4457}
(( segid " " and resid 318 and name HG13))
(( segid " " and resid 322 and name HG13))
2.500 0.800 0.800 peak 4457 spectrum 1 weight 0.10000E+01 volume 0.25883E-02 ppm1 0.611 ppm2 0.168 CV 1
ASSI { 2192}
(( segid " " and resid 399 and name HG3 ))
(( segid " " and resid 399 and name HE3 ))
3.400 1.500 1.500 peak 2192 spectrum 1 weight 0.10000E+01 volume 0.18439E-02 ppm1 1.639 ppm2 2.854 CV 1
OR { 2192}
(( segid " " and resid 399 and name HG3 ))
(( segid " " and resid 399 and name HE2 ))
ASSI { 3705}
( segid " " and resid 190 and name HD% )
( segid " " and resid 190 and name HE% )
3.700 1.700 1.700 peak 3705 spectrum 1 weight 0.10000E+01 volume 0.32706E-03 ppm1 7.859 ppm2 7.153 CV 1
ASSI { 2810}
(( segid " " and resid 435 and name HA ))
( segid " " and resid 435 and name HD1%)
3.000 1.100 1.100 peak 2810 spectrum 1 weight 0.10000E+01 volume 0.15366E-02 ppm1 3.862 ppm2 0.883 CV 1
OR { 2810}
(( segid " " and resid 435 and name HA ))
( segid " " and resid 435 and name HG2%)
ASSI { 2963}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 339 and name H ))
3.800 1.800 1.800 peak 2963 spectrum 1 weight 0.10000E+01 volume 0.18411E-02 ppm1 0.749 ppm2 8.367 CV 1
ASSI { 4359}
( segid " " and resid 344 and name HD1%)
(( segid " " and resid 340 and name HE22))
3.200 1.300 1.300 peak 4359 spectrum 1 weight 0.10000E+01 volume 0.89941E-03 ppm1 0.818 ppm2 7.410 CV 1
ASSI { 2668}
( segid " " and resid 367 and name HD2%)
(( segid " " and resid 368 and name H ))
4.400 2.400 1.600 peak 2668 spectrum 1 weight 0.10000E+01 volume 0.17340E-02 ppm1 0.784 ppm2 8.209 CV 1
ASSI { 3424}
(( segid " " and resid 222 and name HE3 ))
(( segid " " and resid 222 and name HG2 ))
2.100 0.500 0.500 peak 3424 spectrum 1 weight 0.10000E+01 volume 0.11602E-01 ppm1 2.683 ppm2 0.387 CV 1
OR { 3424}
(( segid " " and resid 222 and name HE2 ))
(( segid " " and resid 222 and name HG2 ))
ASSI { 1989}
(( segid " " and resid 293 and name HG3 ))
(( segid " " and resid 293 and name HA ))
4.200 2.200 1.800 peak 1989 spectrum 1 weight 0.10000E+01 volume 0.71615E-03 ppm1 2.023 ppm2 4.291 CV 1
ASSI { 906}
(( segid " " and resid 333 and name HB2 ))
( segid " " and resid 333 and name HD1%)
2.100 0.500 0.500 peak 906 spectrum 1 weight 0.10000E+01 volume 0.24575E-01 ppm1 1.619 ppm2 0.854 CV 1
OR { 906}
(( segid " " and resid 333 and name HB2 ))
( segid " " and resid 333 and name HD2%)
ASSI { 797}
( segid " " and resid 376 and name HG2%)
(( segid " " and resid 377 and name H ))
3.100 1.200 1.200 peak 797 spectrum 1 weight 0.10000E+01 volume 0.30620E-02 ppm1 0.895 ppm2 8.229 CV 1
ASSI { 2520}
(( segid " " and resid 305 and name HD3 ))
( segid " " and resid 306 and name HD1%)
2.200 0.600 0.600 peak 2520 spectrum 1 weight 0.10000E+01 volume 0.36426E-02 ppm1 3.037 ppm2 0.380 CV 1
ASSI { 1077}
(( segid " " and resid 334 and name HG2 ))
( segid " " and resid 335 and name HG2%)
3.300 1.400 1.400 peak 1077 spectrum 1 weight 0.10000E+01 volume 0.22443E-02 ppm1 2.196 ppm2 1.237 CV 1
ASSI { 1835}
( segid " " and resid 230 and name HD1%)
(( segid " " and resid 230 and name HA ))
2.300 0.700 0.700 peak 1835 spectrum 1 weight 0.10000E+01 volume 0.41249E-02 ppm1 0.650 ppm2 3.899 CV 1
ASSI { 3153}
(( segid " " and resid 393 and name HG2 ))
(( segid " " and resid 393 and name H ))
3.700 1.700 1.700 peak 3153 spectrum 1 weight 0.10000E+01 volume 0.22415E-02 ppm1 2.161 ppm2 8.264 CV 1
ASSI { 210}
( segid " " and resid 373 and name HD2%)
(( segid " " and resid 323 and name HB ))
3.400 1.500 1.500 peak 210 spectrum 1 weight 0.10000E+01 volume 0.88531E-03 ppm1 0.515 ppm2 1.719 CV 1
ASSI { 2484}
( segid " " and resid 398 and name HG2%)
( segid " " and resid 398 and name HD1%)
2.200 0.600 0.600 peak 2484 spectrum 1 weight 0.10000E+01 volume 0.86814E-02 ppm1 0.807 ppm2 0.564 CV 1
OR { 2484}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 398 and name HG12))
ASSI { 3504}
(( segid " " and resid 286 and name HA ))
( segid " " and resid 306 and name HD2%)
4.900 3.000 1.100 peak 3504 spectrum 1 weight 0.10000E+01 volume 0.49904E-03 ppm1 4.105 ppm2 -0.357 CV 1
ASSI { 2816}
( segid " " and resid 362 and name HG2%)
(( segid " " and resid 363 and name H ))
3.900 1.900 1.900 peak 2816 spectrum 1 weight 0.10000E+01 volume 0.23515E-02 ppm1 0.561 ppm2 7.273 CV 1
ASSI { 4582}
(( segid " " and resid 258 and name HA ))
( segid " " and resid 258 and name HD% )
3.800 1.800 1.800 peak 4582 spectrum 1 weight 0.10000E+01 volume 0.83457E-03 ppm1 4.397 ppm2 7.127 CV 1
ASSI { 3589}
(( segid " " and resid 291 and name HA ))
(( segid " " and resid 291 and name HB3 ))
3.600 1.600 1.600 peak 3589 spectrum 1 weight 0.10000E+01 volume 0.12547E-02 ppm1 3.956 ppm2 3.089 CV 1
ASSI { 3427}
( segid " " and resid 233 and name HG2%)
(( segid " " and resid 232 and name H ))
3.900 1.900 1.900 peak 3427 spectrum 1 weight 0.10000E+01 volume 0.22584E-02 ppm1 0.948 ppm2 8.783 CV 1
ASSI { 4500}
(( segid " " and resid 348 and name HB3 ))
(( segid " " and resid 348 and name HA ))
2.900 1.000 1.000 peak 4500 spectrum 1 weight 0.10000E+01 volume 0.15310E-02 ppm1 2.237 ppm2 4.517 CV 1
ASSI { 4440}
(( segid " " and resid 328 and name HA ))
(( segid " " and resid 328 and name HB ))
3.700 1.700 1.700 peak 4440 spectrum 1 weight 0.10000E+01 volume 0.41447E-03 ppm1 3.435 ppm2 2.390 CV 1
ASSI { 2452}
(( segid " " and resid 425 and name HB3 ))
(( segid " " and resid 426 and name H ))
3.900 1.900 1.900 peak 2452 spectrum 1 weight 0.10000E+01 volume 0.81765E-03 ppm1 1.852 ppm2 7.991 CV 1
ASSI { 3075}
(( segid " " and resid 331 and name HE3 ))
(( segid " " and resid 334 and name H ))
4.800 2.900 1.200 peak 3075 spectrum 1 weight 0.10000E+01 volume 0.68794E-03 ppm1 2.860 ppm2 8.119 CV 1
ASSI { 3864}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 318 and name H ))
3.900 1.900 1.900 peak 3864 spectrum 1 weight 0.10000E+01 volume 0.29717E-02 ppm1 0.378 ppm2 8.038 CV 1
ASSI { 4027}
(( segid " " and resid 336 and name HB3 ))
(( segid " " and resid 336 and name HG2 ))
3.500 1.600 1.600 peak 4027 spectrum 1 weight 0.10000E+01 volume 0.14831E-02 ppm1 1.986 ppm2 1.165 CV 1
ASSI { 1795}
(( segid " " and resid 284 and name HG3 ))
( segid " " and resid 352 and name HG2%)
3.600 1.700 1.700 peak 1795 spectrum 1 weight 0.10000E+01 volume 0.14520E-02 ppm1 2.588 ppm2 0.918 CV 1
OR { 1795}
(( segid " " and resid 284 and name HG2 ))
( segid " " and resid 352 and name HG2%)
ASSI { 4109}
(( segid " " and resid 419 and name HA2 ))
(( segid " " and resid 419 and name HA3 ))
2.000 0.500 0.500 peak 4109 spectrum 1 weight 0.10000E+01 volume 0.63580E-02 ppm1 3.781 ppm2 3.988 CV 1
ASSI { 1772}
(( segid " " and resid 348 and name HG2 ))
(( segid " " and resid 348 and name HD3 ))
3.000 1.200 1.200 peak 1772 spectrum 1 weight 0.10000E+01 volume 0.20526E-02 ppm1 2.050 ppm2 3.741 CV 1
ASSI { 2393}
(( segid " " and resid 284 and name HG3 ))
( segid " " and resid 284 and name HE% )
2.100 0.500 0.500 peak 2393 spectrum 1 weight 0.10000E+01 volume 0.14808E-01 ppm1 2.587 ppm2 2.177 CV 1
OR { 2393}
(( segid " " and resid 284 and name HG2 ))
( segid " " and resid 284 and name HE% )
ASSI { 4016}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 213 and name HB2 ))
5.000 3.200 1.000 peak 4016 spectrum 1 weight 0.10000E+01 volume 0.41165E-03 ppm1 -0.906 ppm2 2.260 CV 1
ASSI { 1237}
( segid " " and resid 423 and name HD1%)
(( segid " " and resid 427 and name HG3 ))
2.200 0.600 0.600 peak 1237 spectrum 1 weight 0.10000E+01 volume 0.57714E-02 ppm1 0.884 ppm2 2.341 CV 1
ASSI { 4020}
( segid " " and resid 329 and name HD1%)
(( segid " " and resid 326 and name HB3 ))
6.000 4.700 0.000 peak 4020 spectrum 1 weight 0.10000E+01 volume 0.50751E-03 ppm1 0.123 ppm2 2.676 CV 1
ASSI { 3369}
(( segid " " and resid 303 and name HB3 ))
(( segid " " and resid 303 and name HA ))
3.400 1.400 1.400 peak 3369 spectrum 1 weight 0.10000E+01 volume 0.50751E-03 ppm1 2.592 ppm2 3.822 CV 1
ASSI { 4321}
( segid " " and resid 409 and name HD2%)
(( segid " " and resid 433 and name HE22))
4.200 2.200 1.800 peak 4321 spectrum 1 weight 0.10000E+01 volume 0.13308E-02 ppm1 0.741 ppm2 6.715 CV 1
ASSI { 3201}
(( segid " " and resid 342 and name HA ))
(( segid " " and resid 342 and name H ))
3.100 1.200 1.200 peak 3201 spectrum 1 weight 0.10000E+01 volume 0.65978E-03 ppm1 3.921 ppm2 8.634 CV 1
ASSI { 2015}
(( segid " " and resid 244 and name HA ))
(( segid " " and resid 244 and name HG3 ))
4.000 2.000 2.000 peak 2015 spectrum 1 weight 0.10000E+01 volume 0.35244E-03 ppm1 3.284 ppm2 -0.531 CV 1
ASSI { 1188}
(( segid " " and resid 358 and name HB3 ))
( segid " " and resid 359 and name HG1%)
4.700 2.700 1.300 peak 1188 spectrum 1 weight 0.10000E+01 volume 0.70205E-03 ppm1 2.956 ppm2 0.889 CV 1
ASSI { 3821}
(( segid " " and resid 297 and name HB ))
( segid " " and resid 297 and name HG2%)
2.000 0.500 0.500 peak 3821 spectrum 1 weight 0.10000E+01 volume 0.17802E-01 ppm1 3.941 ppm2 1.118 CV 1
ASSI { 2241}
( segid " " and resid 362 and name HG2%)
(( segid " " and resid 362 and name HA ))
2.500 0.800 0.800 peak 2241 spectrum 1 weight 0.10000E+01 volume 0.90167E-02 ppm1 0.561 ppm2 4.064 CV 1
ASSI { 4774}
(( segid " " and resid 345 and name HB ))
(( segid " " and resid 345 and name HA ))
2.700 0.900 0.900 peak 4774 spectrum 1 weight 0.10000E+01 volume 0.24191E-02 ppm1 2.139 ppm2 3.994 CV 1
ASSI { 3029}
( segid " " and resid 346 and name HD2%)
( segid " " and resid 322 and name HD1%)
2.700 0.900 0.900 peak 3029 spectrum 1 weight 0.10000E+01 volume 0.32791E-02 ppm1 0.749 ppm2 -0.165 CV 1
ASSI { 3248}
(( segid " " and resid 305 and name HB2 ))
(( segid " " and resid 306 and name H ))
2.600 0.800 0.800 peak 3248 spectrum 1 weight 0.10000E+01 volume 0.23007E-02 ppm1 1.834 ppm2 8.014 CV 1
OR { 3248}
(( segid " " and resid 305 and name HB3 ))
(( segid " " and resid 306 and name H ))
ASSI { 1423}
( segid " " and resid 391 and name HD2%)
(( segid " " and resid 442 and name HE2 ))
4.600 2.600 1.400 peak 1423 spectrum 1 weight 0.10000E+01 volume 0.10263E-02 ppm1 0.536 ppm2 2.875 CV 1
OR { 1423}
( segid " " and resid 391 and name HD2%)
(( segid " " and resid 442 and name HE3 ))
ASSI { 1460}
(( segid " " and resid 340 and name HG3 ))
(( segid " " and resid 341 and name HA ))
4.200 2.200 1.800 peak 1460 spectrum 1 weight 0.10000E+01 volume 0.16861E-02 ppm1 2.317 ppm2 4.405 CV 1
OR { 1460}
(( segid " " and resid 340 and name HG2 ))
(( segid " " and resid 341 and name HA ))
ASSI { 214}
( segid " " and resid 189 and name HD1%)
(( segid " " and resid 200 and name HB2 ))
2.900 1.000 1.000 peak 214 spectrum 1 weight 0.10000E+01 volume 0.26136E-02 ppm1 0.736 ppm2 2.071 CV 1
OR { 214}
( segid " " and resid 189 and name HD1%)
(( segid " " and resid 200 and name HB3 ))
ASSI { 3179}
(( segid " " and resid 400 and name HG3 ))
(( segid " " and resid 400 and name HA ))
2.700 0.900 0.900 peak 3179 spectrum 1 weight 0.10000E+01 volume 0.93918E-02 ppm1 2.198 ppm2 3.914 CV 1
ASSI { 4750}
( segid " " and resid 212 and name HG1%)
(( segid " " and resid 213 and name HA ))
3.700 1.800 1.800 peak 4750 spectrum 1 weight 0.10000E+01 volume 0.69077E-03 ppm1 -0.343 ppm2 3.595 CV 1
ASSI { 1060}
(( segid " " and resid 302 and name HA ))
(( segid " " and resid 305 and name H ))
3.800 1.800 1.800 peak 1060 spectrum 1 weight 0.10000E+01 volume 0.43421E-03 ppm1 4.315 ppm2 7.505 CV 1
ASSI { 4066}
(( segid " " and resid 185 and name HB2 ))
(( segid " " and resid 186 and name H ))
4.600 2.600 1.400 peak 4066 spectrum 1 weight 0.10000E+01 volume 0.67666E-03 ppm1 2.756 ppm2 8.045 CV 1
ASSI { 1677}
(( segid " " and resid 383 and name HB2 ))
( segid " " and resid 386 and name HB% )
3.300 1.300 1.300 peak 1677 spectrum 1 weight 0.10000E+01 volume 0.16691E-02 ppm1 3.857 ppm2 1.448 CV 1
ASSI { 2255}
( segid " " and resid 212 and name HG2%)
( segid " " and resid 247 and name HD% )
3.500 1.600 1.600 peak 2255 spectrum 1 weight 0.10000E+01 volume 0.13928E-02 ppm1 -0.168 ppm2 7.319 CV 1
ASSI { 1484}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 398 and name HB ))
2.400 0.700 0.700 peak 1484 spectrum 1 weight 0.10000E+01 volume 0.63270E-02 ppm1 0.558 ppm2 1.807 CV 1
ASSI { 4758}
(( segid " " and resid 185 and name HB3 ))
(( segid " " and resid 185 and name HA ))
2.900 1.000 1.000 peak 4758 spectrum 1 weight 0.10000E+01 volume 0.44041E-02 ppm1 2.654 ppm2 4.567 CV 1
ASSI { 4140}
(( segid " " and resid 336 and name HG2 ))
(( segid " " and resid 336 and name HA ))
3.700 1.700 1.700 peak 4140 spectrum 1 weight 0.10000E+01 volume 0.15930E-02 ppm1 1.164 ppm2 3.965 CV 1
ASSI { 2634}
( segid " " and resid 388 and name HE% )
(( segid " " and resid 382 and name HH2 ))
2.800 1.000 1.000 peak 2634 spectrum 1 weight 0.10000E+01 volume 0.38683E-02 ppm1 1.849 ppm2 7.167 CV 1
ASSI { 4460}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 398 and name H ))
4.000 2.000 2.000 peak 4460 spectrum 1 weight 0.10000E+01 volume 0.21174E-02 ppm1 0.807 ppm2 8.691 CV 1
ASSI { 3125}
( segid " " and resid 189 and name HG2%)
( segid " " and resid 212 and name HG1%)
3.300 1.400 1.400 peak 3125 spectrum 1 weight 0.10000E+01 volume 0.25291E-02 ppm1 0.941 ppm2 -0.341 CV 1
ASSI { 3620}
( segid " " and resid 243 and name HD2%)
(( segid " " and resid 243 and name H ))
3.800 1.800 1.800 peak 3620 spectrum 1 weight 0.10000E+01 volume 0.21710E-02 ppm1 0.165 ppm2 7.858 CV 1
ASSI { 2917}
(( segid " " and resid 185 and name HB2 ))
(( segid " " and resid 186 and name HB3 ))
5.400 3.600 0.600 peak 2917 spectrum 1 weight 0.10000E+01 volume 0.99245E-03 ppm1 2.755 ppm2 1.527 CV 1
OR { 2917}
(( segid " " and resid 185 and name HB2 ))
(( segid " " and resid 186 and name HB2 ))
ASSI { 2544}
(( segid " " and resid 403 and name HG2 ))
(( segid " " and resid 403 and name HD3 ))
2.200 0.600 0.600 peak 2544 spectrum 1 weight 0.10000E+01 volume 0.69246E-02 ppm1 1.621 ppm2 3.235 CV 1
OR { 2544}
(( segid " " and resid 403 and name HG2 ))
(( segid " " and resid 403 and name HD2 ))
ASSI { 2236}
(( segid " " and resid 351 and name HG2 ))
(( segid " " and resid 351 and name HA ))
3.300 1.400 1.400 peak 2236 spectrum 1 weight 0.10000E+01 volume 0.30253E-02 ppm1 2.169 ppm2 3.826 CV 1
ASSI { 3846}
( segid " " and resid 267 and name HD1%)
(( segid " " and resid 213 and name H ))
2.900 2.900 3.100 peak 3846 spectrum 1 weight 0.10000E+01 volume 0.62593E-03 ppm1 0.921 ppm2 5.881 CV 1
ASSI { 3269}
( segid " " and resid 352 and name HG2%)
(( segid " " and resid 352 and name HA ))
2.700 0.900 0.900 peak 3269 spectrum 1 weight 0.10000E+01 volume 0.28646E-02 ppm1 0.921 ppm2 4.155 CV 1
ASSI { 2721}
(( segid " " and resid 217 and name HG12))
( segid " " and resid 217 and name HD1%)
2.700 0.900 0.900 peak 2721 spectrum 1 weight 0.10000E+01 volume 0.16973E-02 ppm1 0.504 ppm2 -0.049 CV 1
OR { 2721}
(( segid " " and resid 217 and name HG13))
( segid " " and resid 217 and name HD1%)
ASSI { 3279}
(( segid " " and resid 286 and name HA ))
( segid " " and resid 306 and name HD1%)
4.800 2.900 1.200 peak 3279 spectrum 1 weight 0.10000E+01 volume 0.67948E-03 ppm1 4.112 ppm2 0.379 CV 1
ASSI { 3217}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 352 and name HB ))
2.500 0.800 0.800 peak 3217 spectrum 1 weight 0.10000E+01 volume 0.33044E-02 ppm1 0.603 ppm2 1.138 CV 1
ASSI { 3926}
(( segid " " and resid 226 and name HB2 ))
(( segid " " and resid 226 and name HA ))
3.100 1.200 1.200 peak 3926 spectrum 1 weight 0.10000E+01 volume 0.26616E-02 ppm1 1.504 ppm2 4.383 CV 1
ASSI { 3213}
( segid " " and resid 333 and name HD2%)
(( segid " " and resid 333 and name H ))
3.300 1.400 1.400 peak 3213 spectrum 1 weight 0.10000E+01 volume 0.57460E-02 ppm1 0.844 ppm2 8.635 CV 1
ASSI { 3129}
(( segid " " and resid 437 and name HA ))
(( segid " " and resid 438 and name H ))
3.900 1.900 1.900 peak 3129 spectrum 1 weight 0.10000E+01 volume 0.70205E-03 ppm1 3.789 ppm2 7.598 CV 1
ASSI { 1141}
(( segid " " and resid 239 and name HD2 ))
( segid " " and resid 243 and name HD2%)
5.200 3.300 0.800 peak 1141 spectrum 1 weight 0.10000E+01 volume 0.39190E-03 ppm1 1.755 ppm2 0.163 CV 1
ASSI { 3650}
( segid " " and resid 212 and name HG2%)
( segid " " and resid 247 and name HE% )
3.300 1.400 1.400 peak 3650 spectrum 1 weight 0.10000E+01 volume 0.15338E-02 ppm1 -0.168 ppm2 6.474 CV 1
ASSI { 4250}
(( segid " " and resid 344 and name HB ))
(( segid " " and resid 344 and name HG12))
3.200 1.300 1.300 peak 4250 spectrum 1 weight 0.10000E+01 volume 0.20131E-02 ppm1 1.890 ppm2 1.666 CV 1
ASSI { 3845}
(( segid " " and resid 296 and name HB2 ))
( segid " " and resid 300 and name HG1%)
5.400 3.600 0.600 peak 3845 spectrum 1 weight 0.10000E+01 volume 0.37780E-03 ppm1 2.087 ppm2 0.072 CV 1
ASSI { 2485}
(( segid " " and resid 251 and name HG2 ))
(( segid " " and resid 251 and name HB3 ))
2.500 0.800 0.800 peak 2485 spectrum 1 weight 0.10000E+01 volume 0.50497E-02 ppm1 2.180 ppm2 1.589 CV 1
ASSI { 1493}
( segid " " and resid 283 and name HD1%)
( segid " " and resid 306 and name HD1%)
1.900 0.400 0.400 peak 1493 spectrum 1 weight 0.10000E+01 volume 0.10415E-01 ppm1 0.718 ppm2 0.374 CV 1
ASSI { 2448}
( segid " " and resid 438 and name HB% )
(( segid " " and resid 438 and name HA ))
2.300 0.700 0.700 peak 2448 spectrum 1 weight 0.10000E+01 volume 0.79622E-02 ppm1 1.599 ppm2 4.085 CV 1
ASSI { 2889}
( segid " " and resid 219 and name HE% )
( segid " " and resid 263 and name HG1%)
4.400 2.400 1.600 peak 2889 spectrum 1 weight 0.10000E+01 volume 0.55545E-03 ppm1 6.407 ppm2 0.066 CV 1
ASSI { 1526}
(( segid " " and resid 363 and name HD2 ))
( segid " " and resid 359 and name HG2%)
3.700 1.700 1.700 peak 1526 spectrum 1 weight 0.10000E+01 volume 0.84586E-03 ppm1 7.048 ppm2 -0.455 CV 1
ASSI { 2172}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 217 and name H ))
2.600 0.900 0.900 peak 2172 spectrum 1 weight 0.10000E+01 volume 0.29154E-02 ppm1 -0.048 ppm2 7.480 CV 1
ASSI { 2205}
( segid " " and resid 373 and name HD1%)
(( segid " " and resid 373 and name H ))
3.500 1.500 1.500 peak 2205 spectrum 1 weight 0.10000E+01 volume 0.22499E-02 ppm1 -0.197 ppm2 8.233 CV 1
ASSI { 3082}
( segid " " and resid 220 and name HG1%)
( segid " " and resid 219 and name HD% )
3.100 1.200 1.200 peak 3082 spectrum 1 weight 0.10000E+01 volume 0.40488E-02 ppm1 1.116 ppm2 6.827 CV 1
OR { 3082}
( segid " " and resid 220 and name HG2%)
( segid " " and resid 219 and name HD% )
ASSI { 2258}
(( segid " " and resid 296 and name HG3 ))
(( segid " " and resid 296 and name HA ))
2.900 1.100 1.100 peak 2258 spectrum 1 weight 0.10000E+01 volume 0.19483E-02 ppm1 2.412 ppm2 3.776 CV 1
OR { 2258}
(( segid " " and resid 296 and name HG2 ))
(( segid " " and resid 296 and name HA ))
ASSI { 3119}
( segid " " and resid 358 and name HD% )
( segid " " and resid 339 and name HG2%)
2.500 0.800 0.800 peak 3119 spectrum 1 weight 0.10000E+01 volume 0.52161E-02 ppm1 7.014 ppm2 0.700 CV 1
ASSI { 1419}
( segid " " and resid 356 and name HG1%)
( segid " " and resid 303 and name HE% )
3.300 1.400 1.400 peak 1419 spectrum 1 weight 0.10000E+01 volume 0.18214E-02 ppm1 0.785 ppm2 6.812 CV 1
ASSI { 2947}
( segid " " and resid 278 and name HD1%)
(( segid " " and resid 278 and name H ))
3.000 1.100 1.100 peak 2947 spectrum 1 weight 0.10000E+01 volume 0.16466E-02 ppm1 0.655 ppm2 10.067 CV 1
ASSI { 3555}
(( segid " " and resid 276 and name HG2 ))
(( segid " " and resid 276 and name HA ))
3.500 1.500 1.500 peak 3555 spectrum 1 weight 0.10000E+01 volume 0.17368E-02 ppm1 2.357 ppm2 4.413 CV 1
ASSI { 2560}
(( segid " " and resid 444 and name HB2 ))
(( segid " " and resid 444 and name H ))
2.400 0.700 0.700 peak 2560 spectrum 1 weight 0.10000E+01 volume 0.36567E-02 ppm1 1.862 ppm2 7.756 CV 1
ASSI { 3755}
(( segid " " and resid 322 and name HB ))
( segid " " and resid 322 and name HG2%)
2.400 0.700 0.700 peak 3755 spectrum 1 weight 0.10000E+01 volume 0.14464E-02 ppm1 1.327 ppm2 0.384 CV 1
ASSI { 4748}
(( segid " " and resid 375 and name HG3 ))
(( segid " " and resid 376 and name H ))
4.000 2.000 2.000 peak 4748 spectrum 1 weight 0.10000E+01 volume 0.10432E-02 ppm1 2.260 ppm2 9.509 CV 1
ASSI { 937}
( segid " " and resid 316 and name HD2%)
(( segid " " and resid 317 and name H ))
4.500 2.500 1.500 peak 937 spectrum 1 weight 0.10000E+01 volume 0.10911E-02 ppm1 0.749 ppm2 7.524 CV 1
ASSI { 1475}
( segid " " and resid 243 and name HD2%)
(( segid " " and resid 242 and name HG2 ))
3.600 1.600 1.600 peak 1475 spectrum 1 weight 0.10000E+01 volume 0.19003E-02 ppm1 0.167 ppm2 2.224 CV 1
OR { 1475}
( segid " " and resid 243 and name HD2%)
(( segid " " and resid 242 and name HB3 ))
ASSI { 735}
( segid " " and resid 246 and name HB% )
(( segid " " and resid 247 and name HB2 ))
5.100 3.200 0.900 peak 735 spectrum 1 weight 0.10000E+01 volume 0.78381E-03 ppm1 1.175 ppm2 3.006 CV 1
OR { 735}
( segid " " and resid 246 and name HB% )
(( segid " " and resid 247 and name HB3 ))
ASSI { 1442}
(( segid " " and resid 429 and name HB3 ))
( segid " " and resid 429 and name HD2%)
2.600 0.900 0.900 peak 1442 spectrum 1 weight 0.10000E+01 volume 0.34454E-02 ppm1 1.787 ppm2 0.659 CV 1
ASSI { 4645}
( segid " " and resid 367 and name HD1%)
(( segid " " and resid 367 and name H ))
3.100 1.200 1.200 peak 4645 spectrum 1 weight 0.10000E+01 volume 0.21005E-02 ppm1 0.666 ppm2 7.881 CV 1
ASSI { 4666}
(( segid " " and resid 437 and name HB ))
(( segid " " and resid 437 and name HA ))
3.700 1.700 1.700 peak 4666 spectrum 1 weight 0.10000E+01 volume 0.79509E-03 ppm1 4.228 ppm2 3.782 CV 1
ASSI { 2315}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 280 and name H ))
4.500 2.500 1.500 peak 2315 spectrum 1 weight 0.10000E+01 volume 0.89377E-03 ppm1 0.171 ppm2 7.638 CV 1
ASSI { 997}
( segid " " and resid 435 and name HD1%)
( segid " " and resid 391 and name HD2%)
3.500 1.500 1.500 peak 997 spectrum 1 weight 0.10000E+01 volume 0.98963E-03 ppm1 0.868 ppm2 0.539 CV 1
ASSI { 3368}
( segid " " and resid 435 and name HD1%)
(( segid " " and resid 382 and name H ))
3.100 3.100 2.900 peak 3368 spectrum 1 weight 0.10000E+01 volume 0.35809E-03 ppm1 0.866 ppm2 8.690 CV 1
ASSI { 2266}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 279 and name HA ))
2.500 2.500 3.500 peak 2266 spectrum 1 weight 0.10000E+01 volume 0.13336E-02 ppm1 0.379 ppm2 4.312 CV 1
ASSI { 1714}
(( segid " " and resid 351 and name HB3 ))
(( segid " " and resid 351 and name HA ))
3.400 1.500 1.500 peak 1714 spectrum 1 weight 0.10000E+01 volume 0.51879E-03 ppm1 2.101 ppm2 3.825 CV 1
ASSI { 3563}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 327 and name HB3 ))
2.500 0.800 0.800 peak 3563 spectrum 1 weight 0.10000E+01 volume 0.49651E-02 ppm1 1.913 ppm2 3.134 CV 1
OR { 3563}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 327 and name HB2 ))
ASSI { 221}
( segid " " and resid 310 and name HD1%)
( segid " " and resid 279 and name HD1%)
2.500 0.800 0.800 peak 221 spectrum 1 weight 0.10000E+01 volume 0.34172E-02 ppm1 1.067 ppm2 0.165 CV 1
ASSI { 2320}
(( segid " " and resid 187 and name HG2 ))
(( segid " " and resid 187 and name HA ))
2.900 1.100 1.100 peak 2320 spectrum 1 weight 0.10000E+01 volume 0.13731E-02 ppm1 1.418 ppm2 4.584 CV 1
ASSI { 2579}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 364 and name HA ))
4.600 2.700 1.400 peak 2579 spectrum 1 weight 0.10000E+01 volume 0.91069E-03 ppm1 0.393 ppm2 3.652 CV 1
ASSI { 1274}
(( segid " " and resid 314 and name HB2 ))
(( segid " " and resid 314 and name HD21))
3.100 1.200 1.200 peak 1274 spectrum 1 weight 0.10000E+01 volume 0.65413E-03 ppm1 2.788 ppm2 7.326 CV 1
OR { 1274}
(( segid " " and resid 314 and name HB3 ))
(( segid " " and resid 314 and name H ))
OR { 1274}
(( segid " " and resid 314 and name HB3 ))
(( segid " " and resid 314 and name HD21))
OR { 1274}
(( segid " " and resid 314 and name HB2 ))
(( segid " " and resid 314 and name H ))
ASSI { 3402}
( segid " " and resid 330 and name HB% )
(( segid " " and resid 330 and name HA ))
2.100 0.500 0.500 peak 3402 spectrum 1 weight 0.10000E+01 volume 0.19722E-01 ppm1 1.554 ppm2 4.113 CV 1
ASSI { 3729}
(( segid " " and resid 399 and name HA ))
(( segid " " and resid 399 and name HD3 ))
2.300 0.700 0.700 peak 3729 spectrum 1 weight 0.10000E+01 volume 0.43562E-02 ppm1 3.760 ppm2 1.606 CV 1
OR { 3729}
(( segid " " and resid 399 and name HA ))
(( segid " " and resid 399 and name HD2 ))
ASSI { 3930}
(( segid " " and resid 351 and name HG2 ))
(( segid " " and resid 351 and name HE21))
3.800 1.800 1.800 peak 3930 spectrum 1 weight 0.10000E+01 volume 0.14408E-02 ppm1 2.171 ppm2 6.749 CV 1
ASSI { 1862}
(( segid " " and resid 358 and name HB3 ))
( segid " " and resid 339 and name HG2%)
5.100 3.200 0.900 peak 1862 spectrum 1 weight 0.10000E+01 volume 0.61747E-03 ppm1 2.956 ppm2 0.748 CV 1
ASSI { 3065}
(( segid " " and resid 374 and name HB2 ))
(( segid " " and resid 320 and name HH2 ))
2.700 0.900 0.900 peak 3065 spectrum 1 weight 0.10000E+01 volume 0.57516E-03 ppm1 1.628 ppm2 7.140 CV 1
ASSI { 2027}
(( segid " " and resid 306 and name HA ))
(( segid " " and resid 306 and name HG ))
3.800 1.800 1.800 peak 2027 spectrum 1 weight 0.10000E+01 volume 0.81483E-03 ppm1 3.648 ppm2 1.354 CV 1
ASSI { 2882}
(( segid " " and resid 222 and name HB3 ))
(( segid " " and resid 222 and name HE2 ))
2.900 1.000 1.000 peak 2882 spectrum 1 weight 0.10000E+01 volume 0.86560E-03 ppm1 0.812 ppm2 2.686 CV 1
OR { 2882}
(( segid " " and resid 222 and name HB3 ))
(( segid " " and resid 222 and name HE3 ))
ASSI { 1744}
( segid " " and resid 307 and name HD2%)
(( segid " " and resid 307 and name HA ))
3.800 1.800 1.800 peak 1744 spectrum 1 weight 0.10000E+01 volume 0.15676E-02 ppm1 1.031 ppm2 4.145 CV 1
ASSI { 2514}
(( segid " " and resid 242 and name HG3 ))
( segid " " and resid 243 and name HD2%)
4.000 2.000 2.000 peak 2514 spectrum 1 weight 0.10000E+01 volume 0.80637E-03 ppm1 2.329 ppm2 0.165 CV 1
ASSI { 4588}
(( segid " " and resid 322 and name HA ))
( segid " " and resid 361 and name HE% )
3.400 1.400 1.400 peak 4588 spectrum 1 weight 0.10000E+01 volume 0.54135E-03 ppm1 3.381 ppm2 7.061 CV 1
ASSI { 3922}
(( segid " " and resid 388 and name HG3 ))
(( segid " " and resid 388 and name HG2 ))
2.100 0.500 0.500 peak 3922 spectrum 1 weight 0.10000E+01 volume 0.48607E-02 ppm1 2.269 ppm2 1.857 CV 1
OR { 3922}
(( segid " " and resid 388 and name HG3 ))
( segid " " and resid 388 and name HE% )
ASSI { 2900}
(( segid " " and resid 421 and name HB3 ))
(( segid " " and resid 421 and name H ))
3.100 1.200 1.200 peak 2900 spectrum 1 weight 0.10000E+01 volume 0.17368E-02 ppm1 1.660 ppm2 8.371 CV 1
ASSI { 2684}
(( segid " " and resid 413 and name HB3 ))
(( segid " " and resid 413 and name HD2 ))
4.600 2.600 1.400 peak 2684 spectrum 1 weight 0.10000E+01 volume 0.47930E-03 ppm1 2.990 ppm2 6.796 CV 1
ASSI { 2131}
(( segid " " and resid 236 and name HA ))
( segid " " and resid 236 and name HG2%)
2.900 1.000 1.000 peak 2131 spectrum 1 weight 0.10000E+01 volume 0.19680E-02 ppm1 3.989 ppm2 0.963 CV 1
ASSI { 1505}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 343 and name H ))
4.900 3.000 1.100 peak 1505 spectrum 1 weight 0.10000E+01 volume 0.59773E-03 ppm1 1.012 ppm2 8.180 CV 1
ASSI { 1509}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 406 and name H ))
5.100 3.300 0.900 peak 1509 spectrum 1 weight 0.10000E+01 volume 0.49622E-03 ppm1 0.781 ppm2 9.250 CV 1
ASSI { 4234}
(( segid " " and resid 388 and name HG3 ))
(( segid " " and resid 389 and name HD2 ))
5.100 3.200 0.900 peak 4234 spectrum 1 weight 0.10000E+01 volume 0.75564E-03 ppm1 2.280 ppm2 3.134 CV 1
ASSI { 2327}
(( segid " " and resid 317 and name HG ))
(( segid " " and resid 317 and name HB3 ))
3.700 1.700 1.700 peak 2327 spectrum 1 weight 0.10000E+01 volume 0.33552E-03 ppm1 0.404 ppm2 1.149 CV 1
ASSI { 4268}
(( segid " " and resid 226 and name HG3 ))
(( segid " " and resid 226 and name HA ))
3.000 1.200 1.200 peak 4268 spectrum 1 weight 0.10000E+01 volume 0.28843E-02 ppm1 1.210 ppm2 4.382 CV 1
ASSI { 3310}
(( segid " " and resid 336 and name HB3 ))
(( segid " " and resid 336 and name HE3 ))
4.800 2.800 1.200 peak 3310 spectrum 1 weight 0.10000E+01 volume 0.98681E-03 ppm1 1.976 ppm2 2.866 CV 1
OR { 3310}
(( segid " " and resid 336 and name HB3 ))
(( segid " " and resid 336 and name HE2 ))
ASSI { 2456}
( segid " " and resid 315 and name HE% )
(( segid " " and resid 315 and name HA ))
4.800 2.800 1.200 peak 2456 spectrum 1 weight 0.10000E+01 volume 0.75846E-03 ppm1 6.874 ppm2 3.785 CV 1
ASSI { 2292}
(( segid " " and resid 318 and name HG13))
(( segid " " and resid 318 and name HG12))
1.500 0.300 0.700 peak 2292 spectrum 1 weight 0.10000E+01 volume 0.10587E-01 ppm1 0.611 ppm2 0.990 CV 1
ASSI { 3446}
( segid " " and resid 202 and name HE% )
(( segid " " and resid 202 and name HG2 ))
2.300 0.600 0.600 peak 3446 spectrum 1 weight 0.10000E+01 volume 0.12409E-01 ppm1 1.868 ppm2 2.280 CV 1
OR { 3446}
( segid " " and resid 202 and name HE% )
(( segid " " and resid 202 and name HB3 ))
ASSI { 4578}
(( segid " " and resid 374 and name HB3 ))
( segid " " and resid 207 and name HG2%)
4.800 2.900 1.200 peak 4578 spectrum 1 weight 0.10000E+01 volume 0.48776E-03 ppm1 1.771 ppm2 0.443 CV 1
ASSI { 4362}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 319 and name HA ))
2.500 2.500 3.500 peak 4362 spectrum 1 weight 0.10000E+01 volume 0.13280E-02 ppm1 0.367 ppm2 2.304 CV 1
ASSI { 4690}
(( segid " " and resid 226 and name HG3 ))
(( segid " " and resid 226 and name H ))
2.800 1.000 1.000 peak 4690 spectrum 1 weight 0.10000E+01 volume 0.14718E-02 ppm1 1.211 ppm2 7.423 CV 1
ASSI { 2438}
( segid " " and resid 342 and name HD1%)
( segid " " and resid 329 and name HD1%)
3.800 1.800 1.800 peak 2438 spectrum 1 weight 0.10000E+01 volume 0.21287E-02 ppm1 0.656 ppm2 0.117 CV 1
ASSI { 4217}
(( segid " " and resid 306 and name HB2 ))
( segid " " and resid 306 and name HD2%)
3.100 1.200 1.200 peak 4217 spectrum 1 weight 0.10000E+01 volume 0.56388E-03 ppm1 0.957 ppm2 -0.356 CV 1
ASSI { 1798}
( segid " " and resid 329 and name HD1%)
(( segid " " and resid 339 and name HA ))
2.400 0.700 0.700 peak 1798 spectrum 1 weight 0.10000E+01 volume 0.21090E-02 ppm1 0.118 ppm2 2.998 CV 1
ASSI { 3289}
(( segid " " and resid 316 and name HA ))
(( segid " " and resid 319 and name HG ))
3.200 1.300 1.300 peak 3289 spectrum 1 weight 0.10000E+01 volume 0.55263E-03 ppm1 3.580 ppm2 4.084 CV 1
ASSI { 4368}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 326 and name HA ))
4.500 2.500 1.500 peak 4368 spectrum 1 weight 0.10000E+01 volume 0.17819E-02 ppm1 0.748 ppm2 4.413 CV 1
ASSI { 232}
(( segid " " and resid 351 and name HG3 ))
( segid " " and resid 350 and name HG2%)
4.300 2.400 1.700 peak 232 spectrum 1 weight 0.10000E+01 volume 0.15282E-02 ppm1 2.065 ppm2 0.738 CV 1
OR { 232}
(( segid " " and resid 351 and name HG3 ))
( segid " " and resid 350 and name HG1%)
ASSI { 3159}
(( segid " " and resid 186 and name HG ))
(( segid " " and resid 186 and name HA ))
3.400 1.500 1.500 peak 3159 spectrum 1 weight 0.10000E+01 volume 0.45000E-02 ppm1 1.501 ppm2 4.248 CV 1
ASSI { 2242}
(( segid " " and resid 380 and name HB3 ))
(( segid " " and resid 380 and name HB2 ))
2.200 0.600 0.600 peak 2242 spectrum 1 weight 0.10000E+01 volume 0.20667E-02 ppm1 1.452 ppm2 1.208 CV 1
ASSI { 2961}
(( segid " " and resid 217 and name HG13))
(( segid " " and resid 218 and name H ))
5.400 3.700 0.600 peak 2961 spectrum 1 weight 0.10000E+01 volume 0.31860E-03 ppm1 0.476 ppm2 7.964 CV 1
ASSI { 3115}
(( segid " " and resid 318 and name HG13))
( segid " " and resid 318 and name HD1%)
1.900 0.400 0.400 peak 3115 spectrum 1 weight 0.10000E+01 volume 0.15423E-01 ppm1 0.610 ppm2 0.368 CV 1
OR { 3115}
(( segid " " and resid 318 and name HG13))
( segid " " and resid 318 and name HG2%)
ASSI { 2648}
( segid " " and resid 315 and name HD% )
(( segid " " and resid 315 and name HA ))
3.300 1.400 1.400 peak 2648 spectrum 1 weight 0.10000E+01 volume 0.11306E-02 ppm1 7.027 ppm2 3.785 CV 1
ASSI { 4801}
( segid " " and resid 357 and name HD2%)
( segid " " and resid 322 and name HD1%)
4.400 2.400 1.600 peak 4801 spectrum 1 weight 0.10000E+01 volume 0.80355E-03 ppm1 0.868 ppm2 -0.171 CV 1
ASSI { 2462}
(( segid " " and resid 372 and name HA ))
( segid " " and resid 373 and name HD1%)
4.800 2.900 1.200 peak 2462 spectrum 1 weight 0.10000E+01 volume 0.45959E-03 ppm1 3.804 ppm2 -0.194 CV 1
ASSI { 1984}
(( segid " " and resid 385 and name HG3 ))
(( segid " " and resid 385 and name HA ))
3.900 1.900 1.900 peak 1984 spectrum 1 weight 0.10000E+01 volume 0.18693E-02 ppm1 2.453 ppm2 4.176 CV 1
ASSI { 4428}
(( segid " " and resid 223 and name HB2 ))
( segid " " and resid 223 and name HD% )
3.400 1.500 1.500 peak 4428 spectrum 1 weight 0.10000E+01 volume 0.73589E-03 ppm1 1.773 ppm2 6.429 CV 1
ASSI { 3989}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 357 and name H ))
5.500 3.800 0.500 peak 3989 spectrum 1 weight 0.10000E+01 volume 0.35527E-03 ppm1 0.605 ppm2 8.117 CV 1
ASSI { 3314}
(( segid " " and resid 355 and name HG2 ))
(( segid " " and resid 356 and name H ))
3.800 1.800 1.800 peak 3314 spectrum 1 weight 0.10000E+01 volume 0.15479E-02 ppm1 1.724 ppm2 7.349 CV 1
ASSI { 3139}
(( segid " " and resid 222 and name HA ))
(( segid " " and resid 222 and name HB3 ))
2.500 0.800 0.800 peak 3139 spectrum 1 weight 0.10000E+01 volume 0.30563E-02 ppm1 3.784 ppm2 0.810 CV 1
ASSI { 4726}
( segid " " and resid 263 and name HG2%)
( segid " " and resid 263 and name HG1%)
2.400 0.700 0.700 peak 4726 spectrum 1 weight 0.10000E+01 volume 0.65780E-02 ppm1 0.808 ppm2 0.064 CV 1
ASSI { 4056}
(( segid " " and resid 373 and name HB2 ))
(( segid " " and resid 373 and name HG ))
3.600 1.600 1.600 peak 4056 spectrum 1 weight 0.10000E+01 volume 0.27349E-03 ppm1 0.402 ppm2 1.091 CV 1
ASSI { 3184}
(( segid " " and resid 393 and name HB2 ))
(( segid " " and resid 393 and name HG3 ))
2.300 0.700 0.700 peak 3184 spectrum 1 weight 0.10000E+01 volume 0.74858E-02 ppm1 2.087 ppm2 2.265 CV 1
ASSI { 551}
( segid " " and resid 325 and name HE% )
( segid " " and resid 342 and name HG2%)
3.100 1.200 1.200 peak 551 spectrum 1 weight 0.10000E+01 volume 0.55997E-02 ppm1 0.928 ppm2 0.482 CV 1
ASSI { 4128}
( segid " " and resid 211 and name HB% )
( segid " " and resid 212 and name HG2%)
5.200 3.300 0.800 peak 4128 spectrum 1 weight 0.10000E+01 volume 0.58644E-03 ppm1 1.689 ppm2 -0.170 CV 1
ASSI { 163}
( segid " " and resid 307 and name HD1%)
( segid " " and resid 279 and name HD1%)
3.100 1.200 1.200 peak 163 spectrum 1 weight 0.10000E+01 volume 0.19595E-02 ppm1 1.211 ppm2 0.173 CV 1
ASSI { 4720}
(( segid " " and resid 324 and name HA ))
( segid " " and resid 373 and name HD2%)
2.900 1.000 1.000 peak 4720 spectrum 1 weight 0.10000E+01 volume 0.19454E-02 ppm1 3.931 ppm2 0.519 CV 1
ASSI { 3170}
(( segid " " and resid 311 and name HD3 ))
(( segid " " and resid 310 and name HA ))
2.700 0.900 0.900 peak 3170 spectrum 1 weight 0.10000E+01 volume 0.54981E-03 ppm1 3.118 ppm2 4.335 CV 1
ASSI { 2789}
( segid " " and resid 225 and name HE% )
( segid " " and resid 217 and name HD1%)
4.600 2.600 1.400 peak 2789 spectrum 1 weight 0.10000E+01 volume 0.82047E-03 ppm1 1.914 ppm2 -0.049 CV 1
ASSI { 604}
( segid " " and resid 230 and name HD1%)
( segid " " and resid 220 and name HG2%)
2.600 0.800 0.800 peak 604 spectrum 1 weight 0.10000E+01 volume 0.71982E-02 ppm1 0.651 ppm2 1.115 CV 1
OR { 604}
( segid " " and resid 230 and name HD1%)
( segid " " and resid 220 and name HG1%)
ASSI { 3230}
( segid " " and resid 388 and name HE% )
( segid " " and resid 391 and name HD1%)
2.000 0.500 0.500 peak 3230 spectrum 1 weight 0.10000E+01 volume 0.21095E-01 ppm1 1.846 ppm2 0.713 CV 1
ASSI { 2010}
( segid " " and resid 380 and name HD2%)
(( segid " " and resid 380 and name H ))
4.100 2.100 1.900 peak 2010 spectrum 1 weight 0.10000E+01 volume 0.12716E-02 ppm1 0.777 ppm2 9.014 CV 1
ASSI { 254}
( segid " " and resid 316 and name HD2%)
(( segid " " and resid 316 and name HG ))
2.200 0.600 0.600 peak 254 spectrum 1 weight 0.10000E+01 volume 0.11690E-01 ppm1 0.748 ppm2 1.612 CV 1
OR { 254}
( segid " " and resid 316 and name HD2%)
(( segid " " and resid 316 and name HB2 ))
OR { 254}
( segid " " and resid 316 and name HD2%)
(( segid " " and resid 316 and name HB3 ))
ASSI { 1797}
( segid " " and resid 290 and name HB% )
(( segid " " and resid 287 and name HA ))
2.800 1.000 1.000 peak 1797 spectrum 1 weight 0.10000E+01 volume 0.21005E-02 ppm1 1.529 ppm2 3.486 CV 1
ASSI { 4502}
(( segid " " and resid 304 and name HB2 ))
(( segid " " and resid 304 and name HG2 ))
3.100 1.200 1.200 peak 4502 spectrum 1 weight 0.10000E+01 volume 0.20526E-02 ppm1 2.240 ppm2 2.454 CV 1
ASSI { 431}
(( segid " " and resid 244 and name HE2 ))
(( segid " " and resid 244 and name H ))
4.300 2.300 1.700 peak 431 spectrum 1 weight 0.10000E+01 volume 0.54699E-03 ppm1 2.562 ppm2 8.549 CV 1
ASSI { 4402}
(( segid " " and resid 228 and name HG3 ))
(( segid " " and resid 228 and name H ))
4.300 2.300 1.700 peak 4402 spectrum 1 weight 0.10000E+01 volume 0.11363E-02 ppm1 1.962 ppm2 8.441 CV 1
ASSI { 1009}
(( segid " " and resid 239 and name HD2 ))
( segid " " and resid 243 and name HD1%)
5.200 3.300 0.800 peak 1009 spectrum 1 weight 0.10000E+01 volume 0.28759E-03 ppm1 1.744 ppm2 0.000 CV 1
ASSI { 240}
(( segid " " and resid 418 and name HA2 ))
(( segid " " and resid 420 and name HG12))
6.000 4.500 0.000 peak 240 spectrum 1 weight 0.10000E+01 volume 0.49058E-03 ppm1 3.918 ppm2 1.106 CV 1
ASSI { 2683}
( segid " " and resid 339 and name HG2%)
(( segid " " and resid 340 and name HB2 ))
3.700 1.700 1.700 peak 2683 spectrum 1 weight 0.10000E+01 volume 0.24558E-02 ppm1 0.706 ppm2 1.949 CV 1
ASSI { 3963}
(( segid " " and resid 184 and name HA ))
(( segid " " and resid 184 and name HG3 ))
3.400 1.400 1.400 peak 3963 spectrum 1 weight 0.10000E+01 volume 0.66372E-02 ppm1 4.307 ppm2 1.941 CV 1
OR { 3963}
(( segid " " and resid 184 and name HA ))
(( segid " " and resid 184 and name HG2 ))
ASSI { 4002}
(( segid " " and resid 187 and name HD3 ))
(( segid " " and resid 187 and name HA ))
4.100 2.100 1.900 peak 4002 spectrum 1 weight 0.10000E+01 volume 0.10658E-02 ppm1 1.592 ppm2 4.605 CV 1
ASSI { 2891}
(( segid " " and resid 281 and name HB3 ))
(( segid " " and resid 281 and name HA ))
2.000 0.500 0.500 peak 2891 spectrum 1 weight 0.10000E+01 volume 0.84868E-02 ppm1 1.903 ppm2 3.981 CV 1
ASSI { 3825}
(( segid " " and resid 325 and name HG3 ))
(( segid " " and resid 325 and name HA ))
3.300 1.300 1.300 peak 3825 spectrum 1 weight 0.10000E+01 volume 0.37216E-03 ppm1 2.701 ppm2 3.841 CV 1
ASSI { 1154}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 440 and name H ))
3.700 1.700 1.700 peak 1154 spectrum 1 weight 0.10000E+01 volume 0.10630E-02 ppm1 0.699 ppm2 8.438 CV 1
ASSI { 2048}
( segid " " and resid 352 and name HD1%)
( segid " " and resid 279 and name HD1%)
3.600 1.600 1.600 peak 2048 spectrum 1 weight 0.10000E+01 volume 0.31494E-02 ppm1 0.603 ppm2 0.167 CV 1
ASSI { 3553}
(( segid " " and resid 202 and name HG3 ))
(( segid " " and resid 202 and name HA ))
4.300 2.300 1.700 peak 3553 spectrum 1 weight 0.10000E+01 volume 0.63157E-03 ppm1 2.774 ppm2 4.429 CV 1
ASSI { 2250}
( segid " " and resid 230 and name HD1%)
(( segid " " and resid 230 and name HG13))
2.100 0.500 0.500 peak 2250 spectrum 1 weight 0.10000E+01 volume 0.15727E-01 ppm1 0.651 ppm2 0.947 CV 1
OR { 2250}
( segid " " and resid 230 and name HD1%)
( segid " " and resid 230 and name HG2%)
ASSI { 2041}
(( segid " " and resid 220 and name HA ))
( segid " " and resid 219 and name HD% )
3.800 1.800 1.800 peak 2041 spectrum 1 weight 0.10000E+01 volume 0.39754E-03 ppm1 3.323 ppm2 6.865 CV 1
ASSI { 3785}
( segid " " and resid 436 and name HD2%)
(( segid " " and resid 406 and name HG2 ))
2.700 0.900 0.900 peak 3785 spectrum 1 weight 0.10000E+01 volume 0.19539E-02 ppm1 0.857 ppm2 2.573 CV 1
ASSI { 590}
( segid " " and resid 245 and name HB% )
(( segid " " and resid 244 and name H ))
4.200 2.200 1.800 peak 590 spectrum 1 weight 0.10000E+01 volume 0.18609E-02 ppm1 1.330 ppm2 8.555 CV 1
ASSI { 4376}
(( segid " " and resid 278 and name HB2 ))
(( segid " " and resid 278 and name HA ))
3.400 1.400 1.400 peak 4376 spectrum 1 weight 0.10000E+01 volume 0.67102E-03 ppm1 1.206 ppm2 3.796 CV 1
ASSI { 3319}
( segid " " and resid 371 and name HG2%)
(( segid " " and resid 320 and name HE1 ))
4.100 2.100 1.900 peak 3319 spectrum 1 weight 0.10000E+01 volume 0.74999E-03 ppm1 0.965 ppm2 10.117 CV 1
ASSI { 4569}
(( segid " " and resid 318 and name HB ))
(( segid " " and resid 319 and name HG ))
5.700 4.100 0.300 peak 4569 spectrum 1 weight 0.10000E+01 volume 0.42857E-03 ppm1 1.356 ppm2 4.081 CV 1
ASSI { 4120}
( segid " " and resid 243 and name HD1%)
(( segid " " and resid 243 and name HB2 ))
2.700 0.900 0.900 peak 4120 spectrum 1 weight 0.10000E+01 volume 0.19765E-02 ppm1 0.013 ppm2 1.774 CV 1
ASSI { 3547}
(( segid " " and resid 365 and name HG2 ))
(( segid " " and resid 365 and name HE21))
1.900 0.500 0.500 peak 3547 spectrum 1 weight 0.10000E+01 volume 0.47620E-02 ppm1 2.345 ppm2 6.868 CV 1
ASSI { 2329}
( segid " " and resid 372 and name HG1%)
(( segid " " and resid 372 and name HB ))
2.000 0.500 0.500 peak 2329 spectrum 1 weight 0.10000E+01 volume 0.22435E-01 ppm1 0.644 ppm2 1.701 CV 1
ASSI { 5}
( segid " " and resid 203 and name HE% )
( segid " " and resid 213 and name HD% )
5.700 4.100 0.300 peak 5 spectrum 1 weight 0.10000E+01 volume 0.45677E-03 ppm1 2.222 ppm2 6.661 CV 1
ASSI { 1811}
( segid " " and resid 339 and name HD1%)
( segid " " and resid 358 and name HE% )
3.100 1.200 1.200 peak 1811 spectrum 1 weight 0.10000E+01 volume 0.20385E-02 ppm1 0.648 ppm2 6.694 CV 1
ASSI { 2033}
(( segid " " and resid 329 and name HA ))
(( segid " " and resid 329 and name H ))
3.000 1.100 1.100 peak 2033 spectrum 1 weight 0.10000E+01 volume 0.84021E-03 ppm1 3.849 ppm2 7.942 CV 1
ASSI { 2432}
( segid " " and resid 435 and name HD1%)
(( segid " " and resid 382 and name HZ3 ))
3.500 1.600 1.600 peak 2432 spectrum 1 weight 0.10000E+01 volume 0.82893E-03 ppm1 0.868 ppm2 6.865 CV 1
ASSI { 3744}
(( segid " " and resid 185 and name HA ))
(( segid " " and resid 186 and name HB3 ))
5.400 3.700 0.600 peak 3744 spectrum 1 weight 0.10000E+01 volume 0.72461E-03 ppm1 4.568 ppm2 1.521 CV 1
OR { 3744}
(( segid " " and resid 185 and name HA ))
(( segid " " and resid 186 and name HB2 ))
ASSI { 1240}
( segid " " and resid 278 and name HD2%)
(( segid " " and resid 318 and name HA ))
3.300 1.400 1.400 peak 1240 spectrum 1 weight 0.10000E+01 volume 0.99809E-03 ppm1 0.745 ppm2 3.364 CV 1
ASSI { 1670}
( segid " " and resid 243 and name HD2%)
( segid " " and resid 247 and name HE% )
3.300 1.400 1.400 peak 1670 spectrum 1 weight 0.10000E+01 volume 0.19454E-02 ppm1 0.166 ppm2 6.478 CV 1
ASSI { 4454}
(( segid " " and resid 247 and name HA ))
(( segid " " and resid 247 and name HB3 ))
3.400 1.400 1.400 peak 4454 spectrum 1 weight 0.10000E+01 volume 0.85150E-03 ppm1 4.116 ppm2 3.031 CV 1
OR { 4454}
(( segid " " and resid 247 and name HA ))
(( segid " " and resid 247 and name HB2 ))
ASSI { 3093}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 329 and name HG13))
2.700 0.900 0.900 peak 3093 spectrum 1 weight 0.10000E+01 volume 0.19708E-02 ppm1 0.748 ppm2 0.286 CV 1
ASSI { 4481}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 317 and name H ))
4.000 2.000 2.000 peak 4481 spectrum 1 weight 0.10000E+01 volume 0.10996E-02 ppm1 0.350 ppm2 7.519 CV 1
ASSI { 4564}
(( segid " " and resid 344 and name HB ))
(( segid " " and resid 344 and name HA ))
3.000 1.100 1.100 peak 4564 spectrum 1 weight 0.10000E+01 volume 0.18609E-02 ppm1 1.890 ppm2 3.883 CV 1
ASSI { 3273}
( segid " " and resid 317 and name HD2%)
( segid " " and resid 209 and name HD2%)
4.700 2.800 1.300 peak 3273 spectrum 1 weight 0.10000E+01 volume 0.90505E-03 ppm1 0.343 ppm2 -0.901 CV 1
ASSI { 3754}
( segid " " and resid 245 and name HB% )
(( segid " " and resid 244 and name HA ))
4.700 2.700 1.300 peak 3754 spectrum 1 weight 0.10000E+01 volume 0.89095E-03 ppm1 1.330 ppm2 3.277 CV 1
ASSI { 1745}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 278 and name H ))
4.300 2.300 1.700 peak 1745 spectrum 1 weight 0.10000E+01 volume 0.62875E-03 ppm1 2.150 ppm2 10.071 CV 1
ASSI { 3071}
( segid " " and resid 253 and name HG2%)
(( segid " " and resid 247 and name HH ))
4.500 2.500 1.500 peak 3071 spectrum 1 weight 0.10000E+01 volume 0.54135E-03 ppm1 0.616 ppm2 9.422 CV 1
ASSI { 4494}
(( segid " " and resid 289 and name HB2 ))
( segid " " and resid 306 and name HD2%)
4.600 2.700 1.400 peak 4494 spectrum 1 weight 0.10000E+01 volume 0.36652E-03 ppm1 1.987 ppm2 -0.354 CV 1
ASSI { 4813}
(( segid " " and resid 389 and name HA ))
(( segid " " and resid 389 and name HB3 ))
2.600 0.800 0.800 peak 4813 spectrum 1 weight 0.10000E+01 volume 0.23373E-02 ppm1 4.256 ppm2 2.005 CV 1
ASSI { 4004}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 195 and name H ))
4.900 3.000 1.100 peak 4004 spectrum 1 weight 0.10000E+01 volume 0.37780E-03 ppm1 1.453 ppm2 8.989 CV 1
ASSI { 4269}
(( segid " " and resid 339 and name HA ))
(( segid " " and resid 339 and name HB ))
3.300 1.300 1.300 peak 4269 spectrum 1 weight 0.10000E+01 volume 0.10122E-02 ppm1 2.991 ppm2 1.545 CV 1
OR { 4269}
(( segid " " and resid 339 and name HA ))
(( segid " " and resid 339 and name HG13))
ASSI { 3536}
(( segid " " and resid 336 and name HG3 ))
(( segid " " and resid 336 and name H ))
4.900 3.000 1.100 peak 3536 spectrum 1 weight 0.10000E+01 volume 0.73307E-03 ppm1 1.331 ppm2 9.119 CV 1
ASSI { 4101}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 343 and name H ))
3.200 1.300 1.300 peak 4101 spectrum 1 weight 0.10000E+01 volume 0.25234E-02 ppm1 0.515 ppm2 8.182 CV 1
ASSI { 3364}
(( segid " " and resid 302 and name HG3 ))
( segid " " and resid 303 and name HD% )
5.200 3.300 0.800 peak 3364 spectrum 1 weight 0.10000E+01 volume 0.69077E-03 ppm1 2.074 ppm2 7.074 CV 1
ASSI { 1270}
(( segid " " and resid 333 and name HG ))
(( segid " " and resid 333 and name HA ))
2.400 0.700 0.700 peak 1270 spectrum 1 weight 0.10000E+01 volume 0.10432E-01 ppm1 1.593 ppm2 4.013 CV 1
ASSI { 2581}
(( segid " " and resid 285 and name HG3 ))
(( segid " " and resid 285 and name HA ))
3.700 1.700 1.700 peak 2581 spectrum 1 weight 0.10000E+01 volume 0.33665E-02 ppm1 1.958 ppm2 4.350 CV 1
OR { 2581}
(( segid " " and resid 285 and name HG2 ))
(( segid " " and resid 285 and name HA ))
ASSI { 2152}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 345 and name HB ))
4.400 2.500 1.600 peak 2152 spectrum 1 weight 0.10000E+01 volume 0.18834E-02 ppm1 0.657 ppm2 2.130 CV 1
ASSI { 433}
( segid " " and resid 189 and name HD1%)
( segid " " and resid 247 and name HD% )
4.800 2.900 1.200 peak 433 spectrum 1 weight 0.10000E+01 volume 0.40036E-03 ppm1 0.735 ppm2 7.311 CV 1
ASSI { 3942}
(( segid " " and resid 305 and name HD3 ))
( segid " " and resid 283 and name HD1%)
2.800 1.000 1.000 peak 3942 spectrum 1 weight 0.10000E+01 volume 0.57883E-02 ppm1 3.039 ppm2 0.716 CV 1
ASSI { 2658}
(( segid " " and resid 199 and name HG3 ))
(( segid " " and resid 196 and name HA ))
3.000 1.100 1.100 peak 2658 spectrum 1 weight 0.10000E+01 volume 0.55799E-02 ppm1 2.280 ppm2 4.362 CV 1
OR { 2658}
(( segid " " and resid 199 and name HG2 ))
(( segid " " and resid 196 and name HA ))
ASSI { 4080}
(( segid " " and resid 297 and name HB ))
( segid " " and resid 300 and name HG2%)
5.000 3.100 1.000 peak 4080 spectrum 1 weight 0.10000E+01 volume 0.68512E-03 ppm1 3.944 ppm2 0.534 CV 1
ASSI { 1967}
(( segid " " and resid 426 and name HG3 ))
(( segid " " and resid 426 and name HG2 ))
1.700 0.300 0.500 peak 1967 spectrum 1 weight 0.10000E+01 volume 0.85657E-02 ppm1 1.991 ppm2 2.256 CV 1
ASSI { 3373}
( segid " " and resid 356 and name HG2%)
( segid " " and resid 303 and name HE% )
3.700 1.700 1.700 peak 3373 spectrum 1 weight 0.10000E+01 volume 0.24783E-02 ppm1 0.383 ppm2 6.806 CV 1
ASSI { 3343}
( segid " " and resid 253 and name HG2%)
( segid " " and resid 258 and name HE% )
3.300 1.300 1.300 peak 3343 spectrum 1 weight 0.10000E+01 volume 0.30479E-02 ppm1 0.617 ppm2 6.637 CV 1
ASSI { 863}
( segid " " and resid 307 and name HD2%)
(( segid " " and resid 318 and name H ))
4.300 2.300 1.700 peak 863 spectrum 1 weight 0.10000E+01 volume 0.67948E-03 ppm1 1.027 ppm2 8.003 CV 1
ASSI { 1673}
( segid " " and resid 420 and name HD1%)
(( segid " " and resid 420 and name HA ))
3.400 1.500 1.500 peak 1673 spectrum 1 weight 0.10000E+01 volume 0.86532E-02 ppm1 0.770 ppm2 3.978 CV 1
ASSI { 3215}
(( segid " " and resid 332 and name HB2 ))
(( segid " " and resid 332 and name HB3 ))
1.900 0.500 0.500 peak 3215 spectrum 1 weight 0.10000E+01 volume 0.23627E-02 ppm1 1.814 ppm2 2.624 CV 1
ASSI { 3056}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 300 and name HB ))
2.100 0.600 0.600 peak 3056 spectrum 1 weight 0.10000E+01 volume 0.81737E-02 ppm1 0.076 ppm2 1.727 CV 1
ASSI { 3588}
(( segid " " and resid 202 and name HB3 ))
(( segid " " and resid 202 and name H ))
4.700 2.800 1.300 peak 3588 spectrum 1 weight 0.10000E+01 volume 0.68794E-03 ppm1 2.263 ppm2 8.203 CV 1
ASSI { 3884}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 232 and name HD2 ))
3.400 1.500 1.500 peak 3884 spectrum 1 weight 0.10000E+01 volume 0.85150E-03 ppm1 1.008 ppm2 3.170 CV 1
ASSI { 3212}
(( segid " " and resid 239 and name HG3 ))
( segid " " and resid 258 and name HE% )
4.900 3.000 1.100 peak 3212 spectrum 1 weight 0.10000E+01 volume 0.53007E-03 ppm1 1.599 ppm2 6.636 CV 1
ASSI { 2528}
(( segid " " and resid 217 and name HB ))
(( segid " " and resid 217 and name HA ))
3.600 1.600 1.600 peak 2528 spectrum 1 weight 0.10000E+01 volume 0.52725E-03 ppm1 1.641 ppm2 2.980 CV 1
ASSI { 82}
(( segid " " and resid 331 and name HG3 ))
(( segid " " and resid 331 and name HB3 ))
3.000 1.100 1.100 peak 82 spectrum 1 weight 0.10000E+01 volume 0.74435E-03 ppm1 1.465 ppm2 2.524 CV 1
OR { 82}
(( segid " " and resid 331 and name HG3 ))
(( segid " " and resid 331 and name HB2 ))
ASSI { 3122}
(( segid " " and resid 338 and name HB3 ))
(( segid " " and resid 338 and name HA ))
4.400 2.400 1.600 peak 3122 spectrum 1 weight 0.10000E+01 volume 0.31860E-03 ppm1 3.065 ppm2 4.629 CV 1
ASSI { 1404}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 371 and name HB ))
2.500 0.800 0.800 peak 1404 spectrum 1 weight 0.10000E+01 volume 0.21569E-02 ppm1 0.432 ppm2 1.928 CV 1
ASSI { 187}
( segid " " and resid 361 and name HD% )
( segid " " and resid 322 and name HD1%)
5.100 3.200 0.900 peak 187 spectrum 1 weight 0.10000E+01 volume 0.44267E-03 ppm1 7.143 ppm2 -0.162 CV 1
ASSI { 1836}
( segid " " and resid 435 and name HG2%)
(( segid " " and resid 435 and name H ))
4.100 2.100 1.900 peak 1836 spectrum 1 weight 0.10000E+01 volume 0.24530E-02 ppm1 0.901 ppm2 8.183 CV 1
ASSI { 2812}
( segid " " and resid 349 and name HG2%)
(( segid " " and resid 349 and name HB ))
2.900 1.000 1.000 peak 2812 spectrum 1 weight 0.10000E+01 volume 0.16184E-02 ppm1 1.254 ppm2 4.425 CV 1
ASSI { 1964}
( segid " " and resid 243 and name HD2%)
(( segid " " and resid 244 and name H ))
5.100 3.300 0.900 peak 1964 spectrum 1 weight 0.10000E+01 volume 0.93890E-03 ppm1 0.168 ppm2 8.553 CV 1
ASSI { 1579}
( segid " " and resid 356 and name HG1%)
( segid " " and resid 287 and name HD% )
3.400 1.400 1.400 peak 1579 spectrum 1 weight 0.10000E+01 volume 0.73025E-03 ppm1 0.791 ppm2 6.332 CV 1
ASSI { 4613}
(( segid " " and resid 301 and name HB2 ))
(( segid " " and resid 301 and name HE21))
6.000 4.400 0.000 peak 4613 spectrum 1 weight 0.10000E+01 volume 0.26221E-03 ppm1 1.984 ppm2 6.688 CV 1
ASSI { 2492}
(( segid " " and resid 372 and name HA ))
(( segid " " and resid 372 and name H ))
3.000 1.100 1.100 peak 2492 spectrum 1 weight 0.10000E+01 volume 0.12152E-02 ppm1 3.806 ppm2 7.923 CV 1
ASSI { 3466}
( segid " " and resid 436 and name HD1%)
(( segid " " and resid 436 and name HG ))
2.200 0.600 0.600 peak 3466 spectrum 1 weight 0.10000E+01 volume 0.55235E-02 ppm1 1.012 ppm2 1.601 CV 1
ASSI { 3057}
(( segid " " and resid 322 and name HA ))
(( segid " " and resid 325 and name H ))
3.700 1.700 1.700 peak 3057 spectrum 1 weight 0.10000E+01 volume 0.44267E-03 ppm1 3.366 ppm2 8.492 CV 1
ASSI { 346}
( segid " " and resid 189 and name HD1%)
(( segid " " and resid 197 and name H ))
4.200 2.200 1.800 peak 346 spectrum 1 weight 0.10000E+01 volume 0.69359E-03 ppm1 0.736 ppm2 8.045 CV 1
ASSI { 3492}
(( segid " " and resid 318 and name HG13))
(( segid " " and resid 315 and name HA ))
5.600 3.900 0.400 peak 3492 spectrum 1 weight 0.10000E+01 volume 0.51315E-03 ppm1 0.609 ppm2 3.812 CV 1
ASSI { 657}
(( segid " " and resid 189 and name HB ))
(( segid " " and resid 248 and name HA ))
3.900 1.900 1.900 peak 657 spectrum 1 weight 0.10000E+01 volume 0.37780E-03 ppm1 2.201 ppm2 4.882 CV 1
ASSI { 3544}
( segid " " and resid 372 and name HG1%)
(( segid " " and resid 374 and name H ))
3.300 1.300 1.300 peak 3544 spectrum 1 weight 0.10000E+01 volume 0.17706E-02 ppm1 0.644 ppm2 6.323 CV 1
ASSI { 3904}
( segid " " and resid 357 and name HD2%)
(( segid " " and resid 357 and name HA ))
2.600 0.800 0.800 peak 3904 spectrum 1 weight 0.10000E+01 volume 0.39444E-02 ppm1 0.875 ppm2 3.876 CV 1
ASSI { 3521}
( segid " " and resid 438 and name HB% )
(( segid " " and resid 435 and name HA ))
2.700 0.900 0.900 peak 3521 spectrum 1 weight 0.10000E+01 volume 0.29576E-02 ppm1 1.600 ppm2 3.845 CV 1
ASSI { 3188}
(( segid " " and resid 346 and name HG ))
(( segid " " and resid 346 and name H ))
3.800 1.800 1.800 peak 3188 spectrum 1 weight 0.10000E+01 volume 0.11813E-02 ppm1 1.748 ppm2 8.984 CV 1
ASSI { 2750}
( segid " " and resid 371 and name HG2%)
( segid " " and resid 373 and name HD1%)
4.600 2.600 1.400 peak 2750 spectrum 1 weight 0.10000E+01 volume 0.80355E-03 ppm1 0.959 ppm2 -0.189 CV 1
ASSI { 1327}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 315 and name H ))
3.800 1.800 1.800 peak 1327 spectrum 1 weight 0.10000E+01 volume 0.13900E-02 ppm1 0.350 ppm2 8.345 CV 1
ASSI { 3817}
(( segid " " and resid 363 and name HA ))
(( segid " " and resid 363 and name HB2 ))
4.200 2.200 1.800 peak 3817 spectrum 1 weight 0.10000E+01 volume 0.23684E-03 ppm1 5.084 ppm2 3.151 CV 1
ASSI { 3893}
( segid " " and resid 211 and name HB% )
(( segid " " and resid 210 and name HA ))
4.800 2.900 1.200 peak 3893 spectrum 1 weight 0.10000E+01 volume 0.10630E-02 ppm1 1.685 ppm2 4.030 CV 1
ASSI { 491}
( segid " " and resid 373 and name HD2%)
(( segid " " and resid 373 and name HA ))
3.100 1.200 1.200 peak 491 spectrum 1 weight 0.10000E+01 volume 0.21964E-02 ppm1 0.513 ppm2 2.312 CV 1
ASSI { 1468}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 215 and name HG3 ))
2.500 0.800 0.800 peak 1468 spectrum 1 weight 0.10000E+01 volume 0.90731E-02 ppm1 2.221 ppm2 2.605 CV 1
ASSI { 2294}
(( segid " " and resid 202 and name HG3 ))
(( segid " " and resid 202 and name HG2 ))
1.800 0.400 0.400 peak 2294 spectrum 1 weight 0.10000E+01 volume 0.65103E-02 ppm1 2.771 ppm2 2.311 CV 1
ASSI { 2173}
(( segid " " and resid 361 and name HA ))
(( segid " " and resid 361 and name H ))
3.300 1.400 1.400 peak 2173 spectrum 1 weight 0.10000E+01 volume 0.60901E-03 ppm1 4.202 ppm2 8.360 CV 1
ASSI { 1770}
(( segid " " and resid 444 and name HG3 ))
(( segid " " and resid 444 and name H ))
3.500 1.500 1.500 peak 1770 spectrum 1 weight 0.10000E+01 volume 0.40713E-02 ppm1 1.660 ppm2 7.758 CV 1
ASSI { 2535}
( segid " " and resid 373 and name HD1%)
( segid " " and resid 217 and name HD1%)
2.400 2.400 3.600 peak 2535 spectrum 1 weight 0.10000E+01 volume 0.18721E-02 ppm1 -0.195 ppm2 -0.034 CV 1
ASSI { 2930}
(( segid " " and resid 413 and name HB2 ))
(( segid " " and resid 413 and name H ))
2.800 1.000 1.000 peak 2930 spectrum 1 weight 0.10000E+01 volume 0.12716E-02 ppm1 3.089 ppm2 8.491 CV 1
ASSI { 3468}
(( segid " " and resid 284 and name HG3 ))
( segid " " and resid 287 and name HD% )
4.400 2.400 1.600 peak 3468 spectrum 1 weight 0.10000E+01 volume 0.63439E-03 ppm1 2.585 ppm2 6.339 CV 1
OR { 3468}
(( segid " " and resid 284 and name HG2 ))
( segid " " and resid 287 and name HD% )
ASSI { 2204}
(( segid " " and resid 377 and name HG2 ))
(( segid " " and resid 378 and name H ))
3.000 3.000 3.000 peak 2204 spectrum 1 weight 0.10000E+01 volume 0.48494E-03 ppm1 2.522 ppm2 8.584 CV 1
ASSI { 139}
( segid " " and resid 409 and name HD2%)
(( segid " " and resid 413 and name HD2 ))
3.700 1.700 1.700 peak 139 spectrum 1 weight 0.10000E+01 volume 0.13336E-02 ppm1 0.738 ppm2 6.793 CV 1
ASSI { 3910}
( segid " " and resid 438 and name HB% )
(( segid " " and resid 382 and name HH2 ))
3.300 1.400 1.400 peak 3910 spectrum 1 weight 0.10000E+01 volume 0.20554E-02 ppm1 1.596 ppm2 7.174 CV 1
ASSI { 2121}
( segid " " and resid 300 and name HG2%)
(( segid " " and resid 299 and name H ))
4.000 2.000 2.000 peak 2121 spectrum 1 weight 0.10000E+01 volume 0.10066E-02 ppm1 0.541 ppm2 7.497 CV 1
ASSI { 3545}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 197 and name H ))
2.700 0.900 0.900 peak 3545 spectrum 1 weight 0.10000E+01 volume 0.23063E-02 ppm1 1.455 ppm2 8.039 CV 1
ASSI { 4033}
(( segid " " and resid 299 and name HG3 ))
(( segid " " and resid 299 and name HE3 ))
3.400 1.500 1.500 peak 4033 spectrum 1 weight 0.10000E+01 volume 0.49058E-03 ppm1 1.359 ppm2 2.594 CV 1
OR { 4033}
(( segid " " and resid 299 and name HG2 ))
(( segid " " and resid 299 and name HE3 ))
ASSI { 3090}
(( segid " " and resid 407 and name HB2 ))
(( segid " " and resid 407 and name H ))
3.500 1.500 1.500 peak 3090 spectrum 1 weight 0.10000E+01 volume 0.31296E-03 ppm1 3.286 ppm2 7.816 CV 1
ASSI { 760}
( segid " " and resid 192 and name HD1%)
( segid " " and resid 197 and name HB% )
2.900 1.000 1.000 peak 760 spectrum 1 weight 0.10000E+01 volume 0.44465E-02 ppm1 0.871 ppm2 1.447 CV 1
ASSI { 2717}
( segid " " and resid 318 and name HG2%)
( segid " " and resid 322 and name HD1%)
4.100 2.100 1.900 peak 2717 spectrum 1 weight 0.10000E+01 volume 0.39416E-02 ppm1 0.352 ppm2 -0.166 CV 1
ASSI { 3750}
(( segid " " and resid 377 and name HB3 ))
( segid " " and resid 204 and name HE% )
5.500 3.800 0.500 peak 3750 spectrum 1 weight 0.10000E+01 volume 0.32706E-03 ppm1 1.919 ppm2 6.863 CV 1
OR { 3750}
(( segid " " and resid 377 and name HB3 ))
( segid " " and resid 204 and name HD% )
ASSI { 1420}
(( segid " " and resid 334 and name HG3 ))
( segid " " and resid 335 and name HG2%)
2.500 0.800 0.800 peak 1420 spectrum 1 weight 0.10000E+01 volume 0.22133E-02 ppm1 2.148 ppm2 1.245 CV 1
ASSI { 1433}
( segid " " and resid 339 and name HG2%)
(( segid " " and resid 361 and name HB3 ))
3.800 1.800 1.800 peak 1433 spectrum 1 weight 0.10000E+01 volume 0.19229E-02 ppm1 0.706 ppm2 2.538 CV 1
ASSI { 1754}
(( segid " " and resid 222 and name HG3 ))
(( segid " " and resid 223 and name H ))
4.800 2.900 1.200 peak 1754 spectrum 1 weight 0.10000E+01 volume 0.49904E-03 ppm1 0.981 ppm2 8.426 CV 1
ASSI { 1690}
( segid " " and resid 300 and name HG1%)
( segid " " and resid 359 and name HG2%)
3.300 1.300 1.300 peak 1690 spectrum 1 weight 0.10000E+01 volume 0.21287E-02 ppm1 0.077 ppm2 -0.456 CV 1
ASSI { 2217}
(( segid " " and resid 332 and name HB3 ))
(( segid " " and resid 332 and name HA ))
3.300 1.300 1.300 peak 2217 spectrum 1 weight 0.10000E+01 volume 0.46802E-03 ppm1 2.623 ppm2 4.182 CV 1
ASSI { 1828}
(( segid " " and resid 309 and name HG3 ))
(( segid " " and resid 310 and name H ))
2.400 2.400 3.600 peak 1828 spectrum 1 weight 0.10000E+01 volume 0.20216E-02 ppm1 2.160 ppm2 7.076 CV 1
ASSI { 1921}
(( segid " " and resid 242 and name HG3 ))
( segid " " and resid 243 and name HD1%)
5.600 3.900 0.400 peak 1921 spectrum 1 weight 0.10000E+01 volume 0.34398E-03 ppm1 2.323 ppm2 0.014 CV 1
ASSI { 1571}
(( segid " " and resid 334 and name HG2 ))
(( segid " " and resid 331 and name HE2 ))
3.600 1.600 1.600 peak 1571 spectrum 1 weight 0.10000E+01 volume 0.15000E-02 ppm1 2.194 ppm2 2.901 CV 1
OR { 1571}
(( segid " " and resid 334 and name HG2 ))
(( segid " " and resid 331 and name HE3 ))
ASSI { 4163}
(( segid " " and resid 399 and name HG2 ))
(( segid " " and resid 399 and name HE3 ))
3.200 1.300 1.300 peak 4163 spectrum 1 weight 0.10000E+01 volume 0.17678E-02 ppm1 1.341 ppm2 2.858 CV 1
OR { 4163}
(( segid " " and resid 399 and name HG2 ))
(( segid " " and resid 399 and name HE2 ))
ASSI { 2690}
( segid " " and resid 233 and name HG2%)
(( segid " " and resid 261 and name HD22))
4.000 2.000 2.000 peak 2690 spectrum 1 weight 0.10000E+01 volume 0.11842E-02 ppm1 0.950 ppm2 6.629 CV 1
ASSI { 3919}
(( segid " " and resid 284 and name HB2 ))
(( segid " " and resid 284 and name H ))
2.800 1.000 1.000 peak 3919 spectrum 1 weight 0.10000E+01 volume 0.11504E-02 ppm1 2.240 ppm2 8.099 CV 1
OR { 3919}
(( segid " " and resid 284 and name HB3 ))
(( segid " " and resid 284 and name H ))
ASSI { 2660}
(( segid " " and resid 319 and name HA ))
(( segid " " and resid 319 and name HB2 ))
3.700 1.700 1.700 peak 2660 spectrum 1 weight 0.10000E+01 volume 0.55545E-03 ppm1 2.283 ppm2 3.289 CV 1
ASSI { 4235}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 279 and name HA ))
2.200 0.600 0.600 peak 4235 spectrum 1 weight 0.10000E+01 volume 0.54248E-02 ppm1 0.168 ppm2 4.307 CV 1
ASSI { 3920}
( segid " " and resid 318 and name HG2%)
( segid " " and resid 368 and name HE% )
2.900 1.100 1.100 peak 3920 spectrum 1 weight 0.10000E+01 volume 0.40600E-02 ppm1 0.349 ppm2 6.755 CV 1
ASSI { 2862}
( segid " " and resid 279 and name HD1%)
( segid " " and resid 303 and name HE% )
4.100 2.100 1.900 peak 2862 spectrum 1 weight 0.10000E+01 volume 0.11052E-02 ppm1 0.167 ppm2 6.819 CV 1
ASSI { 2984}
(( segid " " and resid 222 and name HB2 ))
(( segid " " and resid 222 and name HA ))
3.100 1.200 1.200 peak 2984 spectrum 1 weight 0.10000E+01 volume 0.22358E-02 ppm1 1.210 ppm2 3.781 CV 1
ASSI { 4182}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 402 and name H ))
4.000 2.000 2.000 peak 4182 spectrum 1 weight 0.10000E+01 volume 0.21146E-02 ppm1 0.768 ppm2 8.712 CV 1
ASSI { 4307}
( segid " " and resid 243 and name HD1%)
( segid " " and resid 247 and name HE% )
4.300 2.300 1.700 peak 4307 spectrum 1 weight 0.10000E+01 volume 0.80073E-03 ppm1 0.012 ppm2 6.479 CV 1
ASSI { 3957}
(( segid " " and resid 334 and name HA ))
(( segid " " and resid 334 and name HG3 ))
3.600 1.700 1.700 peak 3957 spectrum 1 weight 0.10000E+01 volume 0.23684E-02 ppm1 4.424 ppm2 2.172 CV 1
OR { 3957}
(( segid " " and resid 334 and name HA ))
(( segid " " and resid 334 and name HG2 ))
ASSI { 3121}
( segid " " and resid 297 and name HG2%)
(( segid " " and resid 301 and name HG3 ))
2.600 0.900 0.900 peak 3121 spectrum 1 weight 0.10000E+01 volume 0.59293E-02 ppm1 1.114 ppm2 2.297 CV 1
ASSI { 3858}
(( segid " " and resid 385 and name HG2 ))
(( segid " " and resid 385 and name HA ))
3.500 1.600 1.600 peak 3858 spectrum 1 weight 0.10000E+01 volume 0.18609E-02 ppm1 2.320 ppm2 4.169 CV 1
ASSI { 3157}
( segid " " and resid 360 and name HD% )
(( segid " " and resid 360 and name HA ))
3.100 1.200 1.200 peak 3157 spectrum 1 weight 0.10000E+01 volume 0.12124E-02 ppm1 7.076 ppm2 4.258 CV 1
OR { 3157}
( segid " " and resid 360 and name HE% )
(( segid " " and resid 360 and name HA ))
ASSI { 3101}
(( segid " " and resid 252 and name HB2 ))
(( segid " " and resid 252 and name HA ))
2.600 0.900 0.900 peak 3101 spectrum 1 weight 0.10000E+01 volume 0.52781E-02 ppm1 3.737 ppm2 4.334 CV 1
ASSI { 3718}
(( segid " " and resid 217 and name HG13))
(( segid " " and resid 217 and name HA ))
3.000 1.100 1.100 peak 3718 spectrum 1 weight 0.10000E+01 volume 0.67102E-03 ppm1 0.473 ppm2 2.987 CV 1
ASSI { 753}
( segid " " and resid 316 and name HD2%)
(( segid " " and resid 320 and name HD1 ))
4.000 2.000 2.000 peak 753 spectrum 1 weight 0.10000E+01 volume 0.10770E-02 ppm1 0.749 ppm2 7.273 CV 1
ASSI { 1190}
( segid " " and resid 192 and name HG2%)
(( segid " " and resid 192 and name HB ))
2.400 0.700 0.700 peak 1190 spectrum 1 weight 0.10000E+01 volume 0.40572E-02 ppm1 0.683 ppm2 2.190 CV 1
ASSI { 3842}
(( segid " " and resid 399 and name HD3 ))
(( segid " " and resid 399 and name H ))
3.600 1.600 1.600 peak 3842 spectrum 1 weight 0.10000E+01 volume 0.27236E-02 ppm1 1.601 ppm2 8.327 CV 1
OR { 3842}
(( segid " " and resid 399 and name HD2 ))
(( segid " " and resid 399 and name H ))
ASSI { 3109}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 361 and name HZ ))
3.700 1.700 1.700 peak 3109 spectrum 1 weight 0.10000E+01 volume 0.15169E-02 ppm1 -0.166 ppm2 6.643 CV 1
ASSI { 2409}
( segid " " and resid 344 and name HD1%)
(( segid " " and resid 344 and name HB ))
2.100 0.600 0.600 peak 2409 spectrum 1 weight 0.10000E+01 volume 0.14281E-01 ppm1 0.819 ppm2 1.895 CV 1
ASSI { 1847}
(( segid " " and resid 212 and name HB ))
(( segid " " and resid 212 and name HA ))
3.400 1.400 1.400 peak 1847 spectrum 1 weight 0.10000E+01 volume 0.56388E-03 ppm1 1.184 ppm2 3.241 CV 1
ASSI { 4552}
( segid " " and resid 223 and name HE% )
(( segid " " and resid 256 and name HB2 ))
5.000 3.200 1.000 peak 4552 spectrum 1 weight 0.10000E+01 volume 0.40883E-03 ppm1 6.645 ppm2 2.036 CV 1
ASSI { 1755}
(( segid " " and resid 369 and name HA3 ))
(( segid " " and resid 365 and name HG3 ))
3.100 3.100 2.900 peak 1755 spectrum 1 weight 0.10000E+01 volume 0.42293E-03 ppm1 3.982 ppm2 2.354 CV 1
OR { 1755}
(( segid " " and resid 369 and name HA3 ))
(( segid " " and resid 365 and name HG2 ))
ASSI { 2587}
(( segid " " and resid 433 and name HB3 ))
(( segid " " and resid 433 and name H ))
4.100 2.100 1.900 peak 2587 spectrum 1 weight 0.10000E+01 volume 0.58362E-03 ppm1 2.175 ppm2 8.313 CV 1
ASSI { 129}
( segid " " and resid 438 and name HB% )
(( segid " " and resid 440 and name HG2 ))
3.900 1.900 1.900 peak 129 spectrum 1 weight 0.10000E+01 volume 0.26334E-02 ppm1 1.599 ppm2 1.355 CV 1
OR { 129}
( segid " " and resid 438 and name HB% )
(( segid " " and resid 440 and name HG3 ))
ASSI { 2405}
( segid " " and resid 243 and name HD1%)
( segid " " and resid 247 and name HD% )
6.000 4.500 0.000 peak 2405 spectrum 1 weight 0.10000E+01 volume 0.23684E-03 ppm1 0.018 ppm2 7.333 CV 1
ASSI { 4716}
( segid " " and resid 189 and name HD1%)
( segid " " and resid 189 and name HG2%)
2.300 0.600 0.600 peak 4716 spectrum 1 weight 0.10000E+01 volume 0.77140E-02 ppm1 0.736 ppm2 0.923 CV 1
ASSI { 1339}
(( segid " " and resid 303 and name HB3 ))
( segid " " and resid 367 and name HD1%)
3.600 1.700 1.700 peak 1339 spectrum 1 weight 0.10000E+01 volume 0.73871E-03 ppm1 2.589 ppm2 0.668 CV 1
ASSI { 4452}
(( segid " " and resid 446 and name HA ))
(( segid " " and resid 445 and name HB3 ))
3.200 1.300 1.300 peak 4452 spectrum 1 weight 0.10000E+01 volume 0.16043E-02 ppm1 4.045 ppm2 1.869 CV 1
ASSI { 4347}
( segid " " and resid 195 and name HB% )
(( segid " " and resid 196 and name HA ))
3.700 1.700 1.700 peak 4347 spectrum 1 weight 0.10000E+01 volume 0.19257E-02 ppm1 1.359 ppm2 4.382 CV 1
ASSI { 1833}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 322 and name H ))
3.800 1.800 1.800 peak 1833 spectrum 1 weight 0.10000E+01 volume 0.18186E-02 ppm1 0.398 ppm2 8.205 CV 1
ASSI { 1380}
( segid " " and resid 266 and name HD1%)
(( segid " " and resid 270 and name HB2 ))
2.200 0.600 0.600 peak 1380 spectrum 1 weight 0.10000E+01 volume 0.69443E-02 ppm1 0.879 ppm2 2.871 CV 1
ASSI { 3662}
( segid " " and resid 255 and name HD1%)
(( segid " " and resid 255 and name HG ))
2.300 0.700 0.700 peak 3662 spectrum 1 weight 0.10000E+01 volume 0.74520E-02 ppm1 0.600 ppm2 1.693 CV 1
OR { 3662}
( segid " " and resid 255 and name HD1%)
(( segid " " and resid 255 and name HB2 ))
ASSI { 3220}
(( segid " " and resid 366 and name HG2 ))
( segid " " and resid 300 and name HG2%)
3.800 1.800 1.800 peak 3220 spectrum 1 weight 0.10000E+01 volume 0.23486E-02 ppm1 2.281 ppm2 0.534 CV 1
ASSI { 1720}
(( segid " " and resid 331 and name HE2 ))
(( segid " " and resid 331 and name H ))
3.900 1.900 1.900 peak 1720 spectrum 1 weight 0.10000E+01 volume 0.13562E-02 ppm1 2.915 ppm2 7.158 CV 1
ASSI { 1331}
( segid " " and resid 391 and name HD1%)
(( segid " " and resid 442 and name HE2 ))
3.200 1.300 1.300 peak 1331 spectrum 1 weight 0.10000E+01 volume 0.27744E-02 ppm1 0.707 ppm2 2.888 CV 1
OR { 1331}
( segid " " and resid 391 and name HD1%)
(( segid " " and resid 442 and name HE3 ))
ASSI { 4778}
(( segid " " and resid 333 and name HA ))
(( segid " " and resid 333 and name HB2 ))
2.300 0.700 0.700 peak 4778 spectrum 1 weight 0.10000E+01 volume 0.92000E-02 ppm1 4.004 ppm2 1.600 CV 1
OR { 4778}
(( segid " " and resid 333 and name HA ))
(( segid " " and resid 333 and name HB3 ))
ASSI { 4155}
(( segid " " and resid 277 and name HA ))
(( segid " " and resid 277 and name HB3 ))
3.100 1.200 1.200 peak 4155 spectrum 1 weight 0.10000E+01 volume 0.81201E-03 ppm1 4.489 ppm2 1.977 CV 1
ASSI { 1279}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 369 and name H ))
4.100 2.100 1.900 peak 1279 spectrum 1 weight 0.10000E+01 volume 0.12660E-02 ppm1 0.364 ppm2 7.791 CV 1
ASSI { 1844}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 207 and name H ))
4.000 2.000 2.000 peak 1844 spectrum 1 weight 0.10000E+01 volume 0.32029E-02 ppm1 0.885 ppm2 6.890 CV 1
ASSI { 3130}
(( segid " " and resid 348 and name HG2 ))
(( segid " " and resid 348 and name HA ))
4.800 2.900 1.200 peak 3130 spectrum 1 weight 0.10000E+01 volume 0.74717E-03 ppm1 2.051 ppm2 4.497 CV 1
ASSI { 2118}
(( segid " " and resid 354 and name HB3 ))
(( segid " " and resid 354 and name HA ))
3.100 1.200 1.200 peak 2118 spectrum 1 weight 0.10000E+01 volume 0.17622E-02 ppm1 2.675 ppm2 4.168 CV 1
ASSI { 4675}
(( segid " " and resid 409 and name HB3 ))
(( segid " " and resid 409 and name HA ))
4.000 2.000 2.000 peak 4675 spectrum 1 weight 0.10000E+01 volume 0.41165E-03 ppm1 1.914 ppm2 3.668 CV 1
ASSI { 2481}
( segid " " and resid 255 and name HD1%)
(( segid " " and resid 255 and name HA ))
2.300 0.700 0.700 peak 2481 spectrum 1 weight 0.10000E+01 volume 0.52471E-02 ppm1 0.600 ppm2 3.957 CV 1
ASSI { 3837}
(( segid " " and resid 351 and name HG3 ))
(( segid " " and resid 351 and name HA ))
2.600 0.800 0.800 peak 3837 spectrum 1 weight 0.10000E+01 volume 0.29858E-02 ppm1 2.065 ppm2 3.830 CV 1
ASSI { 1897}
( segid " " and resid 220 and name HG1%)
(( segid " " and resid 217 and name HA ))
3.300 1.300 1.300 peak 1897 spectrum 1 weight 0.10000E+01 volume 0.13223E-02 ppm1 1.118 ppm2 2.985 CV 1
OR { 1897}
( segid " " and resid 220 and name HG2%)
(( segid " " and resid 217 and name HA ))
ASSI { 2696}
(( segid " " and resid 319 and name HB2 ))
(( segid " " and resid 319 and name HG ))
3.200 1.200 1.200 peak 2696 spectrum 1 weight 0.10000E+01 volume 0.41729E-03 ppm1 3.306 ppm2 4.087 CV 1
ASSI { 3004}
( segid " " and resid 290 and name HB% )
( segid " " and resid 303 and name HE% )
2.600 0.800 0.800 peak 3004 spectrum 1 weight 0.10000E+01 volume 0.31973E-02 ppm1 1.530 ppm2 6.808 CV 1
ASSI { 530}
(( segid " " and resid 242 and name HB2 ))
(( segid " " and resid 241 and name H ))
5.200 3.400 0.800 peak 530 spectrum 1 weight 0.10000E+01 volume 0.44267E-03 ppm1 2.230 ppm2 8.366 CV 1
ASSI { 3559}
( segid " " and resid 192 and name HG2%)
(( segid " " and resid 193 and name HD2 ))
3.700 1.700 1.700 peak 3559 spectrum 1 weight 0.10000E+01 volume 0.19088E-02 ppm1 0.686 ppm2 3.868 CV 1
ASSI { 230}
(( segid " " and resid 227 and name HB2 ))
(( segid " " and resid 226 and name H ))
4.500 2.600 1.500 peak 230 spectrum 1 weight 0.10000E+01 volume 0.41165E-03 ppm1 3.132 ppm2 7.447 CV 1
ASSI { 4091}
(( segid " " and resid 257 and name HB3 ))
(( segid " " and resid 258 and name H ))
4.000 2.000 2.000 peak 4091 spectrum 1 weight 0.10000E+01 volume 0.34680E-03 ppm1 2.374 ppm2 8.127 CV 1
ASSI { 2160}
( segid " " and resid 385 and name HE% )
(( segid " " and resid 382 and name HZ2 ))
3.800 1.800 1.800 peak 2160 spectrum 1 weight 0.10000E+01 volume 0.12575E-02 ppm1 1.915 ppm2 7.487 CV 1
ASSI { 3933}
( segid " " and resid 385 and name HE% )
(( segid " " and resid 387 and name HB ))
4.300 2.300 1.700 peak 3933 spectrum 1 weight 0.10000E+01 volume 0.78663E-03 ppm1 1.916 ppm2 4.004 CV 1
ASSI { 1805}
(( segid " " and resid 339 and name HA ))
(( segid " " and resid 339 and name H ))
3.600 1.600 1.600 peak 1805 spectrum 1 weight 0.10000E+01 volume 0.35527E-03 ppm1 2.991 ppm2 8.384 CV 1
ASSI { 3280}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 319 and name HB2 ))
3.000 1.100 1.100 peak 3280 spectrum 1 weight 0.10000E+01 volume 0.24050E-02 ppm1 0.367 ppm2 3.276 CV 1
ASSI { 4611}
(( segid " " and resid 331 and name HD2 ))
(( segid " " and resid 331 and name H ))
3.700 1.700 1.700 peak 4611 spectrum 1 weight 0.10000E+01 volume 0.19849E-02 ppm1 1.641 ppm2 7.166 CV 1
OR { 4611}
(( segid " " and resid 331 and name HD3 ))
(( segid " " and resid 331 and name H ))
ASSI { 4681}
(( segid " " and resid 257 and name HB2 ))
(( segid " " and resid 257 and name HA ))
3.300 1.400 1.400 peak 4681 spectrum 1 weight 0.10000E+01 volume 0.11137E-02 ppm1 2.443 ppm2 4.402 CV 1
ASSI { 3863}
(( segid " " and resid 374 and name HB2 ))
(( segid " " and resid 374 and name H ))
2.700 0.900 0.900 peak 3863 spectrum 1 weight 0.10000E+01 volume 0.13477E-02 ppm1 1.621 ppm2 6.318 CV 1
ASSI { 4532}
( segid " " and resid 333 and name HD1%)
(( segid " " and resid 333 and name HA ))
2.100 0.600 0.600 peak 4532 spectrum 1 weight 0.10000E+01 volume 0.34750E-01 ppm1 0.880 ppm2 4.003 CV 1
ASSI { 310}
(( segid " " and resid 426 and name HG2 ))
(( segid " " and resid 430 and name HZ2 ))
5.700 4.000 0.300 peak 310 spectrum 1 weight 0.10000E+01 volume 0.40600E-03 ppm1 2.261 ppm2 7.295 CV 1
ASSI { 4150}
( segid " " and resid 357 and name HD1%)
( segid " " and resid 322 and name HD1%)
2.700 0.900 0.900 peak 4150 spectrum 1 weight 0.10000E+01 volume 0.34595E-02 ppm1 0.674 ppm2 -0.165 CV 1
ASSI { 2759}
(( segid " " and resid 396 and name HA ))
(( segid " " and resid 399 and name H ))
3.700 1.700 1.700 peak 2759 spectrum 1 weight 0.10000E+01 volume 0.67666E-03 ppm1 4.006 ppm2 8.326 CV 1
ASSI { 3053}
(( segid " " and resid 248 and name HB2 ))
(( segid " " and resid 248 and name HB3 ))
2.800 1.000 1.000 peak 3053 spectrum 1 weight 0.10000E+01 volume 0.58362E-03 ppm1 2.505 ppm2 2.912 CV 1
ASSI { 373}
( segid " " and resid 263 and name HG2%)
(( segid " " and resid 216 and name HG ))
3.300 1.300 1.300 peak 373 spectrum 1 weight 0.10000E+01 volume 0.21767E-02 ppm1 0.809 ppm2 2.764 CV 1
OR { 373}
( segid " " and resid 263 and name HG2%)
(( segid " " and resid 216 and name HB3 ))
ASSI { 3072}
(( segid " " and resid 374 and name HB2 ))
(( segid " " and resid 320 and name HZ2 ))
3.800 1.800 1.800 peak 3072 spectrum 1 weight 0.10000E+01 volume 0.63721E-03 ppm1 1.620 ppm2 7.366 CV 1
ASSI { 2707}
(( segid " " and resid 411 and name HA ))
(( segid " " and resid 414 and name HB3 ))
3.300 1.400 1.400 peak 2707 spectrum 1 weight 0.10000E+01 volume 0.96710E-03 ppm1 3.826 ppm2 2.033 CV 1
ASSI { 706}
( segid " " and resid 357 and name HD1%)
(( segid " " and resid 346 and name HB3 ))
2.400 0.700 0.700 peak 706 spectrum 1 weight 0.10000E+01 volume 0.30507E-02 ppm1 0.674 ppm2 1.476 CV 1
ASSI { 1746}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 330 and name HA ))
3.200 1.300 1.300 peak 1746 spectrum 1 weight 0.10000E+01 volume 0.16240E-02 ppm1 0.748 ppm2 4.121 CV 1
ASSI { 3550}
(( segid " " and resid 420 and name HG13))
(( segid " " and resid 420 and name HA ))
2.900 1.000 1.000 peak 3550 spectrum 1 weight 0.10000E+01 volume 0.42152E-02 ppm1 1.382 ppm2 3.977 CV 1
ASSI { 808}
(( segid " " and resid 327 and name HD2 ))
( segid " " and resid 373 and name HD2%)
5.300 3.500 0.700 peak 808 spectrum 1 weight 0.10000E+01 volume 0.26221E-03 ppm1 7.218 ppm2 0.464 CV 1
OR { 808}
(( segid " " and resid 327 and name HD2 ))
(( segid " " and resid 373 and name HB2 ))
ASSI { 2760}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 350 and name H ))
2.400 0.700 0.700 peak 2760 spectrum 1 weight 0.10000E+01 volume 0.25291E-02 ppm1 0.730 ppm2 7.620 CV 1
ASSI { 3886}
(( segid " " and resid 344 and name HG13))
(( segid " " and resid 344 and name HB ))
2.600 0.800 0.800 peak 3886 spectrum 1 weight 0.10000E+01 volume 0.22274E-02 ppm1 1.222 ppm2 1.897 CV 1
ASSI { 2191}
( segid " " and resid 204 and name HE% )
(( segid " " and resid 403 and name HD3 ))
4.400 2.500 1.600 peak 2191 spectrum 1 weight 0.10000E+01 volume 0.55545E-03 ppm1 6.860 ppm2 3.233 CV 1
OR { 2191}
( segid " " and resid 204 and name HE% )
(( segid " " and resid 403 and name HD2 ))
ASSI { 4439}
(( segid " " and resid 393 and name HA ))
(( segid " " and resid 393 and name HG3 ))
3.600 1.600 1.600 peak 4439 spectrum 1 weight 0.10000E+01 volume 0.20216E-02 ppm1 4.280 ppm2 2.270 CV 1
ASSI { 534}
(( segid " " and resid 304 and name HB2 ))
( segid " " and resid 367 and name HD1%)
5.000 3.100 1.000 peak 534 spectrum 1 weight 0.10000E+01 volume 0.86278E-03 ppm1 2.232 ppm2 0.669 CV 1
ASSI { 3398}
(( segid " " and resid 351 and name HG3 ))
(( segid " " and resid 351 and name HE22))
3.800 1.800 1.800 peak 3398 spectrum 1 weight 0.10000E+01 volume 0.21908E-02 ppm1 2.065 ppm2 7.563 CV 1
ASSI { 1717}
(( segid " " and resid 320 and name HA ))
(( segid " " and resid 320 and name HB3 ))
3.100 1.200 1.200 peak 1717 spectrum 1 weight 0.10000E+01 volume 0.55263E-03 ppm1 3.835 ppm2 3.278 CV 1
ASSI { 2995}
(( segid " " and resid 352 and name HA ))
(( segid " " and resid 353 and name H ))
3.000 1.100 1.100 peak 2995 spectrum 1 weight 0.10000E+01 volume 0.89659E-03 ppm1 4.152 ppm2 8.955 CV 1
ASSI { 1613}
( segid " " and resid 240 and name HG2%)
( segid " " and resid 243 and name HD1%)
3.900 1.900 1.900 peak 1613 spectrum 1 weight 0.10000E+01 volume 0.16156E-02 ppm1 0.773 ppm2 0.017 CV 1
ASSI { 4762}
(( segid " " and resid 230 and name HA ))
(( segid " " and resid 230 and name H ))
3.400 1.500 1.500 peak 4762 spectrum 1 weight 0.10000E+01 volume 0.48212E-03 ppm1 3.881 ppm2 7.095 CV 1
ASSI { 3702}
(( segid " " and resid 307 and name HG ))
(( segid " " and resid 307 and name H ))
4.500 2.600 1.500 peak 3702 spectrum 1 weight 0.10000E+01 volume 0.63721E-03 ppm1 2.303 ppm2 8.697 CV 1
ASSI { 515}
( segid " " and resid 362 and name HG2%)
( segid " " and resid 358 and name HE% )
2.900 1.100 1.100 peak 515 spectrum 1 weight 0.10000E+01 volume 0.29717E-02 ppm1 0.560 ppm2 6.703 CV 1
ASSI { 1753}
(( segid " " and resid 304 and name HG2 ))
(( segid " " and resid 304 and name HE22))
3.500 1.500 1.500 peak 1753 spectrum 1 weight 0.10000E+01 volume 0.31776E-02 ppm1 2.451 ppm2 6.996 CV 1
ASSI { 3965}
(( segid " " and resid 295 and name HB ))
(( segid " " and resid 295 and name H ))
3.700 1.700 1.700 peak 3965 spectrum 1 weight 0.10000E+01 volume 0.39190E-03 ppm1 4.380 ppm2 7.449 CV 1
ASSI { 3077}
(( segid " " and resid 227 and name HB3 ))
( segid " " and resid 230 and name HG2%)
4.200 2.200 1.800 peak 3077 spectrum 1 weight 0.10000E+01 volume 0.13195E-02 ppm1 2.812 ppm2 0.949 CV 1
ASSI { 3112}
( segid " " and resid 223 and name HE% )
(( segid " " and resid 256 and name HB3 ))
3.800 1.800 1.800 peak 3112 spectrum 1 weight 0.10000E+01 volume 0.59208E-03 ppm1 6.643 ppm2 1.904 CV 1
ASSI { 4265}
(( segid " " and resid 421 and name HB2 ))
(( segid " " and resid 421 and name H ))
3.000 1.100 1.100 peak 4265 spectrum 1 weight 0.10000E+01 volume 0.18101E-02 ppm1 1.683 ppm2 8.375 CV 1
ASSI { 2533}
(( segid " " and resid 421 and name HB3 ))
(( segid " " and resid 421 and name HA ))
2.500 0.800 0.800 peak 2533 spectrum 1 weight 0.10000E+01 volume 0.52951E-02 ppm1 1.651 ppm2 4.290 CV 1
ASSI { 2761}
(( segid " " and resid 256 and name HG3 ))
( segid " " and resid 219 and name HE% )
4.500 2.500 1.500 peak 2761 spectrum 1 weight 0.10000E+01 volume 0.13872E-02 ppm1 2.384 ppm2 6.400 CV 1
ASSI { 1093}
(( segid " " and resid 430 and name HD1 ))
(( segid " " and resid 429 and name HB2 ))
4.500 2.500 1.500 peak 1093 spectrum 1 weight 0.10000E+01 volume 0.50469E-03 ppm1 7.177 ppm2 1.402 CV 1
OR { 1093}
(( segid " " and resid 430 and name HD1 ))
(( segid " " and resid 429 and name HG ))
ASSI { 3999}
( segid " " and resid 253 and name HG2%)
(( segid " " and resid 253 and name HB ))
2.200 0.600 0.600 peak 3999 spectrum 1 weight 0.10000E+01 volume 0.10872E-01 ppm1 0.616 ppm2 3.520 CV 1
ASSI { 1886}
(( segid " " and resid 419 and name HA3 ))
(( segid " " and resid 420 and name HG12))
4.900 3.000 1.100 peak 1886 spectrum 1 weight 0.10000E+01 volume 0.47930E-03 ppm1 4.000 ppm2 1.108 CV 1
ASSI { 3168}
(( segid " " and resid 256 and name HG2 ))
(( segid " " and resid 256 and name HA ))
2.700 0.900 0.900 peak 3168 spectrum 1 weight 0.10000E+01 volume 0.32988E-02 ppm1 2.310 ppm2 4.111 CV 1
ASSI { 2734}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 345 and name HB ))
2.200 0.600 0.600 peak 2734 spectrum 1 weight 0.10000E+01 volume 0.10528E-01 ppm1 1.009 ppm2 2.134 CV 1
ASSI { 4490}
( segid " " and resid 344 and name HG2%)
(( segid " " and resid 345 and name H ))
3.100 1.200 1.200 peak 4490 spectrum 1 weight 0.10000E+01 volume 0.39895E-02 ppm1 0.895 ppm2 6.993 CV 1
ASSI { 2270}
(( segid " " and resid 437 and name HA ))
(( segid " " and resid 440 and name H ))
4.100 2.100 1.900 peak 2270 spectrum 1 weight 0.10000E+01 volume 0.40318E-03 ppm1 3.779 ppm2 8.430 CV 1
ASSI { 1687}
(( segid " " and resid 407 and name HB3 ))
( segid " " and resid 407 and name HD% )
4.300 2.300 1.700 peak 1687 spectrum 1 weight 0.10000E+01 volume 0.29605E-03 ppm1 3.380 ppm2 7.312 CV 1
ASSI { 1840}
(( segid " " and resid 293 and name HD2 ))
(( segid " " and resid 293 and name H ))
4.200 2.200 1.800 peak 1840 spectrum 1 weight 0.10000E+01 volume 0.10037E-02 ppm1 3.075 ppm2 7.000 CV 1
ASSI { 166}
(( segid " " and resid 252 and name HA ))
( segid " " and resid 253 and name HG2%)
4.400 2.400 1.600 peak 166 spectrum 1 weight 0.10000E+01 volume 0.74717E-03 ppm1 4.335 ppm2 0.619 CV 1
ASSI { 4048}
( segid " " and resid 279 and name HD1%)
( segid " " and resid 287 and name HD% )
4.400 2.400 1.600 peak 4048 spectrum 1 weight 0.10000E+01 volume 0.87120E-03 ppm1 0.168 ppm2 6.339 CV 1
ASSI { 3031}
(( segid " " and resid 336 and name HD2 ))
(( segid " " and resid 336 and name HG2 ))
2.900 1.000 1.000 peak 3031 spectrum 1 weight 0.10000E+01 volume 0.41334E-02 ppm1 1.464 ppm2 1.164 CV 1
ASSI { 3811}
(( segid " " and resid 351 and name HG2 ))
(( segid " " and resid 277 and name HD22))
3.500 1.500 1.500 peak 3811 spectrum 1 weight 0.10000E+01 volume 0.76128E-03 ppm1 2.167 ppm2 6.122 CV 1
ASSI { 4112}
( segid " " and resid 316 and name HD1%)
(( segid " " and resid 316 and name HA ))
2.500 0.800 0.800 peak 4112 spectrum 1 weight 0.10000E+01 volume 0.81991E-02 ppm1 0.823 ppm2 3.573 CV 1
ASSI { 1633}
( segid " " and resid 315 and name HE% )
(( segid " " and resid 307 and name HB2 ))
2.900 1.000 1.000 peak 1633 spectrum 1 weight 0.10000E+01 volume 0.20103E-02 ppm1 6.874 ppm2 1.620 CV 1
OR { 1633}
( segid " " and resid 315 and name HE% )
(( segid " " and resid 307 and name HB3 ))
ASSI { 14}
(( segid " " and resid 336 and name HG3 ))
(( segid " " and resid 336 and name HB2 ))
2.500 0.800 0.800 peak 14 spectrum 1 weight 0.10000E+01 volume 0.40206E-02 ppm1 1.327 ppm2 2.018 CV 1
OR { 14}
(( segid " " and resid 336 and name HG3 ))
(( segid " " and resid 336 and name HB3 ))
ASSI { 1101}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 214 and name HD2 ))
3.400 1.500 1.500 peak 1101 spectrum 1 weight 0.10000E+01 volume 0.24755E-02 ppm1 2.221 ppm2 2.954 CV 1
ASSI { 1727}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 321 and name HA ))
2.900 1.000 1.000 peak 1727 spectrum 1 weight 0.10000E+01 volume 0.38006E-02 ppm1 -0.047 ppm2 3.964 CV 1
ASSI { 1943}
( segid " " and resid 267 and name HD2%)
( segid " " and resid 217 and name HD1%)
2.200 0.600 0.600 peak 1943 spectrum 1 weight 0.10000E+01 volume 0.82639E-02 ppm1 0.906 ppm2 -0.042 CV 1
ASSI { 3909}
(( segid " " and resid 222 and name HD2 ))
(( segid " " and resid 222 and name HG2 ))
2.400 0.700 0.700 peak 3909 spectrum 1 weight 0.10000E+01 volume 0.58644E-02 ppm1 1.284 ppm2 0.385 CV 1
OR { 3909}
(( segid " " and resid 222 and name HD3 ))
(( segid " " and resid 222 and name HG2 ))
ASSI { 3378}
( segid " " and resid 359 and name HG2%)
( segid " " and resid 303 and name HE% )
3.200 1.300 1.300 peak 3378 spectrum 1 weight 0.10000E+01 volume 0.17622E-02 ppm1 -0.458 ppm2 6.804 CV 1
ASSI { 1686}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 232 and name HD3 ))
3.300 1.300 1.300 peak 1686 spectrum 1 weight 0.10000E+01 volume 0.17368E-02 ppm1 1.009 ppm2 2.984 CV 1
ASSI { 3670}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 341 and name HD21))
3.400 1.400 1.400 peak 3670 spectrum 1 weight 0.10000E+01 volume 0.10883E-02 ppm1 1.801 ppm2 6.992 CV 1
ASSI { 541}
( segid " " and resid 367 and name HD1%)
(( segid " " and resid 304 and name HG3 ))
2.200 0.600 0.600 peak 541 spectrum 1 weight 0.10000E+01 volume 0.62508E-02 ppm1 0.667 ppm2 2.272 CV 1
ASSI { 958}
(( segid " " and resid 348 and name HA ))
(( segid " " and resid 348 and name HG3 ))
4.600 2.700 1.400 peak 958 spectrum 1 weight 0.10000E+01 volume 0.53289E-03 ppm1 4.508 ppm2 1.982 CV 1
ASSI { 3683}
( segid " " and resid 290 and name HB% )
(( segid " " and resid 302 and name HG2 ))
2.300 0.700 0.700 peak 3683 spectrum 1 weight 0.10000E+01 volume 0.38147E-02 ppm1 1.530 ppm2 2.233 CV 1
ASSI { 377}
(( segid " " and resid 226 and name HA ))
(( segid " " and resid 226 and name HD3 ))
4.500 2.500 1.500 peak 377 spectrum 1 weight 0.10000E+01 volume 0.12124E-02 ppm1 4.383 ppm2 1.611 CV 1
OR { 377}
(( segid " " and resid 226 and name HA ))
(( segid " " and resid 226 and name HD2 ))
ASSI { 3925}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 217 and name H ))
4.000 2.000 2.000 peak 3925 spectrum 1 weight 0.10000E+01 volume 0.18383E-02 ppm1 0.463 ppm2 7.467 CV 1
ASSI { 2195}
(( segid " " and resid 293 and name HD3 ))
(( segid " " and resid 293 and name H ))
4.300 2.300 1.700 peak 2195 spectrum 1 weight 0.10000E+01 volume 0.11363E-02 ppm1 3.162 ppm2 6.995 CV 1
ASSI { 3998}
(( segid " " and resid 349 and name HA ))
(( segid " " and resid 272 and name HG3 ))
2.800 1.000 1.000 peak 3998 spectrum 1 weight 0.10000E+01 volume 0.21259E-02 ppm1 3.948 ppm2 1.811 CV 1
OR { 3998}
(( segid " " and resid 349 and name HA ))
(( segid " " and resid 272 and name HG2 ))
ASSI { 1868}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 328 and name HB ))
3.000 1.200 1.200 peak 1868 spectrum 1 weight 0.10000E+01 volume 0.20893E-02 ppm1 0.657 ppm2 2.399 CV 1
ASSI { 1474}
(( segid " " and resid 320 and name HZ2 ))
(( segid " " and resid 374 and name HB2 ))
3.900 1.900 1.900 peak 1474 spectrum 1 weight 0.10000E+01 volume 0.71897E-03 ppm1 7.379 ppm2 1.618 CV 1
OR { 1474}
(( segid " " and resid 320 and name HZ2 ))
(( segid " " and resid 374 and name HD2 ))
OR { 1474}
(( segid " " and resid 320 and name HZ2 ))
(( segid " " and resid 374 and name HD3 ))
ASSI { 2779}
( segid " " and resid 390 and name HG2%)
(( segid " " and resid 390 and name H ))
2.800 1.000 1.000 peak 2779 spectrum 1 weight 0.10000E+01 volume 0.47338E-02 ppm1 1.077 ppm2 8.054 CV 1
ASSI { 2224}
( segid " " and resid 335 and name HG2%)
(( segid " " and resid 336 and name H ))
2.800 2.800 3.200 peak 2224 spectrum 1 weight 0.10000E+01 volume 0.76128E-03 ppm1 1.246 ppm2 9.114 CV 1
ASSI { 2193}
(( segid " " and resid 318 and name HG12))
( segid " " and resid 318 and name HD1%)
1.900 0.500 0.500 peak 2193 spectrum 1 weight 0.10000E+01 volume 0.12135E-01 ppm1 0.989 ppm2 0.368 CV 1
OR { 2193}
(( segid " " and resid 318 and name HG12))
( segid " " and resid 318 and name HG2%)
ASSI { 1208}
(( segid " " and resid 282 and name HG2 ))
( segid " " and resid 283 and name HD1%)
4.600 2.700 1.400 peak 1208 spectrum 1 weight 0.10000E+01 volume 0.15253E-02 ppm1 2.396 ppm2 0.721 CV 1
ASSI { 965}
(( segid " " and resid 316 and name HA ))
(( segid " " and resid 320 and name HD1 ))
4.700 2.700 1.300 peak 965 spectrum 1 weight 0.10000E+01 volume 0.25093E-03 ppm1 3.568 ppm2 7.280 CV 1
ASSI { 3617}
( segid " " and resid 344 and name HG2%)
(( segid " " and resid 341 and name HA ))
4.000 2.000 2.000 peak 3617 spectrum 1 weight 0.10000E+01 volume 0.31635E-02 ppm1 0.895 ppm2 4.407 CV 1
ASSI { 1214}
( segid " " and resid 211 and name HB% )
(( segid " " and resid 201 and name HB ))
3.300 1.400 1.400 peak 1214 spectrum 1 weight 0.10000E+01 volume 0.84868E-03 ppm1 1.689 ppm2 4.432 CV 1
OR { 1214}
( segid " " and resid 211 and name HB% )
(( segid " " and resid 201 and name HG1 ))
ASSI { 3953}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 345 and name H ))
2.200 0.600 0.600 peak 3953 spectrum 1 weight 0.10000E+01 volume 0.78606E-02 ppm1 1.009 ppm2 6.991 CV 1
ASSI { 4170}
(( segid " " and resid 421 and name HB2 ))
(( segid " " and resid 421 and name HG2 ))
2.100 0.500 0.500 peak 4170 spectrum 1 weight 0.10000E+01 volume 0.16223E-01 ppm1 1.680 ppm2 1.320 CV 1
OR { 4170}
(( segid " " and resid 421 and name HB3 ))
(( segid " " and resid 421 and name HG3 ))
OR { 4170}
(( segid " " and resid 421 and name HB3 ))
(( segid " " and resid 421 and name HG2 ))
OR { 4170}
(( segid " " and resid 421 and name HB2 ))
(( segid " " and resid 421 and name HG3 ))
ASSI { 807}
( segid " " and resid 307 and name HD1%)
(( segid " " and resid 310 and name HG ))
3.500 1.500 1.500 peak 807 spectrum 1 weight 0.10000E+01 volume 0.36539E-02 ppm1 1.211 ppm2 2.172 CV 1
ASSI { 1590}
(( segid " " and resid 363 and name HD2 ))
( segid " " and resid 300 and name HG1%)
4.400 2.400 1.600 peak 1590 spectrum 1 weight 0.10000E+01 volume 0.27913E-03 ppm1 7.066 ppm2 0.065 CV 1
ASSI { 4472}
(( segid " " and resid 216 and name HA ))
(( segid " " and resid 219 and name HB2 ))
3.800 1.800 1.800 peak 4472 spectrum 1 weight 0.10000E+01 volume 0.40036E-03 ppm1 3.855 ppm2 3.169 CV 1
OR { 4472}
(( segid " " and resid 216 and name HA ))
(( segid " " and resid 219 and name HB3 ))
ASSI { 3731}
( segid " " and resid 329 and name HG2%)
( segid " " and resid 329 and name HD1%)
2.200 0.600 0.600 peak 3731 spectrum 1 weight 0.10000E+01 volume 0.90138E-02 ppm1 0.748 ppm2 0.116 CV 1
ASSI { 4036}
( segid " " and resid 364 and name HG2%)
(( segid " " and resid 365 and name H ))
3.100 1.200 1.200 peak 4036 spectrum 1 weight 0.10000E+01 volume 0.63890E-02 ppm1 0.908 ppm2 8.351 CV 1
ASSI { 731}
(( segid " " and resid 305 and name HA ))
(( segid " " and resid 308 and name HG2 ))
2.200 0.600 0.600 peak 731 spectrum 1 weight 0.10000E+01 volume 0.32114E-02 ppm1 3.827 ppm2 1.544 CV 1
OR { 731}
(( segid " " and resid 305 and name HA ))
(( segid " " and resid 308 and name HD3 ))
OR { 731}
(( segid " " and resid 305 and name HA ))
(( segid " " and resid 308 and name HD2 ))
ASSI { 1937}
( segid " " and resid 197 and name HB% )
( segid " " and resid 317 and name HD1%)
5.300 3.500 0.700 peak 1937 spectrum 1 weight 0.10000E+01 volume 0.31578E-03 ppm1 1.453 ppm2 0.191 CV 1
ASSI { 1434}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 348 and name HD2 ))
4.100 2.100 1.900 peak 1434 spectrum 1 weight 0.10000E+01 volume 0.61465E-03 ppm1 1.009 ppm2 3.537 CV 1
ASSI { 4586}
( segid " " and resid 245 and name HB% )
(( segid " " and resid 248 and name H ))
4.400 2.400 1.600 peak 4586 spectrum 1 weight 0.10000E+01 volume 0.12096E-02 ppm1 1.329 ppm2 8.877 CV 1
ASSI { 3449}
( segid " " and resid 438 and name HB% )
( segid " " and resid 391 and name HD2%)
3.200 1.300 1.300 peak 3449 spectrum 1 weight 0.10000E+01 volume 0.28364E-02 ppm1 1.600 ppm2 0.531 CV 1
ASSI { 1729}
( segid " " and resid 361 and name HD% )
(( segid " " and resid 358 and name HA ))
3.200 1.300 1.300 peak 1729 spectrum 1 weight 0.10000E+01 volume 0.58644E-03 ppm1 7.144 ppm2 4.018 CV 1
ASSI { 3100}
( segid " " and resid 230 and name HD1%)
(( segid " " and resid 230 and name HG12))
2.100 0.500 0.500 peak 3100 spectrum 1 weight 0.10000E+01 volume 0.79622E-02 ppm1 0.648 ppm2 0.807 CV 1
ASSI { 4370}
( segid " " and resid 416 and name HD2%)
(( segid " " and resid 416 and name H ))
3.300 1.300 1.300 peak 4370 spectrum 1 weight 0.10000E+01 volume 0.44662E-02 ppm1 0.697 ppm2 7.961 CV 1
ASSI { 1370}
( segid " " and resid 267 and name HD2%)
(( segid " " and resid 216 and name HB3 ))
2.800 1.000 1.000 peak 1370 spectrum 1 weight 0.10000E+01 volume 0.37893E-02 ppm1 0.904 ppm2 2.764 CV 1
OR { 1370}
( segid " " and resid 267 and name HD2%)
(( segid " " and resid 216 and name HG ))
ASSI { 1865}
(( segid " " and resid 257 and name HB3 ))
(( segid " " and resid 257 and name HA ))
3.800 1.800 1.800 peak 1865 spectrum 1 weight 0.10000E+01 volume 0.14013E-02 ppm1 2.358 ppm2 4.405 CV 1
ASSI { 1825}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 318 and name H ))
4.600 2.700 1.400 peak 1825 spectrum 1 weight 0.10000E+01 volume 0.11052E-02 ppm1 0.168 ppm2 8.038 CV 1
ASSI { 2367}
(( segid " " and resid 367 and name HA ))
(( segid " " and resid 367 and name H ))
3.400 1.500 1.500 peak 2367 spectrum 1 weight 0.10000E+01 volume 0.76410E-03 ppm1 4.019 ppm2 7.872 CV 1
ASSI { 2410}
(( segid " " and resid 421 and name HG3 ))
(( segid " " and resid 421 and name HA ))
3.200 1.300 1.300 peak 2410 spectrum 1 weight 0.10000E+01 volume 0.32283E-02 ppm1 1.340 ppm2 4.287 CV 1
ASSI { 3415}
(( segid " " and resid 309 and name HA ))
(( segid " " and resid 310 and name H ))
3.300 1.400 1.400 peak 3415 spectrum 1 weight 0.10000E+01 volume 0.12378E-02 ppm1 4.181 ppm2 7.055 CV 1
ASSI { 2444}
(( segid " " and resid 306 and name HB2 ))
( segid " " and resid 306 and name HD1%)
4.300 2.400 1.700 peak 2444 spectrum 1 weight 0.10000E+01 volume 0.42293E-03 ppm1 0.968 ppm2 0.377 CV 1
ASSI { 1212}
( segid " " and resid 432 and name HG1%)
(( segid " " and resid 430 and name H ))
4.000 2.000 2.000 peak 1212 spectrum 1 weight 0.10000E+01 volume 0.10009E-02 ppm1 1.088 ppm2 7.747 CV 1
OR { 1212}
( segid " " and resid 432 and name HG2%)
(( segid " " and resid 430 and name H ))
ASSI { 2903}
(( segid " " and resid 257 and name HA ))
(( segid " " and resid 258 and name H ))
4.000 2.000 2.000 peak 2903 spectrum 1 weight 0.10000E+01 volume 0.70769E-03 ppm1 4.408 ppm2 8.128 CV 1
ASSI { 243}
( segid " " and resid 306 and name HD2%)
( segid " " and resid 287 and name HE% )
2.700 2.700 3.300 peak 243 spectrum 1 weight 0.10000E+01 volume 0.84021E-03 ppm1 -0.358 ppm2 6.951 CV 1
ASSI { 2459}
(( segid " " and resid 379 and name HB2 ))
(( segid " " and resid 379 and name HD2 ))
4.500 2.500 1.500 peak 2459 spectrum 1 weight 0.10000E+01 volume 0.76128E-03 ppm1 1.932 ppm2 3.643 CV 1
ASSI { 3539}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 318 and name HG12))
1.900 0.400 0.400 peak 3539 spectrum 1 weight 0.10000E+01 volume 0.13359E-01 ppm1 0.379 ppm2 1.001 CV 1
ASSI { 2113}
(( segid " " and resid 432 and name HA ))
( segid " " and resid 432 and name HG2%)
3.200 1.300 1.300 peak 2113 spectrum 1 weight 0.10000E+01 volume 0.24981E-02 ppm1 3.626 ppm2 1.084 CV 1
OR { 2113}
(( segid " " and resid 432 and name HA ))
( segid " " and resid 432 and name HG1%)
ASSI { 919}
( segid " " and resid 367 and name HD1%)
(( segid " " and resid 303 and name HB2 ))
3.200 1.300 1.300 peak 919 spectrum 1 weight 0.10000E+01 volume 0.13308E-02 ppm1 0.669 ppm2 3.466 CV 1
ASSI { 2219}
( segid " " and resid 255 and name HD1%)
( segid " " and resid 255 and name HD2%)
2.000 0.500 0.500 peak 2219 spectrum 1 weight 0.10000E+01 volume 0.20743E-01 ppm1 0.603 ppm2 0.776 CV 1
ASSI { 4138}
(( segid " " and resid 346 and name HG ))
(( segid " " and resid 346 and name HB3 ))
2.100 0.500 0.500 peak 4138 spectrum 1 weight 0.10000E+01 volume 0.82414E-02 ppm1 1.761 ppm2 1.465 CV 1
ASSI { 3022}
( segid " " and resid 380 and name HD2%)
(( segid " " and resid 380 and name HA ))
3.100 1.200 1.200 peak 3022 spectrum 1 weight 0.10000E+01 volume 0.78155E-02 ppm1 0.774 ppm2 4.060 CV 1
ASSI { 2754}
(( segid " " and resid 307 and name HG ))
( segid " " and resid 307 and name HD2%)
2.700 0.900 0.900 peak 2754 spectrum 1 weight 0.10000E+01 volume 0.18919E-02 ppm1 2.307 ppm2 1.028 CV 1
ASSI { 1821}
( segid " " and resid 290 and name HB% )
( segid " " and resid 287 and name HD% )
5.000 3.100 1.000 peak 1821 spectrum 1 weight 0.10000E+01 volume 0.38062E-03 ppm1 1.530 ppm2 6.335 CV 1
ASSI { 3299}
( segid " " and resid 202 and name HE% )
(( segid " " and resid 206 and name HA2 ))
2.400 0.700 0.700 peak 3299 spectrum 1 weight 0.10000E+01 volume 0.56755E-02 ppm1 1.869 ppm2 3.590 CV 1
ASSI { 2413}
( segid " " and resid 376 and name HG1%)
(( segid " " and resid 376 and name H ))
2.800 1.000 1.000 peak 2413 spectrum 1 weight 0.10000E+01 volume 0.27011E-02 ppm1 0.957 ppm2 9.505 CV 1
ASSI { 2780}
( segid " " and resid 329 and name HD1%)
(( segid " " and resid 329 and name HA ))
2.400 0.700 0.700 peak 2780 spectrum 1 weight 0.10000E+01 volume 0.20441E-02 ppm1 0.119 ppm2 3.863 CV 1
ASSI { 2769}
( segid " " and resid 372 and name HG1%)
(( segid " " and resid 372 and name H ))
2.500 0.800 0.800 peak 2769 spectrum 1 weight 0.10000E+01 volume 0.51738E-02 ppm1 0.644 ppm2 7.911 CV 1
ASSI { 4175}
( segid " " and resid 436 and name HD2%)
(( segid " " and resid 406 and name H ))
3.900 1.900 1.900 peak 4175 spectrum 1 weight 0.10000E+01 volume 0.10573E-02 ppm1 0.855 ppm2 9.244 CV 1
ASSI { 300}
( segid " " and resid 362 and name HG2%)
(( segid " " and resid 361 and name HB2 ))
3.800 1.800 1.800 peak 300 spectrum 1 weight 0.10000E+01 volume 0.11052E-02 ppm1 0.564 ppm2 3.074 CV 1
ASSI { 3929}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 217 and name HA ))
2.300 0.700 0.700 peak 3929 spectrum 1 weight 0.10000E+01 volume 0.67271E-02 ppm1 -0.048 ppm2 2.973 CV 1
ASSI { 664}
( segid " " and resid 325 and name HE% )
( segid " " and resid 322 and name HD1%)
3.800 1.800 1.800 peak 664 spectrum 1 weight 0.10000E+01 volume 0.14097E-02 ppm1 0.929 ppm2 -0.162 CV 1
ASSI { 1302}
( segid " " and resid 420 and name HG2%)
(( segid " " and resid 425 and name H ))
4.700 2.700 1.300 peak 1302 spectrum 1 weight 0.10000E+01 volume 0.80637E-03 ppm1 0.808 ppm2 7.763 CV 1
ASSI { 4674}
( segid " " and resid 388 and name HE% )
(( segid " " and resid 382 and name HZ2 ))
3.500 1.500 1.500 peak 4674 spectrum 1 weight 0.10000E+01 volume 0.21315E-02 ppm1 1.848 ppm2 7.464 CV 1
ASSI { 3148}
(( segid " " and resid 218 and name HA ))
(( segid " " and resid 218 and name HB3 ))
3.400 1.500 1.500 peak 3148 spectrum 1 weight 0.10000E+01 volume 0.16071E-02 ppm1 4.070 ppm2 2.530 CV 1
ASSI { 4554}
(( segid " " and resid 399 and name HB2 ))
(( segid " " and resid 399 and name HA ))
2.900 1.000 1.000 peak 4554 spectrum 1 weight 0.10000E+01 volume 0.21343E-02 ppm1 1.909 ppm2 3.780 CV 1
ASSI { 4103}
(( segid " " and resid 423 and name HB3 ))
(( segid " " and resid 424 and name H ))
3.000 1.100 1.100 peak 4103 spectrum 1 weight 0.10000E+01 volume 0.11419E-02 ppm1 1.607 ppm2 8.281 CV 1
ASSI { 4363}
( segid " " and resid 344 and name HD1%)
(( segid " " and resid 344 and name HA ))
3.300 1.400 1.400 peak 4363 spectrum 1 weight 0.10000E+01 volume 0.88643E-02 ppm1 0.818 ppm2 3.885 CV 1
ASSI { 2863}
(( segid " " and resid 241 and name HA ))
(( segid " " and resid 241 and name H ))
3.300 1.300 1.300 peak 2863 spectrum 1 weight 0.10000E+01 volume 0.12349E-02 ppm1 4.122 ppm2 8.370 CV 1
ASSI { 3740}
(( segid " " and resid 346 and name HA ))
(( segid " " and resid 346 and name H ))
3.600 1.600 1.600 peak 3740 spectrum 1 weight 0.10000E+01 volume 0.43139E-03 ppm1 4.060 ppm2 8.986 CV 1
ASSI { 3323}
( segid " " and resid 333 and name HD2%)
(( segid " " and resid 334 and name H ))
2.200 2.200 3.800 peak 3323 spectrum 1 weight 0.10000E+01 volume 0.26842E-02 ppm1 0.842 ppm2 8.135 CV 1
ASSI { 2576}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 406 and name H ))
4.000 2.000 2.000 peak 2576 spectrum 1 weight 0.10000E+01 volume 0.92479E-03 ppm1 0.771 ppm2 9.244 CV 1
ASSI { 1066}
(( segid " " and resid 443 and name HB3 ))
( segid " " and resid 398 and name HD1%)
4.600 2.700 1.400 peak 1066 spectrum 1 weight 0.10000E+01 volume 0.82611E-03 ppm1 1.624 ppm2 0.579 CV 1
ASSI { 1095}
( segid " " and resid 307 and name HD2%)
(( segid " " and resid 367 and name HB3 ))
4.000 2.000 2.000 peak 1095 spectrum 1 weight 0.10000E+01 volume 0.70487E-03 ppm1 1.026 ppm2 0.057 CV 1
ASSI { 206}
( segid " " and resid 255 and name HD2%)
(( segid " " and resid 215 and name H ))
2.800 2.800 3.200 peak 206 spectrum 1 weight 0.10000E+01 volume 0.65413E-03 ppm1 0.779 ppm2 8.890 CV 1
ASSI { 219}
(( segid " " and resid 435 and name HA ))
(( segid " " and resid 382 and name HE3 ))
5.200 3.300 0.800 peak 219 spectrum 1 weight 0.10000E+01 volume 0.36370E-03 ppm1 3.867 ppm2 7.155 CV 1
OR { 219}
(( segid " " and resid 435 and name HA ))
(( segid " " and resid 382 and name HH2 ))
ASSI { 2657}
( segid " " and resid 335 and name HG2%)
(( segid " " and resid 331 and name HB2 ))
3.200 1.200 1.200 peak 2657 spectrum 1 weight 0.10000E+01 volume 0.16381E-02 ppm1 1.243 ppm2 2.547 CV 1
OR { 2657}
( segid " " and resid 335 and name HG2%)
(( segid " " and resid 331 and name HB3 ))
ASSI { 2234}
(( segid " " and resid 182 and name HA ))
(( segid " " and resid 182 and name HB3 ))
2.200 0.600 0.600 peak 2234 spectrum 1 weight 0.10000E+01 volume 0.15812E-01 ppm1 3.882 ppm2 2.952 CV 1
OR { 2234}
(( segid " " and resid 182 and name HA ))
(( segid " " and resid 182 and name HB2 ))
ASSI { 2287}
(( segid " " and resid 184 and name HD3 ))
(( segid " " and resid 183 and name HG2 ))
2.400 2.400 3.600 peak 2287 spectrum 1 weight 0.10000E+01 volume 0.16043E-02 ppm1 3.614 ppm2 2.465 CV 1
OR { 2287}
(( segid " " and resid 184 and name HD3 ))
(( segid " " and resid 183 and name HG3 ))
ASSI { 3979}
(( segid " " and resid 341 and name HA ))
(( segid " " and resid 341 and name HB2 ))
3.200 1.300 1.300 peak 3979 spectrum 1 weight 0.10000E+01 volume 0.74435E-03 ppm1 4.405 ppm2 2.809 CV 1
OR { 3979}
(( segid " " and resid 341 and name HA ))
(( segid " " and resid 341 and name HB3 ))
ASSI { 1024}
(( segid " " and resid 319 and name HB3 ))
( segid " " and resid 368 and name HE% )
4.400 2.400 1.600 peak 1024 spectrum 1 weight 0.10000E+01 volume 0.26221E-03 ppm1 3.078 ppm2 6.767 CV 1
ASSI { 3497}
(( segid " " and resid 377 and name HB2 ))
(( segid " " and resid 377 and name HA ))
4.300 2.300 1.700 peak 3497 spectrum 1 weight 0.10000E+01 volume 0.37498E-03 ppm1 1.980 ppm2 4.657 CV 1
ASSI { 1529}
( segid " " and resid 432 and name HG2%)
(( segid " " and resid 433 and name HA ))
3.200 1.300 1.300 peak 1529 spectrum 1 weight 0.10000E+01 volume 0.27180E-02 ppm1 1.083 ppm2 4.022 CV 1
OR { 1529}
( segid " " and resid 432 and name HG1%)
(( segid " " and resid 433 and name HA ))
ASSI { 2820}
(( segid " " and resid 291 and name HA ))
(( segid " " and resid 292 and name H ))
3.800 1.800 1.800 peak 2820 spectrum 1 weight 0.10000E+01 volume 0.76128E-03 ppm1 3.957 ppm2 7.795 CV 1
ASSI { 4147}
( segid " " and resid 190 and name HD% )
(( segid " " and resid 190 and name HB2 ))
4.100 2.100 1.900 peak 4147 spectrum 1 weight 0.10000E+01 volume 0.26785E-03 ppm1 7.873 ppm2 2.537 CV 1
ASSI { 2437}
(( segid " " and resid 251 and name HB3 ))
(( segid " " and resid 251 and name HA ))
3.000 1.100 1.100 peak 2437 spectrum 1 weight 0.10000E+01 volume 0.17424E-02 ppm1 1.598 ppm2 4.208 CV 1
ASSI { 3001}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 285 and name HD2 ))
2.200 2.200 3.800 peak 3001 spectrum 1 weight 0.10000E+01 volume 0.34877E-02 ppm1 2.151 ppm2 3.612 CV 1
ASSI { 2693}
(( segid " " and resid 222 and name HE2 ))
(( segid " " and resid 222 and name H ))
4.900 3.100 1.100 peak 2693 spectrum 1 weight 0.10000E+01 volume 0.15958E-02 ppm1 2.682 ppm2 7.242 CV 1
OR { 2693}
(( segid " " and resid 222 and name HE3 ))
(( segid " " and resid 222 and name H ))
ASSI { 4731}
(( segid " " and resid 387 and name HB ))
( segid " " and resid 387 and name HG2%)
1.900 0.500 0.500 peak 4731 spectrum 1 weight 0.10000E+01 volume 0.21538E-01 ppm1 4.025 ppm2 1.105 CV 1
ASSI { 1869}
(( segid " " and resid 299 and name HE3 ))
(( segid " " and resid 299 and name H ))
4.800 2.800 1.200 peak 1869 spectrum 1 weight 0.10000E+01 volume 0.70487E-03 ppm1 2.554 ppm2 7.496 CV 1
ASSI { 4313}
(( segid " " and resid 290 and name HA ))
( segid " " and resid 290 and name HB% )
2.100 0.500 0.500 peak 4313 spectrum 1 weight 0.10000E+01 volume 0.54643E-02 ppm1 4.044 ppm2 1.535 CV 1
ASSI { 3660}
( segid " " and resid 357 and name HD1%)
(( segid " " and resid 352 and name HB ))
3.100 1.200 1.200 peak 3660 spectrum 1 weight 0.10000E+01 volume 0.32565E-02 ppm1 0.677 ppm2 1.109 CV 1
ASSI { 1954}
( segid " " and resid 253 and name HG2%)
(( segid " " and resid 254 and name HA ))
5.100 3.200 0.900 peak 1954 spectrum 1 weight 0.10000E+01 volume 0.54981E-03 ppm1 0.614 ppm2 4.868 CV 1
ASSI { 4451}
(( segid " " and resid 208 and name HD2 ))
(( segid " " and resid 208 and name H ))
3.600 1.600 1.600 peak 4451 spectrum 1 weight 0.10000E+01 volume 0.13703E-02 ppm1 3.077 ppm2 8.263 CV 1
ASSI { 4257}
( segid " " and resid 391 and name HD1%)
(( segid " " and resid 392 and name HD2 ))
4.100 2.100 1.900 peak 4257 spectrum 1 weight 0.10000E+01 volume 0.17453E-02 ppm1 0.711 ppm2 3.143 CV 1
ASSI { 18}
( segid " " and resid 359 and name HG1%)
(( segid " " and resid 358 and name H ))
4.200 2.200 1.800 peak 18 spectrum 1 weight 0.10000E+01 volume 0.95864E-03 ppm1 0.891 ppm2 8.547 CV 1
ASSI { 1843}
(( segid " " and resid 285 and name HG3 ))
(( segid " " and resid 286 and name H ))
3.000 1.200 1.200 peak 1843 spectrum 1 weight 0.10000E+01 volume 0.20075E-02 ppm1 1.967 ppm2 7.442 CV 1
OR { 1843}
(( segid " " and resid 285 and name HG2 ))
(( segid " " and resid 286 and name H ))
ASSI { 3840}
(( segid " " and resid 208 and name HB3 ))
(( segid " " and resid 208 and name H ))
3.800 1.800 1.800 peak 3840 spectrum 1 weight 0.10000E+01 volume 0.18016E-02 ppm1 1.624 ppm2 8.284 CV 1
ASSI { 2457}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 213 and name HB2 ))
3.600 1.600 1.600 peak 2457 spectrum 1 weight 0.10000E+01 volume 0.22471E-02 ppm1 -0.047 ppm2 2.273 CV 1
ASSI { 423}
( segid " " and resid 420 and name HD1%)
(( segid " " and resid 418 and name H ))
4.100 2.100 1.900 peak 423 spectrum 1 weight 0.10000E+01 volume 0.60901E-03 ppm1 0.770 ppm2 8.195 CV 1
ASSI { 3131}
(( segid " " and resid 272 and name HD2 ))
(( segid " " and resid 272 and name H ))
3.600 1.600 1.600 peak 3131 spectrum 1 weight 0.10000E+01 volume 0.26757E-02 ppm1 3.228 ppm2 8.497 CV 1
OR { 3131}
(( segid " " and resid 272 and name HD3 ))
(( segid " " and resid 272 and name H ))
ASSI { 2895}
(( segid " " and resid 420 and name HA ))
(( segid " " and resid 420 and name H ))
2.800 1.000 1.000 peak 2895 spectrum 1 weight 0.10000E+01 volume 0.24783E-02 ppm1 3.978 ppm2 7.498 CV 1
ASSI { 2301}
(( segid " " and resid 326 and name HA ))
(( segid " " and resid 326 and name HB2 ))
3.000 1.200 1.200 peak 2301 spectrum 1 weight 0.10000E+01 volume 0.55263E-03 ppm1 4.428 ppm2 2.867 CV 1
ASSI { 2996}
(( segid " " and resid 344 and name HG13))
(( segid " " and resid 344 and name HG12))
1.600 0.300 0.600 peak 2996 spectrum 1 weight 0.10000E+01 volume 0.61747E-02 ppm1 1.214 ppm2 1.634 CV 1
ASSI { 3829}
( segid " " and resid 317 and name HD2%)
(( segid " " and resid 321 and name HA ))
4.700 2.800 1.300 peak 3829 spectrum 1 weight 0.10000E+01 volume 0.85432E-03 ppm1 0.346 ppm2 3.975 CV 1
ASSI { 2676}
( segid " " and resid 356 and name HG1%)
(( segid " " and resid 356 and name H ))
3.700 1.800 1.800 peak 2676 spectrum 1 weight 0.10000E+01 volume 0.29464E-02 ppm1 0.793 ppm2 7.352 CV 1
ASSI { 3012}
( segid " " and resid 361 and name HD% )
(( segid " " and resid 361 and name H ))
3.700 1.700 1.700 peak 3012 spectrum 1 weight 0.10000E+01 volume 0.62029E-03 ppm1 7.144 ppm2 8.371 CV 1
ASSI { 2043}
( segid " " and resid 223 and name HE% )
(( segid " " and resid 222 and name HG2 ))
3.000 3.000 3.000 peak 2043 spectrum 1 weight 0.10000E+01 volume 0.49904E-03 ppm1 6.648 ppm2 0.385 CV 1
ASSI { 1051}
( segid " " and resid 315 and name HD% )
( segid " " and resid 307 and name HD1%)
3.700 1.700 1.700 peak 1051 spectrum 1 weight 0.10000E+01 volume 0.20977E-02 ppm1 7.027 ppm2 1.207 CV 1
ASSI { 1997}
(( segid " " and resid 217 and name HB ))
(( segid " " and resid 217 and name H ))
2.900 1.100 1.100 peak 1997 spectrum 1 weight 0.10000E+01 volume 0.55263E-03 ppm1 1.641 ppm2 7.491 CV 1
ASSI { 2543}
(( segid " " and resid 391 and name HB3 ))
( segid " " and resid 391 and name HD1%)
3.300 1.400 1.400 peak 2543 spectrum 1 weight 0.10000E+01 volume 0.12660E-02 ppm1 1.506 ppm2 0.715 CV 1
ASSI { 1441}
( segid " " and resid 225 and name HE% )
( segid " " and resid 231 and name HE% )
4.400 2.400 1.600 peak 1441 spectrum 1 weight 0.10000E+01 volume 0.13703E-02 ppm1 1.913 ppm2 6.780 CV 1
OR { 1441}
( segid " " and resid 225 and name HE% )
( segid " " and resid 231 and name HD% )
ASSI { 3890}
(( segid " " and resid 366 and name HB2 ))
( segid " " and resid 300 and name HG2%)
3.900 1.900 1.900 peak 3890 spectrum 1 weight 0.10000E+01 volume 0.11588E-02 ppm1 1.876 ppm2 0.538 CV 1
ASSI { 2095}
(( segid " " and resid 413 and name HD2 ))
(( segid " " and resid 413 and name HE1 ))
5.600 3.900 0.400 peak 2095 spectrum 1 weight 0.10000E+01 volume 0.30169E-03 ppm1 6.795 ppm2 7.650 CV 1
ASSI { 3557}
(( segid " " and resid 409 and name HA ))
(( segid " " and resid 409 and name HG ))
2.800 1.000 1.000 peak 3557 spectrum 1 weight 0.10000E+01 volume 0.28392E-02 ppm1 3.684 ppm2 1.383 CV 1
ASSI { 1892}
( segid " " and resid 223 and name HD% )
(( segid " " and resid 222 and name HB2 ))
3.400 1.500 1.500 peak 1892 spectrum 1 weight 0.10000E+01 volume 0.65978E-03 ppm1 6.430 ppm2 1.250 CV 1
ASSI { 2031}
(( segid " " and resid 207 and name HA ))
(( segid " " and resid 207 and name H ))
3.700 1.700 1.700 peak 2031 spectrum 1 weight 0.10000E+01 volume 0.48776E-03 ppm1 3.768 ppm2 6.903 CV 1
ASSI { 2474}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 196 and name H ))
4.400 2.400 1.600 peak 2474 spectrum 1 weight 0.10000E+01 volume 0.11842E-02 ppm1 1.456 ppm2 7.176 CV 1
ASSI { 4577}
(( segid " " and resid 445 and name HA ))
(( segid " " and resid 445 and name HB2 ))
2.100 0.500 0.500 peak 4577 spectrum 1 weight 0.10000E+01 volume 0.13725E-01 ppm1 4.226 ppm2 2.046 CV 1
ASSI { 2487}
(( segid " " and resid 281 and name HG3 ))
(( segid " " and resid 281 and name HE2 ))
2.000 0.500 0.500 peak 2487 spectrum 1 weight 0.10000E+01 volume 0.23983E-01 ppm1 1.401 ppm2 2.959 CV 1
OR { 2487}
(( segid " " and resid 281 and name HG2 ))
(( segid " " and resid 281 and name HE2 ))
OR { 2487}
(( segid " " and resid 281 and name HG2 ))
(( segid " " and resid 281 and name HE3 ))
OR { 2487}
(( segid " " and resid 281 and name HG3 ))
(( segid " " and resid 281 and name HE3 ))
ASSI { 3649}
(( segid " " and resid 388 and name HG3 ))
(( segid " " and resid 388 and name HB3 ))
2.600 0.900 0.900 peak 3649 spectrum 1 weight 0.10000E+01 volume 0.49425E-02 ppm1 2.270 ppm2 1.303 CV 1
ASSI { 4435}
(( segid " " and resid 348 and name HD3 ))
(( segid " " and resid 348 and name HA ))
3.600 1.600 1.600 peak 4435 spectrum 1 weight 0.10000E+01 volume 0.15197E-02 ppm1 3.754 ppm2 4.551 CV 1
ASSI { 4038}
(( segid " " and resid 280 and name HA ))
( segid " " and resid 280 and name HG2%)
3.100 1.200 1.200 peak 4038 spectrum 1 weight 0.10000E+01 volume 0.16099E-02 ppm1 4.030 ppm2 1.122 CV 1
ASSI { 4621}
(( segid " " and resid 210 and name HB3 ))
(( segid " " and resid 210 and name HA ))
2.700 0.900 0.900 peak 4621 spectrum 1 weight 0.10000E+01 volume 0.94736E-03 ppm1 1.406 ppm2 3.985 CV 1
ASSI { 4058}
(( segid " " and resid 443 and name HB2 ))
(( segid " " and resid 444 and name H ))
3.500 1.600 1.600 peak 4058 spectrum 1 weight 0.10000E+01 volume 0.10686E-02 ppm1 1.688 ppm2 7.755 CV 1
ASSI { 3418}
(( segid " " and resid 243 and name HB3 ))
(( segid " " and resid 243 and name H ))
4.400 2.400 1.600 peak 3418 spectrum 1 weight 0.10000E+01 volume 0.50469E-03 ppm1 1.206 ppm2 7.856 CV 1
ASSI { 4164}
(( segid " " and resid 344 and name HA ))
(( segid " " and resid 345 and name H ))
3.500 1.500 1.500 peak 4164 spectrum 1 weight 0.10000E+01 volume 0.62593E-03 ppm1 3.881 ppm2 6.990 CV 1
ASSI { 1857}
(( segid " " and resid 184 and name HD2 ))
(( segid " " and resid 183 and name HA ))
1.800 0.400 0.400 peak 1857 spectrum 1 weight 0.10000E+01 volume 0.19624E-01 ppm1 3.665 ppm2 4.709 CV 1
ASSI { 3433}
(( segid " " and resid 318 and name HB ))
(( segid " " and resid 318 and name HA ))
2.500 0.800 0.800 peak 3433 spectrum 1 weight 0.10000E+01 volume 0.22358E-02 ppm1 1.355 ppm2 3.366 CV 1
ASSI { 3463}
( segid " " and resid 253 and name HG2%)
(( segid " " and resid 253 and name HA ))
2.400 0.700 0.700 peak 3463 spectrum 1 weight 0.10000E+01 volume 0.83627E-02 ppm1 0.615 ppm2 4.148 CV 1
ASSI { 199}
(( segid " " and resid 430 and name HZ2 ))
(( segid " " and resid 426 and name HB3 ))
3.500 1.600 1.600 peak 199 spectrum 1 weight 0.10000E+01 volume 0.47648E-03 ppm1 7.288 ppm2 1.860 CV 1
OR { 199}
(( segid " " and resid 430 and name HZ2 ))
(( segid " " and resid 426 and name HB2 ))
ASSI { 1796}
(( segid " " and resid 268 and name HG2 ))
(( segid " " and resid 269 and name H ))
3.600 1.600 1.600 peak 1796 spectrum 1 weight 0.10000E+01 volume 0.38344E-03 ppm1 1.255 ppm2 8.191 CV 1
OR { 1796}
(( segid " " and resid 268 and name HG3 ))
(( segid " " and resid 269 and name H ))
ASSI { 2798}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 373 and name H ))
3.900 1.900 1.900 peak 2798 spectrum 1 weight 0.10000E+01 volume 0.14718E-02 ppm1 0.368 ppm2 8.227 CV 1
ASSI { 4721}
(( segid " " and resid 400 and name HG2 ))
(( segid " " and resid 400 and name H ))
2.700 0.900 0.900 peak 4721 spectrum 1 weight 0.10000E+01 volume 0.77450E-02 ppm1 2.344 ppm2 7.993 CV 1
ASSI { 2068}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 371 and name H ))
3.500 1.600 1.600 peak 2068 spectrum 1 weight 0.10000E+01 volume 0.28251E-02 ppm1 0.365 ppm2 7.539 CV 1
ASSI { 3748}
( segid " " and resid 253 and name HG2%)
( segid " " and resid 243 and name HD1%)
3.500 1.500 1.500 peak 3748 spectrum 1 weight 0.10000E+01 volume 0.51484E-02 ppm1 0.616 ppm2 0.017 CV 1
ASSI { 2108}
(( segid " " and resid 305 and name HD2 ))
( segid " " and resid 283 and name HD1%)
3.200 1.300 1.300 peak 2108 spectrum 1 weight 0.10000E+01 volume 0.65893E-02 ppm1 3.146 ppm2 0.722 CV 1
ASSI { 4630}
(( segid " " and resid 305 and name HD3 ))
(( segid " " and resid 306 and name H ))
2.900 1.100 1.100 peak 4630 spectrum 1 weight 0.10000E+01 volume 0.14971E-02 ppm1 3.031 ppm2 8.006 CV 1
ASSI { 4342}
(( segid " " and resid 293 and name HD3 ))
(( segid " " and resid 290 and name HA ))
3.500 1.500 1.500 peak 4342 spectrum 1 weight 0.10000E+01 volume 0.82329E-03 ppm1 3.164 ppm2 4.004 CV 1
ASSI { 266}
( segid " " and resid 192 and name HD1%)
(( segid " " and resid 196 and name HB2 ))
3.200 1.300 1.300 peak 266 spectrum 1 weight 0.10000E+01 volume 0.20893E-02 ppm1 0.870 ppm2 2.601 CV 1
ASSI { 3787}
(( segid " " and resid 293 and name HD3 ))
(( segid " " and resid 293 and name HE ))
3.500 1.500 1.500 peak 3787 spectrum 1 weight 0.10000E+01 volume 0.52161E-03 ppm1 3.164 ppm2 7.804 CV 1
ASSI { 3172}
(( segid " " and resid 318 and name HG12))
(( segid " " and resid 319 and name H ))
5.000 3.100 1.000 peak 3172 spectrum 1 weight 0.10000E+01 volume 0.56109E-03 ppm1 0.985 ppm2 7.843 CV 1
ASSI { 2991}
( segid " " and resid 339 and name HD1%)
( segid " " and resid 358 and name HD% )
3.700 1.700 1.700 peak 2991 spectrum 1 weight 0.10000E+01 volume 0.26983E-02 ppm1 0.647 ppm2 7.036 CV 1
ASSI { 2383}
( segid " " and resid 361 and name HD% )
(( segid " " and resid 361 and name HB2 ))
3.000 1.100 1.100 peak 2383 spectrum 1 weight 0.10000E+01 volume 0.82329E-03 ppm1 7.141 ppm2 3.066 CV 1
ASSI { 3439}
( segid " " and resid 420 and name HD1%)
(( segid " " and resid 422 and name HB2 ))
2.600 2.600 3.400 peak 3439 spectrum 1 weight 0.10000E+01 volume 0.11616E-02 ppm1 0.771 ppm2 2.405 CV 1
ASSI { 3234}
( segid " " and resid 420 and name HD1%)
(( segid " " and resid 420 and name HB ))
2.200 0.600 0.600 peak 3234 spectrum 1 weight 0.10000E+01 volume 0.15079E-01 ppm1 0.770 ppm2 1.766 CV 1
ASSI { 2711}
( segid " " and resid 339 and name HD1%)
( segid " " and resid 329 and name HD1%)
2.100 2.100 3.900 peak 2711 spectrum 1 weight 0.10000E+01 volume 0.44380E-02 ppm1 0.645 ppm2 0.116 CV 1
ASSI { 2617}
( segid " " and resid 372 and name HG2%)
(( segid " " and resid 373 and name H ))
2.300 0.700 0.700 peak 2617 spectrum 1 weight 0.10000E+01 volume 0.59265E-02 ppm1 0.745 ppm2 8.230 CV 1
ASSI { 3196}
( segid " " and resid 436 and name HD1%)
(( segid " " and resid 436 and name HB3 ))
3.000 1.100 1.100 peak 3196 spectrum 1 weight 0.10000E+01 volume 0.60732E-02 ppm1 1.012 ppm2 1.952 CV 1
ASSI { 2237}
( segid " " and resid 243 and name HD1%)
(( segid " " and resid 243 and name H ))
3.700 1.700 1.700 peak 2237 spectrum 1 weight 0.10000E+01 volume 0.18693E-02 ppm1 0.012 ppm2 7.858 CV 1
ASSI { 3388}
( segid " " and resid 186 and name HD2%)
(( segid " " and resid 186 and name HA ))
2.600 0.800 0.800 peak 3388 spectrum 1 weight 0.10000E+01 volume 0.98258E-02 ppm1 0.830 ppm2 4.245 CV 1
ASSI { 3432}
(( segid " " and resid 226 and name HG2 ))
(( segid " " and resid 226 and name HB3 ))
2.400 0.700 0.700 peak 3432 spectrum 1 weight 0.10000E+01 volume 0.45621E-02 ppm1 1.278 ppm2 1.957 CV 1
ASSI { 556}
(( segid " " and resid 303 and name HA ))
( segid " " and resid 303 and name HE% )
5.000 3.100 1.000 peak 556 spectrum 1 weight 0.10000E+01 volume 0.40600E-03 ppm1 3.825 ppm2 6.812 CV 1
ASSI { 2378}
( segid " " and resid 388 and name HE% )
(( segid " " and resid 388 and name HB3 ))
2.900 1.100 1.100 peak 2378 spectrum 1 weight 0.10000E+01 volume 0.10404E-01 ppm1 1.847 ppm2 1.347 CV 1
ASSI { 2874}
(( segid " " and resid 331 and name HE2 ))
(( segid " " and resid 331 and name HA ))
3.500 1.600 1.600 peak 2874 spectrum 1 weight 0.10000E+01 volume 0.88249E-03 ppm1 2.917 ppm2 4.500 CV 1
ASSI { 326}
( segid " " and resid 446 and name HB% )
(( segid " " and resid 395 and name HG2 ))
3.400 1.400 1.400 peak 326 spectrum 1 weight 0.10000E+01 volume 0.19454E-02 ppm1 1.264 ppm2 2.277 CV 1
ASSI { 4117}
(( segid " " and resid 366 and name HA ))
(( segid " " and resid 366 and name HG3 ))
2.500 0.800 0.800 peak 4117 spectrum 1 weight 0.10000E+01 volume 0.11379E-01 ppm1 3.931 ppm2 2.212 CV 1
OR { 4117}
(( segid " " and resid 366 and name HA ))
(( segid " " and resid 366 and name HG2 ))
ASSI { 1791}
( segid " " and resid 271 and name HD1%)
( segid " " and resid 270 and name HE% )
4.400 2.400 1.600 peak 1791 spectrum 1 weight 0.10000E+01 volume 0.59491E-03 ppm1 0.842 ppm2 6.047 CV 1
ASSI { 3254}
(( segid " " and resid 406 and name HG2 ))
(( segid " " and resid 406 and name HB3 ))
2.900 1.000 1.000 peak 3254 spectrum 1 weight 0.10000E+01 volume 0.20103E-02 ppm1 2.581 ppm2 1.916 CV 1
OR { 3254}
(( segid " " and resid 406 and name HG2 ))
(( segid " " and resid 406 and name HB2 ))
ASSI { 4107}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 371 and name HB ))
2.200 0.600 0.600 peak 4107 spectrum 1 weight 0.10000E+01 volume 0.50976E-02 ppm1 0.367 ppm2 1.927 CV 1
ASSI { 2296}
(( segid " " and resid 406 and name HG2 ))
(( segid " " and resid 406 and name HG3 ))
1.900 0.400 0.400 peak 2296 spectrum 1 weight 0.10000E+01 volume 0.36962E-02 ppm1 2.577 ppm2 2.098 CV 1
ASSI { 3607}
(( segid " " and resid 308 and name HD2 ))
(( segid " " and resid 308 and name HA ))
2.000 0.500 0.500 peak 3607 spectrum 1 weight 0.10000E+01 volume 0.10226E-01 ppm1 1.530 ppm2 3.966 CV 1
OR { 3607}
(( segid " " and resid 308 and name HD3 ))
(( segid " " and resid 308 and name HA ))
ASSI { 2806}
( segid " " and resid 202 and name HE% )
(( segid " " and resid 206 and name H ))
3.700 1.700 1.700 peak 2806 spectrum 1 weight 0.10000E+01 volume 0.43026E-02 ppm1 1.869 ppm2 7.658 CV 1
ASSI { 2897}
(( segid " " and resid 281 and name HA ))
(( segid " " and resid 281 and name HG2 ))
2.900 1.000 1.000 peak 2897 spectrum 1 weight 0.10000E+01 volume 0.68315E-02 ppm1 3.978 ppm2 1.408 CV 1
OR { 2897}
(( segid " " and resid 281 and name HA ))
(( segid " " and resid 281 and name HG3 ))
ASSI { 2276}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 277 and name HD22))
3.000 3.000 3.000 peak 2276 spectrum 1 weight 0.10000E+01 volume 0.52161E-03 ppm1 0.607 ppm2 6.117 CV 1
ASSI { 2801}
(( segid " " and resid 222 and name HB2 ))
( segid " " and resid 223 and name HE% )
4.600 2.600 1.400 peak 2801 spectrum 1 weight 0.10000E+01 volume 0.44549E-03 ppm1 1.221 ppm2 6.630 CV 1
ASSI { 3144}
( segid " " and resid 373 and name HD1%)
(( segid " " and resid 373 and name HB3 ))
2.700 0.900 0.900 peak 3144 spectrum 1 weight 0.10000E+01 volume 0.25432E-02 ppm1 -0.196 ppm2 1.344 CV 1
ASSI { 2082}
(( segid " " and resid 418 and name HA2 ))
(( segid " " and resid 419 and name H ))
3.800 1.800 1.800 peak 2082 spectrum 1 weight 0.10000E+01 volume 0.42293E-03 ppm1 3.910 ppm2 7.937 CV 1
ASSI { 3191}
(( segid " " and resid 299 and name HE2 ))
(( segid " " and resid 299 and name H ))
3.900 1.900 1.900 peak 3191 spectrum 1 weight 0.10000E+01 volume 0.21823E-02 ppm1 2.848 ppm2 7.495 CV 1
ASSI { 1976}
(( segid " " and resid 365 and name HB3 ))
(( segid " " and resid 365 and name HA ))
2.300 0.600 0.600 peak 1976 spectrum 1 weight 0.10000E+01 volume 0.71869E-02 ppm1 1.991 ppm2 3.876 CV 1
OR { 1976}
(( segid " " and resid 365 and name HB2 ))
(( segid " " and resid 365 and name HA ))
ASSI { 1021}
(( segid " " and resid 242 and name HB3 ))
( segid " " and resid 243 and name HD2%)
4.500 2.500 1.500 peak 1021 spectrum 1 weight 0.10000E+01 volume 0.57798E-03 ppm1 2.173 ppm2 0.168 CV 1
ASSI { 1452}
(( segid " " and resid 272 and name HD2 ))
(( segid " " and resid 272 and name HA ))
3.800 1.800 1.800 peak 1452 spectrum 1 weight 0.10000E+01 volume 0.48494E-02 ppm1 3.229 ppm2 4.258 CV 1
OR { 1452}
(( segid " " and resid 272 and name HD3 ))
(( segid " " and resid 272 and name HA ))
ASSI { 2498}
(( segid " " and resid 251 and name HG3 ))
(( segid " " and resid 251 and name H ))
3.400 1.500 1.500 peak 2498 spectrum 1 weight 0.10000E+01 volume 0.17932E-02 ppm1 2.112 ppm2 7.869 CV 1
ASSI { 876}
( segid " " and resid 367 and name HD2%)
( segid " " and resid 303 and name HD% )
2.600 0.800 0.800 peak 876 spectrum 1 weight 0.10000E+01 volume 0.64398E-02 ppm1 0.778 ppm2 7.077 CV 1
ASSI { 4407}
(( segid " " and resid 318 and name HG13))
(( segid " " and resid 318 and name HA ))
3.000 1.100 1.100 peak 4407 spectrum 1 weight 0.10000E+01 volume 0.18186E-02 ppm1 0.611 ppm2 3.368 CV 1
ASSI { 247}
(( segid " " and resid 187 and name HG2 ))
(( segid " " and resid 188 and name HD2 ))
4.500 2.500 1.500 peak 247 spectrum 1 weight 0.10000E+01 volume 0.96146E-03 ppm1 1.425 ppm2 3.477 CV 1
OR { 247}
(( segid " " and resid 187 and name HG2 ))
(( segid " " and resid 188 and name HD3 ))
ASSI { 2830}
(( segid " " and resid 306 and name HB3 ))
(( segid " " and resid 306 and name HA ))
3.400 1.400 1.400 peak 2830 spectrum 1 weight 0.10000E+01 volume 0.23966E-03 ppm1 0.243 ppm2 3.636 CV 1
ASSI { 2548}
(( segid " " and resid 276 and name HB3 ))
(( segid " " and resid 276 and name H ))
2.900 1.000 1.000 peak 2548 spectrum 1 weight 0.10000E+01 volume 0.22866E-02 ppm1 1.824 ppm2 6.941 CV 1
OR { 2548}
(( segid " " and resid 276 and name HB2 ))
(( segid " " and resid 276 and name H ))
ASSI { 4701}
(( segid " " and resid 252 and name HB3 ))
(( segid " " and resid 252 and name HA ))
2.700 0.900 0.900 peak 4701 spectrum 1 weight 0.10000E+01 volume 0.52274E-02 ppm1 3.676 ppm2 4.334 CV 1
ASSI { 3733}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 279 and name H ))
2.700 0.900 0.900 peak 3733 spectrum 1 weight 0.10000E+01 volume 0.34849E-02 ppm1 2.151 ppm2 9.005 CV 1
ASSI { 3383}
(( segid " " and resid 366 and name HA ))
(( segid " " and resid 366 and name H ))
2.700 0.900 0.900 peak 3383 spectrum 1 weight 0.10000E+01 volume 0.31409E-02 ppm1 3.920 ppm2 8.327 CV 1
ASSI { 4528}
(( segid " " and resid 305 and name HD3 ))
(( segid " " and resid 305 and name HB2 ))
2.900 1.100 1.100 peak 4528 spectrum 1 weight 0.10000E+01 volume 0.60901E-02 ppm1 3.026 ppm2 1.812 CV 1
ASSI { 4601}
( segid " " and resid 335 and name HG2%)
(( segid " " and resid 334 and name H ))
4.400 2.400 1.600 peak 4601 spectrum 1 weight 0.10000E+01 volume 0.11757E-02 ppm1 1.246 ppm2 8.122 CV 1
ASSI { 4171}
( segid " " and resid 240 and name HG1%)
(( segid " " and resid 240 and name HA ))
2.700 0.900 0.900 peak 4171 spectrum 1 weight 0.10000E+01 volume 0.37272E-02 ppm1 1.038 ppm2 3.234 CV 1
ASSI { 2080}
(( segid " " and resid 318 and name HG13))
( segid " " and resid 322 and name HD1%)
4.500 2.500 1.500 peak 2080 spectrum 1 weight 0.10000E+01 volume 0.67666E-03 ppm1 0.615 ppm2 -0.170 CV 1
ASSI { 3413}
( segid " " and resid 367 and name HD2%)
( segid " " and resid 368 and name HE% )
3.500 1.600 1.600 peak 3413 spectrum 1 weight 0.10000E+01 volume 0.13985E-02 ppm1 0.778 ppm2 6.775 CV 1
ASSI { 4300}
(( segid " " and resid 318 and name HG13))
(( segid " " and resid 318 and name H ))
4.000 2.000 2.000 peak 4300 spectrum 1 weight 0.10000E+01 volume 0.17848E-02 ppm1 0.611 ppm2 8.037 CV 1
ASSI { 2098}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 393 and name HA ))
3.000 1.100 1.100 peak 2098 spectrum 1 weight 0.10000E+01 volume 0.14013E-02 ppm1 0.557 ppm2 4.280 CV 1
ASSI { 1320}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 409 and name HB3 ))
2.700 0.900 0.900 peak 1320 spectrum 1 weight 0.10000E+01 volume 0.89546E-02 ppm1 0.779 ppm2 1.917 CV 1
ASSI { 1788}
(( segid " " and resid 374 and name HB3 ))
(( segid " " and resid 320 and name HH2 ))
4.800 2.900 1.200 peak 1788 spectrum 1 weight 0.10000E+01 volume 0.54417E-03 ppm1 1.791 ppm2 7.185 CV 1
ASSI { 3591}
( segid " " and resid 207 and name HG2%)
(( segid " " and resid 208 and name H ))
4.300 2.400 1.700 peak 3591 spectrum 1 weight 0.10000E+01 volume 0.13054E-02 ppm1 0.459 ppm2 8.248 CV 1
ASSI { 4100}
(( segid " " and resid 393 and name HB2 ))
(( segid " " and resid 393 and name HA ))
3.000 1.100 1.100 peak 4100 spectrum 1 weight 0.10000E+01 volume 0.47930E-02 ppm1 2.084 ppm2 4.286 CV 1
ASSI { 2035}
(( segid " " and resid 424 and name HB2 ))
(( segid " " and resid 424 and name HA ))
2.600 0.800 0.800 peak 2035 spectrum 1 weight 0.10000E+01 volume 0.66457E-02 ppm1 3.904 ppm2 4.238 CV 1
ASSI { 4132}
( segid " " and resid 342 and name HD1%)
( segid " " and resid 231 and name HD% )
2.900 1.100 1.100 peak 4132 spectrum 1 weight 0.10000E+01 volume 0.20187E-02 ppm1 0.657 ppm2 6.767 CV 1
ASSI { 4280}
(( segid " " and resid 331 and name HD2 ))
(( segid " " and resid 331 and name HE2 ))
2.200 0.600 0.600 peak 4280 spectrum 1 weight 0.10000E+01 volume 0.10003E-01 ppm1 1.640 ppm2 2.876 CV 1
OR { 4280}
(( segid " " and resid 331 and name HD3 ))
(( segid " " and resid 331 and name HE3 ))
OR { 4280}
(( segid " " and resid 331 and name HD3 ))
(( segid " " and resid 331 and name HE2 ))
OR { 4280}
(( segid " " and resid 331 and name HD2 ))
(( segid " " and resid 331 and name HE3 ))
ASSI { 3810}
( segid " " and resid 236 and name HD1%)
(( segid " " and resid 236 and name HG12))
2.000 0.500 0.500 peak 3810 spectrum 1 weight 0.10000E+01 volume 0.18360E-01 ppm1 0.832 ppm2 1.114 CV 1
ASSI { 999}
(( segid " " and resid 367 and name HB2 ))
(( segid " " and resid 367 and name HB3 ))
2.400 0.700 0.700 peak 999 spectrum 1 weight 0.10000E+01 volume 0.61465E-03 ppm1 1.013 ppm2 0.056 CV 1
ASSI { 2630}
(( segid " " and resid 183 and name HG3 ))
(( segid " " and resid 183 and name HB3 ))
2.100 0.600 0.600 peak 2630 spectrum 1 weight 0.10000E+01 volume 0.20596E-01 ppm1 2.446 ppm2 1.857 CV 1
ASSI { 3224}
( segid " " and resid 325 and name HE% )
(( segid " " and resid 325 and name HG2 ))
2.200 0.600 0.600 peak 3224 spectrum 1 weight 0.10000E+01 volume 0.71220E-02 ppm1 0.929 ppm2 2.407 CV 1
ASSI { 1504}
( segid " " and resid 344 and name HG2%)
(( segid " " and resid 340 and name HG3 ))
4.500 2.600 1.500 peak 1504 spectrum 1 weight 0.10000E+01 volume 0.27293E-02 ppm1 0.896 ppm2 2.309 CV 1
OR { 1504}
( segid " " and resid 344 and name HG2%)
(( segid " " and resid 340 and name HG2 ))
ASSI { 2406}
(( segid " " and resid 218 and name HB2 ))
(( segid " " and resid 218 and name HB3 ))
2.000 0.500 0.500 peak 2406 spectrum 1 weight 0.10000E+01 volume 0.28590E-02 ppm1 2.726 ppm2 2.531 CV 1
ASSI { 4543}
( segid " " and resid 372 and name HG2%)
(( segid " " and resid 374 and name HE2 ))
3.900 1.900 1.900 peak 4543 spectrum 1 weight 0.10000E+01 volume 0.19511E-02 ppm1 0.745 ppm2 2.947 CV 1
OR { 4543}
( segid " " and resid 372 and name HG2%)
(( segid " " and resid 374 and name HE3 ))
ASSI { 3236}
(( segid " " and resid 413 and name HB3 ))
(( segid " " and resid 410 and name HA ))
3.200 1.300 1.300 peak 3236 spectrum 1 weight 0.10000E+01 volume 0.91351E-03 ppm1 2.999 ppm2 4.347 CV 1
ASSI { 4104}
(( segid " " and resid 339 and name HG12))
(( segid " " and resid 339 and name H ))
4.000 2.000 2.000 peak 4104 spectrum 1 weight 0.10000E+01 volume 0.62029E-03 ppm1 0.562 ppm2 8.362 CV 1
ASSI { 3195}
(( segid " " and resid 309 and name HG2 ))
(( segid " " and resid 306 and name HA ))
2.800 1.000 1.000 peak 3195 spectrum 1 weight 0.10000E+01 volume 0.20949E-02 ppm1 2.297 ppm2 3.647 CV 1
ASSI { 4684}
( segid " " and resid 373 and name HD1%)
(( segid " " and resid 373 and name HA ))
2.400 0.700 0.700 peak 4684 spectrum 1 weight 0.10000E+01 volume 0.30507E-02 ppm1 -0.196 ppm2 2.332 CV 1
ASSI { 2342}
(( segid " " and resid 367 and name HA ))
( segid " " and resid 367 and name HD1%)
2.600 0.900 0.900 peak 2342 spectrum 1 weight 0.10000E+01 volume 0.34229E-02 ppm1 4.026 ppm2 0.666 CV 1
ASSI { 4430}
( segid " " and resid 329 and name HD1%)
(( segid " " and resid 326 and name HB2 ))
5.200 3.400 0.800 peak 4430 spectrum 1 weight 0.10000E+01 volume 0.80073E-03 ppm1 0.118 ppm2 2.823 CV 1
ASSI { 4151}
(( segid " " and resid 329 and name HB ))
(( segid " " and resid 329 and name HA ))
3.500 1.500 1.500 peak 4151 spectrum 1 weight 0.10000E+01 volume 0.53289E-03 ppm1 1.726 ppm2 3.830 CV 1
ASSI { 2190}
(( segid " " and resid 251 and name HB3 ))
(( segid " " and resid 246 and name HA ))
4.400 2.400 1.600 peak 2190 spectrum 1 weight 0.10000E+01 volume 0.65696E-03 ppm1 1.593 ppm2 3.823 CV 1
ASSI { 2695}
(( segid " " and resid 272 and name HG2 ))
(( segid " " and resid 272 and name HA ))
2.500 0.800 0.800 peak 2695 spectrum 1 weight 0.10000E+01 volume 0.52810E-02 ppm1 1.800 ppm2 4.265 CV 1
OR { 2695}
(( segid " " and resid 272 and name HG3 ))
(( segid " " and resid 272 and name HA ))
ASSI { 3171}
(( segid " " and resid 217 and name HA ))
(( segid " " and resid 217 and name HG13))
2.800 0.900 0.900 peak 3171 spectrum 1 weight 0.10000E+01 volume 0.23684E-02 ppm1 2.989 ppm2 0.472 CV 1
OR { 3171}
(( segid " " and resid 217 and name HA ))
( segid " " and resid 217 and name HG2%)
OR { 3171}
(( segid " " and resid 217 and name HA ))
(( segid " " and resid 217 and name HG12))
ASSI { 3976}
( segid " " and resid 364 and name HG2%)
(( segid " " and resid 363 and name HA ))
4.400 2.500 1.600 peak 3976 spectrum 1 weight 0.10000E+01 volume 0.10404E-02 ppm1 0.906 ppm2 5.140 CV 1
ASSI { 1919}
(( segid " " and resid 239 and name HD2 ))
(( segid " " and resid 239 and name HE3 ))
2.600 0.800 0.800 peak 1919 spectrum 1 weight 0.10000E+01 volume 0.39472E-02 ppm1 1.752 ppm2 2.915 CV 1
OR { 1919}
(( segid " " and resid 239 and name HD2 ))
(( segid " " and resid 239 and name HE2 ))
ASSI { 2216}
(( segid " " and resid 374 and name HB3 ))
(( segid " " and resid 320 and name HZ2 ))
5.600 3.900 0.400 peak 2216 spectrum 1 weight 0.10000E+01 volume 0.52161E-03 ppm1 1.802 ppm2 7.368 CV 1
ASSI { 4200}
( segid " " and resid 321 and name HD1%)
(( segid " " and resid 213 and name HZ ))
3.800 1.800 1.800 peak 4200 spectrum 1 weight 0.10000E+01 volume 0.10432E-02 ppm1 0.893 ppm2 6.335 CV 1
ASSI { 12}
( segid " " and resid 435 and name HG2%)
(( segid " " and resid 439 and name H ))
3.500 1.500 1.500 peak 12 spectrum 1 weight 0.10000E+01 volume 0.11081E-02 ppm1 0.901 ppm2 8.739 CV 1
ASSI { 1776}
( segid " " and resid 325 and name HE% )
(( segid " " and resid 325 and name HA ))
2.700 0.900 0.900 peak 1776 spectrum 1 weight 0.10000E+01 volume 0.43167E-02 ppm1 0.927 ppm2 3.874 CV 1
ASSI { 1780}
( segid " " and resid 194 and name HD2%)
( segid " " and resid 317 and name HD2%)
3.000 1.100 1.100 peak 1780 spectrum 1 weight 0.10000E+01 volume 0.30930E-02 ppm1 0.551 ppm2 0.367 CV 1
ASSI { 3959}
(( segid " " and resid 370 and name HB2 ))
(( segid " " and resid 370 and name HA ))
2.900 1.100 1.100 peak 3959 spectrum 1 weight 0.10000E+01 volume 0.30084E-02 ppm1 2.761 ppm2 4.715 CV 1
OR { 3959}
(( segid " " and resid 370 and name HB3 ))
(( segid " " and resid 370 and name HA ))
ASSI { 3928}
( segid " " and resid 339 and name HD1%)
(( segid " " and resid 339 and name HG13))
2.000 0.500 0.500 peak 3928 spectrum 1 weight 0.10000E+01 volume 0.13675E-01 ppm1 0.645 ppm2 1.538 CV 1
OR { 3928}
( segid " " and resid 339 and name HD1%)
(( segid " " and resid 339 and name HB ))
ASSI { 4771}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 329 and name HG13))
3.000 3.000 3.000 peak 4771 spectrum 1 weight 0.10000E+01 volume 0.49904E-03 ppm1 0.653 ppm2 0.291 CV 1
ASSI { 4496}
(( segid " " and resid 318 and name HG12))
( segid " " and resid 368 and name HE% )
4.900 3.000 1.100 peak 4496 spectrum 1 weight 0.10000E+01 volume 0.34398E-03 ppm1 0.987 ppm2 6.723 CV 1
ASSI { 3390}
( segid " " and resid 371 and name HG2%)
(( segid " " and resid 371 and name HB ))
2.100 0.500 0.500 peak 3390 spectrum 1 weight 0.10000E+01 volume 0.82442E-02 ppm1 0.962 ppm2 1.957 CV 1
ASSI { 4415}
( segid " " and resid 386 and name HB% )
(( segid " " and resid 386 and name HA ))
2.500 0.800 0.800 peak 4415 spectrum 1 weight 0.10000E+01 volume 0.81709E-02 ppm1 1.451 ppm2 4.448 CV 1
ASSI { 3527}
(( segid " " and resid 244 and name HE3 ))
(( segid " " and resid 244 and name HD2 ))
2.800 1.000 1.000 peak 3527 spectrum 1 weight 0.10000E+01 volume 0.24671E-02 ppm1 2.557 ppm2 0.945 CV 1
OR { 3527}
(( segid " " and resid 244 and name HE2 ))
(( segid " " and resid 244 and name HD2 ))
ASSI { 4542}
(( segid " " and resid 228 and name HA ))
(( segid " " and resid 229 and name H ))
2.900 1.000 1.000 peak 4542 spectrum 1 weight 0.10000E+01 volume 0.64285E-03 ppm1 4.007 ppm2 9.608 CV 1
ASSI { 4483}
(( segid " " and resid 334 and name HG3 ))
(( segid " " and resid 334 and name H ))
3.300 1.400 1.400 peak 4483 spectrum 1 weight 0.10000E+01 volume 0.24078E-02 ppm1 2.147 ppm2 8.117 CV 1
ASSI { 4099}
(( segid " " and resid 413 and name HA ))
(( segid " " and resid 413 and name HB2 ))
3.100 1.200 1.200 peak 4099 spectrum 1 weight 0.10000E+01 volume 0.13026E-02 ppm1 4.196 ppm2 3.071 CV 1
ASSI { 3318}
(( segid " " and resid 189 and name HB ))
(( segid " " and resid 189 and name H ))
3.200 1.300 1.300 peak 3318 spectrum 1 weight 0.10000E+01 volume 0.53007E-03 ppm1 2.183 ppm2 8.873 CV 1
ASSI { 2973}
(( segid " " and resid 299 and name HB3 ))
( segid " " and resid 300 and name HG1%)
5.000 3.100 1.000 peak 2973 spectrum 1 weight 0.10000E+01 volume 0.48776E-03 ppm1 1.705 ppm2 0.077 CV 1
ASSI { 1218}
( segid " " and resid 225 and name HE% )
( segid " " and resid 329 and name HD1%)
5.800 4.200 0.200 peak 1218 spectrum 1 weight 0.10000E+01 volume 0.45113E-03 ppm1 1.914 ppm2 0.114 CV 1
ASSI { 2106}
( segid " " and resid 267 and name HD1%)
( segid " " and resid 213 and name HD% )
2.500 0.800 0.800 peak 2106 spectrum 1 weight 0.10000E+01 volume 0.42236E-02 ppm1 0.918 ppm2 6.708 CV 1
ASSI { 2238}
( segid " " and resid 339 and name HG2%)
( segid " " and resid 329 and name HD1%)
2.700 0.900 0.900 peak 2238 spectrum 1 weight 0.10000E+01 volume 0.43675E-02 ppm1 0.706 ppm2 0.116 CV 1
ASSI { 4751}
(( segid " " and resid 222 and name HG2 ))
(( segid " " and resid 222 and name HA ))
2.600 0.800 0.800 peak 4751 spectrum 1 weight 0.10000E+01 volume 0.29548E-02 ppm1 0.384 ppm2 3.787 CV 1
ASSI { 3444}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 346 and name H ))
3.700 1.700 1.700 peak 3444 spectrum 1 weight 0.10000E+01 volume 0.33101E-02 ppm1 1.008 ppm2 8.986 CV 1
ASSI { 2570}
( segid " " and resid 317 and name HD2%)
(( segid " " and resid 317 and name HA ))
3.500 1.600 1.600 peak 2570 spectrum 1 weight 0.10000E+01 volume 0.26419E-02 ppm1 0.343 ppm2 3.130 CV 1
ASSI { 4279}
( segid " " and resid 386 and name HB% )
(( segid " " and resid 383 and name HB2 ))
3.200 1.300 1.300 peak 4279 spectrum 1 weight 0.10000E+01 volume 0.88531E-03 ppm1 1.451 ppm2 3.800 CV 1
OR { 4279}
( segid " " and resid 386 and name HB% )
(( segid " " and resid 383 and name HB3 ))
ASSI { 4535}
(( segid " " and resid 302 and name HG2 ))
( segid " " and resid 306 and name HD2%)
3.000 1.100 1.100 peak 4535 spectrum 1 weight 0.10000E+01 volume 0.18496E-02 ppm1 2.246 ppm2 -0.356 CV 1
ASSI { 1311}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 360 and name HZ ))
4.400 2.400 1.600 peak 1311 spectrum 1 weight 0.10000E+01 volume 0.36652E-03 ppm1 0.610 ppm2 6.613 CV 1
ASSI { 2691}
(( segid " " and resid 342 and name HB ))
(( segid " " and resid 342 and name HG13))
2.900 1.000 1.000 peak 2691 spectrum 1 weight 0.10000E+01 volume 0.86278E-03 ppm1 1.710 ppm2 1.301 CV 1
ASSI { 2595}
( segid " " and resid 376 and name HG2%)
(( segid " " and resid 376 and name H ))
3.600 1.600 1.600 peak 2595 spectrum 1 weight 0.10000E+01 volume 0.17453E-02 ppm1 0.894 ppm2 9.505 CV 1
ASSI { 3430}
(( segid " " and resid 232 and name HB2 ))
(( segid " " and resid 232 and name HD3 ))
3.500 1.600 1.600 peak 3430 spectrum 1 weight 0.10000E+01 volume 0.43421E-03 ppm1 1.486 ppm2 2.989 CV 1
ASSI { 4718}
( segid " " and resid 255 and name HD1%)
( segid " " and resid 212 and name HG2%)
4.200 2.200 1.800 peak 4718 spectrum 1 weight 0.10000E+01 volume 0.55263E-03 ppm1 0.602 ppm2 -0.154 CV 1
ASSI { 4663}
( segid " " and resid 212 and name HG1%)
(( segid " " and resid 212 and name HA ))
3.500 1.500 1.500 peak 4663 spectrum 1 weight 0.10000E+01 volume 0.17227E-02 ppm1 -0.343 ppm2 3.233 CV 1
ASSI { 4559}
(( segid " " and resid 247 and name HA ))
(( segid " " and resid 247 and name H ))
3.400 1.500 1.500 peak 4559 spectrum 1 weight 0.10000E+01 volume 0.74717E-03 ppm1 4.125 ppm2 8.407 CV 1
ASSI { 1300}
( segid " " and resid 240 and name HG1%)
( segid " " and resid 243 and name HD1%)
4.200 2.200 1.800 peak 1300 spectrum 1 weight 0.10000E+01 volume 0.12631E-02 ppm1 1.036 ppm2 0.024 CV 1
ASSI { 4594}
(( segid " " and resid 297 and name HB ))
(( segid " " and resid 298 and name H ))
2.400 0.700 0.700 peak 4594 spectrum 1 weight 0.10000E+01 volume 0.26503E-02 ppm1 3.943 ppm2 7.326 CV 1
ASSI { 4499}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 196 and name HB3 ))
4.800 2.900 1.200 peak 4499 spectrum 1 weight 0.10000E+01 volume 0.54981E-03 ppm1 1.451 ppm2 2.748 CV 1
ASSI { 2746}
( segid " " and resid 225 and name HE% )
( segid " " and resid 328 and name HG2%)
1.900 0.400 0.400 peak 2746 spectrum 1 weight 0.10000E+01 volume 0.22389E-01 ppm1 1.914 ppm2 0.757 CV 1
OR { 2746}
( segid " " and resid 225 and name HE% )
( segid " " and resid 328 and name HG1%)
ASSI { 4808}
( segid " " and resid 230 and name HD1%)
(( segid " " and resid 230 and name HB ))
2.500 0.800 0.800 peak 4808 spectrum 1 weight 0.10000E+01 volume 0.40713E-02 ppm1 0.650 ppm2 1.821 CV 1
ASSI { 3905}
(( segid " " and resid 380 and name HA ))
(( segid " " and resid 381 and name H ))
3.100 1.200 1.200 peak 3905 spectrum 1 weight 0.10000E+01 volume 0.14238E-02 ppm1 4.068 ppm2 8.182 CV 1
ASSI { 4053}
( segid " " and resid 385 and name HE% )
(( segid " " and resid 383 and name HB2 ))
3.500 1.600 1.600 peak 4053 spectrum 1 weight 0.10000E+01 volume 0.13139E-02 ppm1 1.914 ppm2 3.875 CV 1
ASSI { 2922}
( segid " " and resid 391 and name HD2%)
(( segid " " and resid 391 and name HA ))
2.700 0.900 0.900 peak 2922 spectrum 1 weight 0.10000E+01 volume 0.36765E-02 ppm1 0.532 ppm2 4.373 CV 1
ASSI { 160}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 344 and name H ))
4.100 2.100 1.900 peak 160 spectrum 1 weight 0.10000E+01 volume 0.96428E-03 ppm1 0.656 ppm2 7.704 CV 1
ASSI { 4612}
( segid " " and resid 390 and name HG2%)
(( segid " " and resid 391 and name H ))
2.300 0.600 0.600 peak 4612 spectrum 1 weight 0.10000E+01 volume 0.90477E-02 ppm1 1.078 ppm2 8.190 CV 1
ASSI { 2656}
(( segid " " and resid 371 and name HB ))
( segid " " and resid 323 and name HG1%)
2.600 0.800 0.800 peak 2656 spectrum 1 weight 0.10000E+01 volume 0.41644E-02 ppm1 1.936 ppm2 0.799 CV 1
ASSI { 4679}
(( segid " " and resid 430 and name HZ3 ))
(( segid " " and resid 430 and name HZ2 ))
5.300 3.500 0.700 peak 4679 spectrum 1 weight 0.10000E+01 volume 0.43421E-03 ppm1 6.943 ppm2 7.311 CV 1
ASSI { 2066}
( segid " " and resid 387 and name HG2%)
(( segid " " and resid 387 and name HA ))
2.300 0.700 0.700 peak 2066 spectrum 1 weight 0.10000E+01 volume 0.13057E-01 ppm1 1.103 ppm2 4.287 CV 1
ASSI { 2022}
(( segid " " and resid 308 and name HG2 ))
(( segid " " and resid 305 and name HA ))
2.100 0.600 0.600 peak 2022 spectrum 1 weight 0.10000E+01 volume 0.17227E-02 ppm1 1.542 ppm2 3.833 CV 1
ASSI { 3992}
( segid " " and resid 385 and name HE% )
(( segid " " and resid 385 and name HA ))
3.900 1.900 1.900 peak 3992 spectrum 1 weight 0.10000E+01 volume 0.17312E-02 ppm1 1.912 ppm2 4.175 CV 1
ASSI { 3716}
(( segid " " and resid 185 and name HB3 ))
(( segid " " and resid 186 and name H ))
4.900 2.900 1.100 peak 3716 spectrum 1 weight 0.10000E+01 volume 0.53571E-03 ppm1 2.656 ppm2 8.040 CV 1
ASSI { 4392}
(( segid " " and resid 331 and name HG2 ))
(( segid " " and resid 331 and name HA ))
3.400 1.400 1.400 peak 4392 spectrum 1 weight 0.10000E+01 volume 0.71615E-03 ppm1 1.529 ppm2 4.526 CV 1
ASSI { 4406}
(( segid " " and resid 259 and name HB2 ))
(( segid " " and resid 259 and name HA ))
4.400 2.400 1.600 peak 4406 spectrum 1 weight 0.10000E+01 volume 0.29887E-03 ppm1 2.036 ppm2 4.790 CV 1
ASSI { 892}
(( segid " " and resid 302 and name HB3 ))
( segid " " and resid 306 and name HD2%)
4.500 2.600 1.500 peak 892 spectrum 1 weight 0.10000E+01 volume 0.32424E-03 ppm1 2.109 ppm2 -0.357 CV 1
ASSI { 3569}
( segid " " and resid 189 and name HD1%)
( segid " " and resid 201 and name HG2%)
2.400 0.700 0.700 peak 3569 spectrum 1 weight 0.10000E+01 volume 0.56529E-02 ppm1 0.737 ppm2 1.293 CV 1
ASSI { 1858}
(( segid " " and resid 287 and name HA ))
( segid " " and resid 287 and name HD% )
3.700 1.800 1.800 peak 1858 spectrum 1 weight 0.10000E+01 volume 0.79227E-03 ppm1 3.491 ppm2 6.329 CV 1
ASSI { 3652}
( segid " " and resid 346 and name HD2%)
(( segid " " and resid 325 and name HG3 ))
3.900 1.900 1.900 peak 3652 spectrum 1 weight 0.10000E+01 volume 0.15930E-02 ppm1 0.751 ppm2 2.718 CV 1
ASSI { 4319}
(( segid " " and resid 293 and name HD2 ))
(( segid " " and resid 293 and name HB3 ))
3.200 1.300 1.300 peak 4319 spectrum 1 weight 0.10000E+01 volume 0.89659E-03 ppm1 3.082 ppm2 1.699 CV 1
OR { 4319}
(( segid " " and resid 293 and name HD2 ))
(( segid " " and resid 293 and name HB2 ))
ASSI { 1678}
( segid " " and resid 372 and name HG2%)
( segid " " and resid 373 and name HD1%)
4.800 2.800 1.200 peak 1678 spectrum 1 weight 0.10000E+01 volume 0.13675E-02 ppm1 0.745 ppm2 -0.176 CV 1
ASSI { 4204}
(( segid " " and resid 240 and name HA ))
(( segid " " and resid 240 and name HB ))
3.600 1.600 1.600 peak 4204 spectrum 1 weight 0.10000E+01 volume 0.85714E-03 ppm1 3.242 ppm2 2.185 CV 1
ASSI { 4431}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 315 and name HA ))
2.200 0.600 0.600 peak 4431 spectrum 1 weight 0.10000E+01 volume 0.49002E-02 ppm1 0.348 ppm2 3.786 CV 1
ASSI { 3257}
(( segid " " and resid 222 and name HA ))
(( segid " " and resid 222 and name HB2 ))
3.200 1.300 1.300 peak 3257 spectrum 1 weight 0.10000E+01 volume 0.32339E-02 ppm1 3.783 ppm2 1.240 CV 1
OR { 3257}
(( segid " " and resid 222 and name HA ))
(( segid " " and resid 222 and name HD3 ))
OR { 3257}
(( segid " " and resid 222 and name HA ))
(( segid " " and resid 222 and name HD2 ))
ASSI { 516}
( segid " " and resid 264 and name HB% )
( segid " " and resid 231 and name HE% )
2.800 1.000 1.000 peak 516 spectrum 1 weight 0.10000E+01 volume 0.27913E-02 ppm1 0.953 ppm2 6.771 CV 1
OR { 516}
( segid " " and resid 264 and name HB% )
( segid " " and resid 231 and name HD% )
ASSI { 4606}
(( segid " " and resid 281 and name HG2 ))
(( segid " " and resid 281 and name H ))
2.000 0.500 0.500 peak 4606 spectrum 1 weight 0.10000E+01 volume 0.27518E-02 ppm1 1.405 ppm2 9.164 CV 1
OR { 4606}
(( segid " " and resid 281 and name HG3 ))
(( segid " " and resid 281 and name H ))
ASSI { 2563}
( segid " " and resid 412 and name HD1%)
(( segid " " and resid 412 and name H ))
3.100 1.200 1.200 peak 2563 spectrum 1 weight 0.10000E+01 volume 0.27293E-02 ppm1 0.843 ppm2 8.464 CV 1
ASSI { 1277}
(( segid " " and resid 393 and name HG3 ))
(( segid " " and resid 442 and name HE2 ))
3.600 1.600 1.600 peak 1277 spectrum 1 weight 0.10000E+01 volume 0.22782E-02 ppm1 2.273 ppm2 2.874 CV 1
OR { 1277}
(( segid " " and resid 393 and name HG3 ))
(( segid " " and resid 442 and name HE3 ))
ASSI { 4602}
( segid " " and resid 203 and name HE% )
( segid " " and resid 211 and name HB% )
2.200 0.600 0.600 peak 4602 spectrum 1 weight 0.10000E+01 volume 0.17360E-01 ppm1 2.221 ppm2 1.688 CV 1
ASSI { 4274}
(( segid " " and resid 304 and name HB2 ))
(( segid " " and resid 304 and name H ))
2.800 1.000 1.000 peak 4274 spectrum 1 weight 0.10000E+01 volume 0.12547E-02 ppm1 2.236 ppm2 8.667 CV 1
ASSI { 3503}
(( segid " " and resid 351 and name HB3 ))
(( segid " " and resid 351 and name H ))
5.100 3.200 0.900 peak 3503 spectrum 1 weight 0.10000E+01 volume 0.40883E-03 ppm1 2.113 ppm2 7.871 CV 1
ASSI { 3008}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 306 and name HA ))
1.800 0.400 0.400 peak 3008 spectrum 1 weight 0.10000E+01 volume 0.61155E-02 ppm1 0.379 ppm2 3.642 CV 1
ASSI { 2809}
(( segid " " and resid 336 and name HA ))
(( segid " " and resid 336 and name HB2 ))
3.100 1.200 1.200 peak 2809 spectrum 1 weight 0.10000E+01 volume 0.12011E-02 ppm1 3.952 ppm2 2.007 CV 1
OR { 2809}
(( segid " " and resid 336 and name HA ))
(( segid " " and resid 336 and name HB3 ))
ASSI { 120}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 316 and name HA ))
4.300 2.400 1.700 peak 120 spectrum 1 weight 0.10000E+01 volume 0.86278E-03 ppm1 0.348 ppm2 3.586 CV 1
ASSI { 2077}
( segid " " and resid 300 and name HG2%)
(( segid " " and resid 300 and name HB ))
2.100 0.500 0.500 peak 2077 spectrum 1 weight 0.10000E+01 volume 0.81821E-02 ppm1 0.538 ppm2 1.740 CV 1
ASSI { 1499}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 283 and name HA ))
3.300 1.400 1.400 peak 1499 spectrum 1 weight 0.10000E+01 volume 0.67102E-03 ppm1 0.378 ppm2 4.486 CV 1
ASSI { 4467}
( segid " " and resid 373 and name HD2%)
(( segid " " and resid 324 and name HB2 ))
3.500 1.500 1.500 peak 4467 spectrum 1 weight 0.10000E+01 volume 0.10798E-02 ppm1 0.517 ppm2 2.901 CV 1
ASSI { 3226}
( segid " " and resid 342 and name HG2%)
( segid " " and resid 342 and name HD1%)
2.000 0.500 0.500 peak 3226 spectrum 1 weight 0.10000E+01 volume 0.13113E-01 ppm1 0.514 ppm2 0.676 CV 1
ASSI { 2441}
( segid " " and resid 339 and name HD1%)
(( segid " " and resid 339 and name HA ))
3.700 1.700 1.700 peak 2441 spectrum 1 weight 0.10000E+01 volume 0.42547E-02 ppm1 0.646 ppm2 3.036 CV 1
ASSI { 90}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 341 and name H ))
4.900 3.000 1.100 peak 90 spectrum 1 weight 0.10000E+01 volume 0.77816E-03 ppm1 1.804 ppm2 8.519 CV 1
ASSI { 2758}
(( segid " " and resid 327 and name HD2 ))
(( segid " " and resid 327 and name HB3 ))
4.400 2.500 1.600 peak 2758 spectrum 1 weight 0.10000E+01 volume 0.29605E-03 ppm1 7.225 ppm2 3.152 CV 1
OR { 2758}
(( segid " " and resid 327 and name HD2 ))
(( segid " " and resid 327 and name HB2 ))
ASSI { 3270}
(( segid " " and resid 351 and name HB2 ))
(( segid " " and resid 277 and name HD21))
3.700 1.700 1.700 peak 3270 spectrum 1 weight 0.10000E+01 volume 0.30732E-03 ppm1 2.040 ppm2 7.653 CV 1
ASSI { 170}
(( segid " " and resid 320 and name HZ2 ))
(( segid " " and resid 374 and name HG3 ))
3.800 1.800 1.800 peak 170 spectrum 1 weight 0.10000E+01 volume 0.62029E-03 ppm1 7.377 ppm2 1.354 CV 1
OR { 170}
(( segid " " and resid 320 and name HZ2 ))
(( segid " " and resid 374 and name HG2 ))
ASSI { 1891}
(( segid " " and resid 221 and name HB3 ))
(( segid " " and resid 221 and name H ))
3.400 1.400 1.400 peak 1891 spectrum 1 weight 0.10000E+01 volume 0.71897E-03 ppm1 1.928 ppm2 8.764 CV 1
ASSI { 24}
(( segid " " and resid 252 and name HB3 ))
(( segid " " and resid 251 and name HG3 ))
2.900 2.900 3.100 peak 24 spectrum 1 weight 0.10000E+01 volume 0.55263E-03 ppm1 3.668 ppm2 2.133 CV 1
OR { 24}
(( segid " " and resid 252 and name HB3 ))
(( segid " " and resid 251 and name HG2 ))
ASSI { 2868}
(( segid " " and resid 363 and name HB3 ))
(( segid " " and resid 363 and name HB2 ))
2.800 1.000 1.000 peak 2868 spectrum 1 weight 0.10000E+01 volume 0.44549E-03 ppm1 2.627 ppm2 3.171 CV 1
ASSI { 4708}
(( segid " " and resid 243 and name HB3 ))
( segid " " and resid 243 and name HD1%)
3.600 1.600 1.600 peak 4708 spectrum 1 weight 0.10000E+01 volume 0.76410E-03 ppm1 1.203 ppm2 0.014 CV 1
ASSI { 1829}
(( segid " " and resid 391 and name HG ))
( segid " " and resid 391 and name HD2%)
2.500 0.800 0.800 peak 1829 spectrum 1 weight 0.10000E+01 volume 0.31860E-02 ppm1 1.657 ppm2 0.544 CV 1
ASSI { 2091}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 212 and name HB ))
2.600 0.900 0.900 peak 2091 spectrum 1 weight 0.10000E+01 volume 0.31465E-02 ppm1 -0.168 ppm2 1.173 CV 1
ASSI { 3309}
( segid " " and resid 359 and name HG1%)
(( segid " " and resid 359 and name HB ))
2.300 0.600 0.600 peak 3309 spectrum 1 weight 0.10000E+01 volume 0.57065E-02 ppm1 0.894 ppm2 1.573 CV 1
ASSI { 4017}
( segid " " and resid 207 and name HG2%)
(( segid " " and resid 207 and name HG12))
2.800 1.000 1.000 peak 4017 spectrum 1 weight 0.10000E+01 volume 0.27095E-02 ppm1 0.459 ppm2 1.312 CV 1
ASSI { 4000}
(( segid " " and resid 318 and name HG12))
( segid " " and resid 322 and name HD1%)
4.800 2.900 1.200 peak 4000 spectrum 1 weight 0.10000E+01 volume 0.91069E-03 ppm1 0.988 ppm2 -0.166 CV 1
ASSI { 4061}
(( segid " " and resid 425 and name HG2 ))
(( segid " " and resid 425 and name HE3 ))
3.200 1.300 1.300 peak 4061 spectrum 1 weight 0.10000E+01 volume 0.18524E-02 ppm1 1.462 ppm2 2.902 CV 1
OR { 4061}
(( segid " " and resid 425 and name HG2 ))
(( segid " " and resid 425 and name HE2 ))
ASSI { 3687}
(( segid " " and resid 342 and name HB ))
( segid " " and resid 342 and name HD1%)
3.600 1.600 1.600 peak 3687 spectrum 1 weight 0.10000E+01 volume 0.21428E-02 ppm1 1.709 ppm2 0.671 CV 1
ASSI { 3656}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 323 and name H ))
2.200 0.600 0.600 peak 3656 spectrum 1 weight 0.10000E+01 volume 0.29746E-02 ppm1 0.436 ppm2 7.771 CV 1
ASSI { 2334}
(( segid " " and resid 373 and name HA ))
(( segid " " and resid 373 and name H ))
3.500 1.500 1.500 peak 2334 spectrum 1 weight 0.10000E+01 volume 0.44831E-03 ppm1 2.335 ppm2 8.243 CV 1
ASSI { 623}
(( segid " " and resid 382 and name HZ2 ))
(( segid " " and resid 382 and name HZ3 ))
5.200 3.400 0.800 peak 623 spectrum 1 weight 0.10000E+01 volume 0.54981E-03 ppm1 7.460 ppm2 6.875 CV 1
OR { 623}
(( segid " " and resid 382 and name HZ2 ))
(( segid " " and resid 382 and name HD1 ))
ASSI { 4713}
(( segid " " and resid 372 and name HA ))
(( segid " " and resid 373 and name H ))
2.400 0.700 0.700 peak 4713 spectrum 1 weight 0.10000E+01 volume 0.30084E-02 ppm1 3.810 ppm2 8.236 CV 1
ASSI { 3883}
( segid " " and resid 317 and name HD1%)
( segid " " and resid 317 and name HD2%)
2.100 0.600 0.600 peak 3883 spectrum 1 weight 0.10000E+01 volume 0.17726E-01 ppm1 0.170 ppm2 0.351 CV 1
ASSI { 4764}
( segid " " and resid 287 and name HD% )
(( segid " " and resid 287 and name HB2 ))
3.900 1.900 1.900 peak 4764 spectrum 1 weight 0.10000E+01 volume 0.35244E-03 ppm1 6.346 ppm2 3.053 CV 1
ASSI { 4404}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 328 and name HB ))
5.000 3.100 1.000 peak 4404 spectrum 1 weight 0.10000E+01 volume 0.89659E-03 ppm1 0.749 ppm2 2.402 CV 1
ASSI { 2979}
(( segid " " and resid 339 and name HG13))
( segid " " and resid 329 and name HD1%)
4.200 2.200 1.800 peak 2979 spectrum 1 weight 0.10000E+01 volume 0.68794E-03 ppm1 1.531 ppm2 0.103 CV 1
ASSI { 2210}
(( segid " " and resid 413 and name HD2 ))
(( segid " " and resid 413 and name HA ))
3.900 1.900 1.900 peak 2210 spectrum 1 weight 0.10000E+01 volume 0.96710E-03 ppm1 6.800 ppm2 4.193 CV 1
ASSI { 2530}
(( segid " " and resid 410 and name HB3 ))
(( segid " " and resid 410 and name HD22))
3.700 1.800 1.800 peak 2530 spectrum 1 weight 0.10000E+01 volume 0.14238E-02 ppm1 2.682 ppm2 7.487 CV 1
ASSI { 648}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 205 and name HB2 ))
4.100 2.100 1.900 peak 648 spectrum 1 weight 0.10000E+01 volume 0.11504E-02 ppm1 0.887 ppm2 2.723 CV 1
ASSI { 2029}
(( segid " " and resid 217 and name HG12))
(( segid " " and resid 217 and name H ))
4.300 2.300 1.700 peak 2029 spectrum 1 weight 0.10000E+01 volume 0.81765E-03 ppm1 0.528 ppm2 7.482 CV 1
ASSI { 933}
( segid " " and resid 262 and name HG2%)
( segid " " and resid 243 and name HD2%)
3.400 1.400 1.400 peak 933 spectrum 1 weight 0.10000E+01 volume 0.33101E-02 ppm1 1.077 ppm2 0.154 CV 1
ASSI { 2480}
(( segid " " and resid 228 and name HB3 ))
(( segid " " and resid 229 and name H ))
4.600 2.600 1.400 peak 2480 spectrum 1 weight 0.10000E+01 volume 0.36652E-03 ppm1 1.986 ppm2 9.604 CV 1
ASSI { 4377}
(( segid " " and resid 184 and name HG3 ))
(( segid " " and resid 184 and name HD2 ))
1.800 0.400 0.400 peak 4377 spectrum 1 weight 0.10000E+01 volume 0.34344E-01 ppm1 1.937 ppm2 3.640 CV 1
OR { 4377}
(( segid " " and resid 184 and name HG2 ))
(( segid " " and resid 184 and name HD3 ))
OR { 4377}
(( segid " " and resid 184 and name HG2 ))
(( segid " " and resid 184 and name HD2 ))
OR { 4377}
(( segid " " and resid 184 and name HG3 ))
(( segid " " and resid 184 and name HD3 ))
ASSI { 2221}
( segid " " and resid 439 and name HD2%)
(( segid " " and resid 439 and name HA ))
2.600 0.900 0.900 peak 2221 spectrum 1 weight 0.10000E+01 volume 0.68400E-02 ppm1 0.886 ppm2 3.841 CV 1
ASSI { 620}
( segid " " and resid 209 and name HD2%)
( segid " " and resid 213 and name HD% )
3.600 1.700 1.700 peak 620 spectrum 1 weight 0.10000E+01 volume 0.81765E-03 ppm1 -0.905 ppm2 6.688 CV 1
ASSI { 1628}
( segid " " and resid 420 and name HG2%)
(( segid " " and resid 422 and name HA ))
4.500 2.600 1.500 peak 1628 spectrum 1 weight 0.10000E+01 volume 0.58080E-03 ppm1 0.808 ppm2 4.575 CV 1
ASSI { 1909}
( segid " " and resid 407 and name HD% )
(( segid " " and resid 410 and name HB2 ))
6.000 5.100 0.000 peak 1909 spectrum 1 weight 0.10000E+01 volume 0.40318E-03 ppm1 7.312 ppm2 2.813 CV 1
ASSI { 3030}
(( segid " " and resid 219 and name HA ))
(( segid " " and resid 222 and name HB3 ))
4.200 2.200 1.800 peak 3030 spectrum 1 weight 0.10000E+01 volume 0.12067E-02 ppm1 4.130 ppm2 0.797 CV 1
ASSI { 3814}
(( segid " " and resid 322 and name HG12))
( segid " " and resid 322 and name HD1%)
3.000 1.100 1.100 peak 3814 spectrum 1 weight 0.10000E+01 volume 0.69077E-03 ppm1 1.394 ppm2 -0.162 CV 1
ASSI { 1896}
(( segid " " and resid 443 and name HB2 ))
(( segid " " and resid 443 and name HA ))
2.900 1.000 1.000 peak 1896 spectrum 1 weight 0.10000E+01 volume 0.18439E-02 ppm1 1.651 ppm2 4.147 CV 1
OR { 1896}
(( segid " " and resid 443 and name HB3 ))
(( segid " " and resid 443 and name HA ))
ASSI { 4361}
(( segid " " and resid 415 and name HB2 ))
(( segid " " and resid 415 and name HA ))
3.600 1.600 1.600 peak 4361 spectrum 1 weight 0.10000E+01 volume 0.91351E-03 ppm1 2.756 ppm2 4.395 CV 1
ASSI { 443}
( segid " " and resid 371 and name HG2%)
(( segid " " and resid 319 and name HB3 ))
2.600 0.800 0.800 peak 443 spectrum 1 weight 0.10000E+01 volume 0.17368E-02 ppm1 0.962 ppm2 3.093 CV 1
ASSI { 4102}
( segid " " and resid 359 and name HG2%)
(( segid " " and resid 359 and name HB ))
2.500 0.800 0.800 peak 4102 spectrum 1 weight 0.10000E+01 volume 0.44972E-02 ppm1 -0.458 ppm2 1.584 CV 1
ASSI { 1384}
(( segid " " and resid 305 and name HA ))
(( segid " " and resid 308 and name HG3 ))
2.800 1.000 1.000 peak 1384 spectrum 1 weight 0.10000E+01 volume 0.25206E-02 ppm1 3.825 ppm2 1.384 CV 1
ASSI { 1790}
(( segid " " and resid 228 and name HG2 ))
(( segid " " and resid 229 and name H ))
4.200 2.200 1.800 peak 1790 spectrum 1 weight 0.10000E+01 volume 0.67384E-03 ppm1 2.056 ppm2 9.621 CV 1
ASSI { 3079}
(( segid " " and resid 364 and name HA ))
( segid " " and resid 368 and name HE% )
4.100 2.100 1.900 peak 3079 spectrum 1 weight 0.10000E+01 volume 0.46802E-03 ppm1 3.658 ppm2 6.754 CV 1
ASSI { 4651}
( segid " " and resid 195 and name HB% )
(( segid " " and resid 196 and name H ))
2.600 0.800 0.800 peak 4651 spectrum 1 weight 0.10000E+01 volume 0.45282E-02 ppm1 1.360 ppm2 7.172 CV 1
ASSI { 3742}
(( segid " " and resid 390 and name HA ))
( segid " " and resid 391 and name HD2%)
5.100 3.200 0.900 peak 3742 spectrum 1 weight 0.10000E+01 volume 0.89095E-03 ppm1 3.867 ppm2 0.530 CV 1
ASSI { 4638}
(( segid " " and resid 252 and name HB2 ))
(( segid " " and resid 253 and name H ))
3.900 1.900 1.900 peak 4638 spectrum 1 weight 0.10000E+01 volume 0.29774E-02 ppm1 3.738 ppm2 8.248 CV 1
ASSI { 3487}
(( segid " " and resid 284 and name HB2 ))
(( segid " " and resid 284 and name HA ))
2.600 0.900 0.900 peak 3487 spectrum 1 weight 0.10000E+01 volume 0.23261E-02 ppm1 2.236 ppm2 4.282 CV 1
OR { 3487}
(( segid " " and resid 284 and name HB3 ))
(( segid " " and resid 284 and name HA ))
ASSI { 1845}
( segid " " and resid 246 and name HB% )
(( segid " " and resid 251 and name H ))
3.300 1.400 1.400 peak 1845 spectrum 1 weight 0.10000E+01 volume 0.17481E-02 ppm1 1.176 ppm2 7.866 CV 1
ASSI { 4745}
(( segid " " and resid 205 and name HB3 ))
(( segid " " and resid 205 and name HB2 ))
2.800 1.000 1.000 peak 4745 spectrum 1 weight 0.10000E+01 volume 0.47648E-03 ppm1 1.725 ppm2 2.732 CV 1
ASSI { 2701}
( segid " " and resid 283 and name HD1%)
(( segid " " and resid 280 and name HG1 ))
3.800 1.800 1.800 peak 2701 spectrum 1 weight 0.10000E+01 volume 0.24727E-02 ppm1 0.717 ppm2 7.578 CV 1
ASSI { 4169}
(( segid " " and resid 305 and name HD3 ))
( segid " " and resid 306 and name HD2%)
3.800 1.800 1.800 peak 4169 spectrum 1 weight 0.10000E+01 volume 0.12913E-02 ppm1 3.037 ppm2 -0.359 CV 1
ASSI { 2854}
( segid " " and resid 315 and name HD% )
(( segid " " and resid 316 and name H ))
3.900 1.900 1.900 peak 2854 spectrum 1 weight 0.10000E+01 volume 0.74717E-03 ppm1 7.028 ppm2 8.712 CV 1
ASSI { 3868}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 317 and name H ))
4.200 2.200 1.800 peak 3868 spectrum 1 weight 0.10000E+01 volume 0.18806E-02 ppm1 0.170 ppm2 7.512 CV 1
ASSI { 4115}
(( segid " " and resid 294 and name HB ))
(( segid " " and resid 295 and name H ))
3.700 1.700 1.700 peak 4115 spectrum 1 weight 0.10000E+01 volume 0.15169E-02 ppm1 4.299 ppm2 7.389 CV 1
ASSI { 1747}
( segid " " and resid 330 and name HB% )
(( segid " " and resid 330 and name H ))
2.300 0.600 0.600 peak 1747 spectrum 1 weight 0.10000E+01 volume 0.10641E-01 ppm1 1.555 ppm2 8.628 CV 1
ASSI { 536}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 364 and name HG1%)
2.000 0.500 0.500 peak 536 spectrum 1 weight 0.10000E+01 volume 0.66848E-02 ppm1 0.398 ppm2 1.057 CV 1
ASSI { 2059}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 342 and name H ))
3.800 1.800 1.800 peak 2059 spectrum 1 weight 0.10000E+01 volume 0.13364E-02 ppm1 1.802 ppm2 8.643 CV 1
ASSI { 3429}
(( segid " " and resid 390 and name HB ))
(( segid " " and resid 389 and name HA ))
4.500 2.500 1.500 peak 3429 spectrum 1 weight 0.10000E+01 volume 0.78945E-03 ppm1 3.857 ppm2 4.260 CV 1
ASSI { 752}
(( segid " " and resid 251 and name HG3 ))
(( segid " " and resid 251 and name HB3 ))
3.300 1.400 1.400 peak 752 spectrum 1 weight 0.10000E+01 volume 0.25798E-02 ppm1 2.114 ppm2 1.581 CV 1
ASSI { 2154}
(( segid " " and resid 395 and name HA ))
(( segid " " and resid 396 and name H ))
3.900 1.900 1.900 peak 2154 spectrum 1 weight 0.10000E+01 volume 0.65696E-03 ppm1 3.757 ppm2 8.687 CV 1
ASSI { 1503}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 368 and name HB3 ))
4.900 3.000 1.100 peak 1503 spectrum 1 weight 0.10000E+01 volume 0.52725E-03 ppm1 0.366 ppm2 2.718 CV 1
ASSI { 3791}
( segid " " and resid 247 and name HE% )
(( segid " " and resid 247 and name HH ))
3.700 1.800 1.800 peak 3791 spectrum 1 weight 0.10000E+01 volume 0.53007E-03 ppm1 6.468 ppm2 9.430 CV 1
ASSI { 3773}
(( segid " " and resid 285 and name HA ))
(( segid " " and resid 285 and name HB3 ))
3.000 1.100 1.100 peak 3773 spectrum 1 weight 0.10000E+01 volume 0.12688E-02 ppm1 4.356 ppm2 1.763 CV 1
ASSI { 113}
(( segid " " and resid 440 and name HE3 ))
(( segid " " and resid 440 and name H ))
4.700 2.800 1.300 peak 113 spectrum 1 weight 0.10000E+01 volume 0.57516E-03 ppm1 2.735 ppm2 8.447 CV 1
ASSI { 912}
( segid " " and resid 243 and name HD2%)
( segid " " and resid 258 and name HE% )
3.200 1.300 1.300 peak 912 spectrum 1 weight 0.10000E+01 volume 0.17030E-02 ppm1 0.167 ppm2 6.639 CV 1
ASSI { 2072}
(( segid " " and resid 417 and name HB3 ))
(( segid " " and resid 417 and name HG2 ))
2.100 0.600 0.600 peak 2072 spectrum 1 weight 0.10000E+01 volume 0.15617E-01 ppm1 2.056 ppm2 2.355 CV 1
OR { 2072}
(( segid " " and resid 417 and name HB2 ))
(( segid " " and resid 417 and name HG2 ))
OR { 2072}
(( segid " " and resid 417 and name HB3 ))
(( segid " " and resid 417 and name HG3 ))
OR { 2072}
(( segid " " and resid 417 and name HB2 ))
(( segid " " and resid 417 and name HG3 ))
ASSI { 2148}
( segid " " and resid 358 and name HE% )
(( segid " " and resid 358 and name HB2 ))
4.700 2.800 1.300 peak 2148 spectrum 1 weight 0.10000E+01 volume 0.11024E-02 ppm1 6.701 ppm2 3.277 CV 1
ASSI { 2632}
( segid " " and resid 212 and name HG2%)
( segid " " and resid 267 and name HD2%)
3.100 1.200 1.200 peak 2632 spectrum 1 weight 0.10000E+01 volume 0.45141E-02 ppm1 -0.166 ppm2 0.886 CV 1
OR { 2632}
( segid " " and resid 212 and name HG2%)
( segid " " and resid 267 and name HD1%)
ASSI { 3576}
(( segid " " and resid 254 and name HB3 ))
(( segid " " and resid 254 and name HA ))
3.600 1.600 1.600 peak 3576 spectrum 1 weight 0.10000E+01 volume 0.12490E-02 ppm1 2.950 ppm2 4.857 CV 1
ASSI { 4231}
(( segid " " and resid 234 and name HB2 ))
(( segid " " and resid 234 and name H ))
4.300 2.300 1.700 peak 4231 spectrum 1 weight 0.10000E+01 volume 0.28759E-03 ppm1 3.787 ppm2 8.651 CV 1
ASSI { 44}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 395 and name HE22))
4.600 2.700 1.400 peak 44 spectrum 1 weight 0.10000E+01 volume 0.45959E-03 ppm1 0.560 ppm2 6.977 CV 1
ASSI { 4222}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 318 and name HB ))
1.900 0.400 0.400 peak 4222 spectrum 1 weight 0.10000E+01 volume 0.13054E-01 ppm1 0.349 ppm2 1.357 CV 1
ASSI { 4186}
( segid " " and resid 346 and name HD1%)
(( segid " " and resid 346 and name H ))
3.700 1.700 1.700 peak 4186 spectrum 1 weight 0.10000E+01 volume 0.29013E-02 ppm1 0.833 ppm2 8.985 CV 1
ASSI { 4479}
( segid " " and resid 223 and name HD% )
(( segid " " and resid 223 and name HA ))
3.800 1.800 1.800 peak 4479 spectrum 1 weight 0.10000E+01 volume 0.76692E-03 ppm1 6.434 ppm2 4.670 CV 1
ASSI { 4680}
( segid " " and resid 439 and name HD1%)
(( segid " " and resid 439 and name HG ))
2.600 0.900 0.900 peak 4680 spectrum 1 weight 0.10000E+01 volume 0.38936E-02 ppm1 0.817 ppm2 1.941 CV 1
OR { 4680}
( segid " " and resid 439 and name HD1%)
(( segid " " and resid 439 and name HB3 ))
ASSI { 2578}
(( segid " " and resid 338 and name HB2 ))
(( segid " " and resid 338 and name HA ))
4.000 2.000 2.000 peak 2578 spectrum 1 weight 0.10000E+01 volume 0.27913E-03 ppm1 2.804 ppm2 4.675 CV 1
ASSI { 4734}
(( segid " " and resid 351 and name HG2 ))
(( segid " " and resid 351 and name H ))
4.100 2.100 1.900 peak 4734 spectrum 1 weight 0.10000E+01 volume 0.20836E-02 ppm1 2.169 ppm2 7.877 CV 1
ASSI { 4698}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 337 and name HB3 ))
2.100 0.600 0.600 peak 4698 spectrum 1 weight 0.10000E+01 volume 0.48551E-02 ppm1 1.802 ppm2 1.500 CV 1
ASSI { 2870}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 324 and name HB3 ))
3.100 1.200 1.200 peak 2870 spectrum 1 weight 0.10000E+01 volume 0.26447E-02 ppm1 -0.047 ppm2 3.284 CV 1
ASSI { 151}
( segid " " and resid 345 and name HG2%)
(( segid " " and resid 346 and name HB3 ))
3.000 1.100 1.100 peak 151 spectrum 1 weight 0.10000E+01 volume 0.39726E-02 ppm1 0.921 ppm2 1.492 CV 1
ASSI { 3018}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 338 and name H ))
4.200 2.200 1.800 peak 3018 spectrum 1 weight 0.10000E+01 volume 0.12265E-02 ppm1 1.804 ppm2 7.700 CV 1
ASSI { 950}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 232 and name HD2 ))
4.100 2.100 1.900 peak 950 spectrum 1 weight 0.10000E+01 volume 0.76128E-03 ppm1 1.801 ppm2 3.155 CV 1
ASSI { 887}
(( segid " " and resid 305 and name HD3 ))
(( segid " " and resid 283 and name HA ))
5.000 3.100 1.000 peak 887 spectrum 1 weight 0.10000E+01 volume 0.10658E-02 ppm1 3.038 ppm2 4.478 CV 1
ASSI { 2284}
(( segid " " and resid 430 and name HD1 ))
(( segid " " and resid 430 and name H ))
3.500 1.500 1.500 peak 2284 spectrum 1 weight 0.10000E+01 volume 0.50469E-03 ppm1 7.189 ppm2 7.767 CV 1
ASSI { 2645}
(( segid " " and resid 327 and name HD2 ))
(( segid " " and resid 327 and name H ))
4.800 2.900 1.200 peak 2645 spectrum 1 weight 0.10000E+01 volume 0.31578E-03 ppm1 7.209 ppm2 7.602 CV 1
ASSI { 3775}
(( segid " " and resid 293 and name HD2 ))
(( segid " " and resid 293 and name HG3 ))
2.600 0.800 0.800 peak 3775 spectrum 1 weight 0.10000E+01 volume 0.29830E-02 ppm1 3.076 ppm2 2.019 CV 1
ASSI { 2515}
(( segid " " and resid 367 and name HB3 ))
( segid " " and resid 367 and name HD2%)
3.400 1.400 1.400 peak 2515 spectrum 1 weight 0.10000E+01 volume 0.67666E-03 ppm1 0.003 ppm2 0.781 CV 1
ASSI { 4478}
(( segid " " and resid 207 and name HB ))
( segid " " and resid 207 and name HD1%)
3.400 1.500 1.500 peak 4478 spectrum 1 weight 0.10000E+01 volume 0.89941E-03 ppm1 1.614 ppm2 0.886 CV 1
ASSI { 1939}
(( segid " " and resid 226 and name HE2 ))
(( segid " " and resid 226 and name H ))
2.600 2.600 3.400 peak 1939 spectrum 1 weight 0.10000E+01 volume 0.11898E-02 ppm1 2.918 ppm2 7.428 CV 1
OR { 1939}
(( segid " " and resid 226 and name HE3 ))
(( segid " " and resid 226 and name H ))
ASSI { 2051}
( segid " " and resid 335 and name HG2%)
(( segid " " and resid 335 and name H ))
2.900 1.000 1.000 peak 2051 spectrum 1 weight 0.10000E+01 volume 0.24332E-02 ppm1 1.247 ppm2 8.870 CV 1
ASSI { 3229}
( segid " " and resid 211 and name HB% )
( segid " " and resid 247 and name HE% )
4.200 2.200 1.800 peak 3229 spectrum 1 weight 0.10000E+01 volume 0.47084E-03 ppm1 1.693 ppm2 6.476 CV 1
ASSI { 1914}
(( segid " " and resid 374 and name HB2 ))
( segid " " and resid 207 and name HG2%)
4.700 2.700 1.300 peak 1914 spectrum 1 weight 0.10000E+01 volume 0.40600E-03 ppm1 1.620 ppm2 0.459 CV 1
ASSI { 4218}
(( segid " " and resid 186 and name HA ))
( segid " " and resid 186 and name HD1%)
1.900 0.500 0.500 peak 4218 spectrum 1 weight 0.10000E+01 volume 0.19274E-01 ppm1 4.251 ppm2 0.789 CV 1
OR { 4218}
(( segid " " and resid 186 and name HA ))
( segid " " and resid 186 and name HD2%)
ASSI { 918}
(( segid " " and resid 350 and name HB ))
(( segid " " and resid 352 and name HB ))
3.800 1.800 1.800 peak 918 spectrum 1 weight 0.10000E+01 volume 0.74717E-03 ppm1 2.481 ppm2 1.115 CV 1
ASSI { 4416}
(( segid " " and resid 256 and name HB2 ))
(( segid " " and resid 254 and name HD22))
2.900 2.900 3.100 peak 4416 spectrum 1 weight 0.10000E+01 volume 0.45677E-03 ppm1 2.028 ppm2 6.851 CV 1
ASSI { 3197}
( segid " " and resid 204 and name HD% )
( segid " " and resid 203 and name HE% )
4.900 3.000 1.100 peak 3197 spectrum 1 weight 0.10000E+01 volume 0.32424E-03 ppm1 6.873 ppm2 2.230 CV 1
ASSI { 1347}
( segid " " and resid 356 and name HG2%)
(( segid " " and resid 360 and name HZ ))
5.600 3.900 0.400 peak 1347 spectrum 1 weight 0.10000E+01 volume 0.56670E-03 ppm1 0.384 ppm2 6.607 CV 1
ASSI { 201}
( segid " " and resid 192 and name HD1%)
(( segid " " and resid 196 and name HB3 ))
2.900 1.100 1.100 peak 201 spectrum 1 weight 0.10000E+01 volume 0.18242E-02 ppm1 0.868 ppm2 2.754 CV 1
ASSI { 895}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 391 and name HB2 ))
4.200 2.300 1.800 peak 895 spectrum 1 weight 0.10000E+01 volume 0.62029E-03 ppm1 0.562 ppm2 1.100 CV 1
ASSI { 4686}
(( segid " " and resid 222 and name HE3 ))
(( segid " " and resid 222 and name HG3 ))
2.800 1.000 1.000 peak 4686 spectrum 1 weight 0.10000E+01 volume 0.12237E-01 ppm1 2.683 ppm2 0.974 CV 1
OR { 4686}
(( segid " " and resid 222 and name HE2 ))
(( segid " " and resid 222 and name HG3 ))
ASSI { 4226}
(( segid " " and resid 375 and name HG2 ))
(( segid " " and resid 375 and name HE22))
4.300 2.300 1.700 peak 4226 spectrum 1 weight 0.10000E+01 volume 0.20075E-02 ppm1 2.296 ppm2 7.497 CV 1
ASSI { 3939}
( segid " " and resid 220 and name HG1%)
( segid " " and resid 219 and name HE% )
4.200 2.200 1.800 peak 3939 spectrum 1 weight 0.10000E+01 volume 0.14210E-02 ppm1 1.115 ppm2 6.389 CV 1
OR { 3939}
( segid " " and resid 220 and name HG2%)
( segid " " and resid 219 and name HE% )
ASSI { 236}
(( segid " " and resid 252 and name HB3 ))
( segid " " and resid 253 and name HG2%)
4.400 2.400 1.600 peak 236 spectrum 1 weight 0.10000E+01 volume 0.85150E-03 ppm1 3.681 ppm2 0.617 CV 1
ASSI { 2493}
(( segid " " and resid 378 and name HG2 ))
(( segid " " and resid 378 and name HA ))
3.700 1.700 1.700 peak 2493 spectrum 1 weight 0.10000E+01 volume 0.78663E-03 ppm1 1.497 ppm2 4.435 CV 1
ASSI { 4590}
(( segid " " and resid 391 and name HB3 ))
( segid " " and resid 391 and name HD2%)
3.300 1.300 1.300 peak 4590 spectrum 1 weight 0.10000E+01 volume 0.83457E-03 ppm1 1.516 ppm2 0.535 CV 1
ASSI { 1834}
( segid " " and resid 192 and name HG2%)
(( segid " " and resid 193 and name HD3 ))
4.100 2.100 1.900 peak 1834 spectrum 1 weight 0.10000E+01 volume 0.14605E-02 ppm1 0.684 ppm2 3.650 CV 1
ASSI { 4551}
(( segid " " and resid 285 and name HB2 ))
(( segid " " and resid 285 and name HD3 ))
4.200 2.200 1.800 peak 4551 spectrum 1 weight 0.10000E+01 volume 0.12378E-02 ppm1 2.306 ppm2 3.695 CV 1
ASSI { 2686}
(( segid " " and resid 395 and name HA ))
( segid " " and resid 398 and name HD1%)
3.200 1.300 1.300 peak 2686 spectrum 1 weight 0.10000E+01 volume 0.17396E-02 ppm1 3.756 ppm2 0.569 CV 1
OR { 2686}
(( segid " " and resid 395 and name HA ))
(( segid " " and resid 398 and name HG12))
ASSI { 4037}
(( segid " " and resid 184 and name HB3 ))
(( segid " " and resid 184 and name HD3 ))
2.800 1.000 1.000 peak 4037 spectrum 1 weight 0.10000E+01 volume 0.76579E-02 ppm1 1.811 ppm2 3.633 CV 1
OR { 4037}
(( segid " " and resid 184 and name HB3 ))
(( segid " " and resid 184 and name HD2 ))
ASSI { 3505}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 342 and name H ))
3.700 1.700 1.700 peak 3505 spectrum 1 weight 0.10000E+01 volume 0.28167E-02 ppm1 0.514 ppm2 8.641 CV 1
ASSI { 2032}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 433 and name HE21))
2.800 1.000 1.000 peak 2032 spectrum 1 weight 0.10000E+01 volume 0.25742E-02 ppm1 0.779 ppm2 6.985 CV 1
ASSI { 4814}
(( segid " " and resid 332 and name HG2 ))
(( segid " " and resid 332 and name HB3 ))
3.200 1.300 1.300 peak 4814 spectrum 1 weight 0.10000E+01 volume 0.11701E-02 ppm1 2.055 ppm2 2.603 CV 1
ASSI { 4152}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 232 and name H ))
2.600 2.600 3.400 peak 4152 spectrum 1 weight 0.10000E+01 volume 0.12378E-02 ppm1 1.009 ppm2 8.787 CV 1
ASSI { 2404}
(( segid " " and resid 360 and name HZ ))
( segid " " and resid 360 and name HE% )
2.700 0.900 0.900 peak 2404 spectrum 1 weight 0.10000E+01 volume 0.19257E-02 ppm1 6.606 ppm2 7.079 CV 1
ASSI { 2714}
(( segid " " and resid 183 and name HB3 ))
(( segid " " and resid 183 and name HA ))
2.500 0.800 0.800 peak 2714 spectrum 1 weight 0.10000E+01 volume 0.39190E-02 ppm1 1.853 ppm2 4.709 CV 1
ASSI { 2876}
(( segid " " and resid 433 and name HB3 ))
(( segid " " and resid 433 and name HA ))
2.900 1.000 1.000 peak 2876 spectrum 1 weight 0.10000E+01 volume 0.13449E-02 ppm1 2.176 ppm2 4.007 CV 1
ASSI { 2719}
(( segid " " and resid 232 and name HB3 ))
(( segid " " and resid 233 and name H ))
3.500 1.500 1.500 peak 2719 spectrum 1 weight 0.10000E+01 volume 0.74999E-03 ppm1 1.931 ppm2 7.982 CV 1
ASSI { 405}
(( segid " " and resid 226 and name HB2 ))
(( segid " " and resid 334 and name HG3 ))
4.400 2.500 1.600 peak 405 spectrum 1 weight 0.10000E+01 volume 0.12096E-02 ppm1 1.499 ppm2 2.184 CV 1
OR { 405}
(( segid " " and resid 226 and name HB2 ))
(( segid " " and resid 334 and name HG2 ))
ASSI { 2910}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 352 and name HG12))
2.200 0.600 0.600 peak 2910 spectrum 1 weight 0.10000E+01 volume 0.39557E-02 ppm1 0.603 ppm2 1.730 CV 1
ASSI { 4429}
( segid " " and resid 438 and name HB% )
(( segid " " and resid 438 and name H ))
2.400 0.700 0.700 peak 4429 spectrum 1 weight 0.10000E+01 volume 0.62029E-02 ppm1 1.600 ppm2 7.573 CV 1
ASSI { 235}
(( segid " " and resid 207 and name HA ))
(( segid " " and resid 207 and name HG13))
3.700 1.700 1.700 peak 235 spectrum 1 weight 0.10000E+01 volume 0.18665E-02 ppm1 3.757 ppm2 1.029 CV 1
ASSI { 1958}
(( segid " " and resid 336 and name HD2 ))
(( segid " " and resid 336 and name HB2 ))
2.700 0.900 0.900 peak 1958 spectrum 1 weight 0.10000E+01 volume 0.40488E-02 ppm1 1.465 ppm2 2.004 CV 1
OR { 1958}
(( segid " " and resid 336 and name HD2 ))
(( segid " " and resid 336 and name HB3 ))
ASSI { 2948}
(( segid " " and resid 289 and name HG3 ))
( segid " " and resid 306 and name HD2%)
4.700 2.700 1.300 peak 2948 spectrum 1 weight 0.10000E+01 volume 0.45677E-03 ppm1 2.175 ppm2 -0.354 CV 1
ASSI { 2269}
(( segid " " and resid 236 and name HB ))
( segid " " and resid 236 and name HG2%)
2.700 0.900 0.900 peak 2269 spectrum 1 weight 0.10000E+01 volume 0.16156E-02 ppm1 1.754 ppm2 0.966 CV 1
ASSI { 2819}
( segid " " and resid 195 and name HB% )
(( segid " " and resid 199 and name H ))
4.000 2.000 2.000 peak 2819 spectrum 1 weight 0.10000E+01 volume 0.13308E-02 ppm1 1.359 ppm2 7.767 CV 1
ASSI { 154}
( segid " " and resid 333 and name HD2%)
(( segid " " and resid 334 and name HG2 ))
2.000 2.000 4.000 peak 154 spectrum 1 weight 0.10000E+01 volume 0.62114E-02 ppm1 0.842 ppm2 2.164 CV 1
OR { 154}
( segid " " and resid 333 and name HD2%)
(( segid " " and resid 334 and name HG3 ))
ASSI { 2778}
(( segid " " and resid 218 and name HA ))
(( segid " " and resid 218 and name HB2 ))
2.800 1.000 1.000 peak 2778 spectrum 1 weight 0.10000E+01 volume 0.14971E-02 ppm1 4.065 ppm2 2.721 CV 1
ASSI { 4646}
(( segid " " and resid 306 and name HA ))
(( segid " " and resid 306 and name H ))
3.000 1.100 1.100 peak 4646 spectrum 1 weight 0.10000E+01 volume 0.78663E-03 ppm1 3.641 ppm2 8.008 CV 1
ASSI { 4550}
(( segid " " and resid 291 and name HA ))
(( segid " " and resid 291 and name HB2 ))
3.100 1.200 1.200 peak 4550 spectrum 1 weight 0.10000E+01 volume 0.11165E-02 ppm1 3.954 ppm2 2.758 CV 1
ASSI { 1447}
(( segid " " and resid 388 and name HB2 ))
(( segid " " and resid 388 and name HG2 ))
3.200 1.200 1.200 peak 1447 spectrum 1 weight 0.10000E+01 volume 0.21343E-02 ppm1 1.543 ppm2 1.843 CV 1
OR { 1447}
(( segid " " and resid 388 and name HB2 ))
( segid " " and resid 388 and name HE% )
ASSI { 4605}
(( segid " " and resid 410 and name HA ))
(( segid " " and resid 411 and name H ))
3.800 1.800 1.800 peak 4605 spectrum 1 weight 0.10000E+01 volume 0.67384E-03 ppm1 4.360 ppm2 7.735 CV 1
ASSI { 2141}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 374 and name HB3 ))
3.200 3.200 2.800 peak 2141 spectrum 1 weight 0.10000E+01 volume 0.50892E-02 ppm1 0.884 ppm2 1.773 CV 1
ASSI { 1837}
(( segid " " and resid 425 and name HD3 ))
(( segid " " and resid 425 and name HA ))
2.400 0.700 0.700 peak 1837 spectrum 1 weight 0.10000E+01 volume 0.50525E-02 ppm1 1.613 ppm2 4.037 CV 1
OR { 1837}
(( segid " " and resid 425 and name HD2 ))
(( segid " " and resid 425 and name HA ))
ASSI { 2784}
(( segid " " and resid 222 and name HE2 ))
(( segid " " and resid 222 and name HA ))
4.000 2.000 2.000 peak 2784 spectrum 1 weight 0.10000E+01 volume 0.26277E-02 ppm1 2.684 ppm2 3.783 CV 1
OR { 2784}
(( segid " " and resid 222 and name HE3 ))
(( segid " " and resid 222 and name HA ))
ASSI { 3913}
(( segid " " and resid 287 and name HA ))
(( segid " " and resid 287 and name HB3 ))
3.600 1.600 1.600 peak 3913 spectrum 1 weight 0.10000E+01 volume 0.51879E-03 ppm1 3.481 ppm2 2.442 CV 1
ASSI { 3455}
(( segid " " and resid 183 and name HB3 ))
(( segid " " and resid 183 and name HG3 ))
2.100 0.600 0.600 peak 3455 spectrum 1 weight 0.10000E+01 volume 0.20441E-01 ppm1 1.854 ppm2 2.485 CV 1
OR { 3455}
(( segid " " and resid 183 and name HB3 ))
(( segid " " and resid 183 and name HG2 ))
ASSI { 4788}
( segid " " and resid 195 and name HB% )
(( segid " " and resid 195 and name H ))
2.200 0.600 0.600 peak 4788 spectrum 1 weight 0.10000E+01 volume 0.11571E-01 ppm1 1.359 ppm2 8.980 CV 1
ASSI { 3632}
(( segid " " and resid 351 and name HA ))
(( segid " " and resid 351 and name H ))
2.800 1.000 1.000 peak 3632 spectrum 1 weight 0.10000E+01 volume 0.13336E-02 ppm1 3.829 ppm2 7.876 CV 1
ASSI { 3006}
(( segid " " and resid 261 and name HB3 ))
(( segid " " and resid 261 and name HA ))
4.000 2.000 2.000 peak 3006 spectrum 1 weight 0.10000E+01 volume 0.25093E-03 ppm1 3.054 ppm2 4.480 CV 1
ASSI { 4324}
(( segid " " and resid 251 and name HB2 ))
( segid " " and resid 246 and name HB% )
3.000 1.100 1.100 peak 4324 spectrum 1 weight 0.10000E+01 volume 0.17565E-02 ppm1 1.748 ppm2 1.162 CV 1
ASSI { 3760}
(( segid " " and resid 358 and name HB2 ))
(( segid " " and resid 358 and name H ))
2.800 1.000 1.000 peak 3760 spectrum 1 weight 0.10000E+01 volume 0.12124E-02 ppm1 3.279 ppm2 8.552 CV 1
ASSI { 3242}
(( segid " " and resid 308 and name HB2 ))
(( segid " " and resid 308 and name H ))
2.600 0.900 0.900 peak 3242 spectrum 1 weight 0.10000E+01 volume 0.30676E-02 ppm1 1.809 ppm2 7.087 CV 1
ASSI { 2477}
(( segid " " and resid 267 and name HB3 ))
(( segid " " and resid 267 and name HB2 ))
2.300 0.700 0.700 peak 2477 spectrum 1 weight 0.10000E+01 volume 0.58926E-03 ppm1 2.284 ppm2 1.593 CV 1
ASSI { 3964}
( segid " " and resid 350 and name HG1%)
(( segid " " and resid 350 and name HB ))
2.500 0.800 0.800 peak 3964 spectrum 1 weight 0.10000E+01 volume 0.37413E-02 ppm1 0.713 ppm2 2.479 CV 1
ASSI { 4378}
(( segid " " and resid 188 and name HD2 ))
(( segid " " and resid 187 and name HA ))
2.900 1.000 1.000 peak 4378 spectrum 1 weight 0.10000E+01 volume 0.10207E-02 ppm1 3.493 ppm2 4.618 CV 1
OR { 4378}
(( segid " " and resid 188 and name HD3 ))
(( segid " " and resid 187 and name HA ))
ASSI { 2880}
(( segid " " and resid 293 and name HD2 ))
(( segid " " and resid 294 and name H ))
3.800 1.800 1.800 peak 2880 spectrum 1 weight 0.10000E+01 volume 0.53289E-03 ppm1 3.068 ppm2 8.510 CV 1
ASSI { 585}
( segid " " and resid 267 and name HD1%)
(( segid " " and resid 216 and name HB3 ))
2.700 0.900 0.900 peak 585 spectrum 1 weight 0.10000E+01 volume 0.58588E-02 ppm1 0.917 ppm2 2.763 CV 1
OR { 585}
( segid " " and resid 267 and name HD1%)
(( segid " " and resid 216 and name HG ))
ASSI { 1799}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 351 and name H ))
3.300 1.400 1.400 peak 1799 spectrum 1 weight 0.10000E+01 volume 0.16071E-02 ppm1 0.730 ppm2 7.875 CV 1
ASSI { 2904}
( segid " " and resid 219 and name HD% )
(( segid " " and resid 219 and name HB2 ))
3.500 1.500 1.500 peak 2904 spectrum 1 weight 0.10000E+01 volume 0.48212E-03 ppm1 6.862 ppm2 3.164 CV 1
OR { 2904}
( segid " " and resid 219 and name HD% )
(( segid " " and resid 219 and name HB3 ))
ASSI { 4224}
( segid " " and resid 240 and name HG2%)
(( segid " " and resid 240 and name HA ))
2.600 0.900 0.900 peak 4224 spectrum 1 weight 0.10000E+01 volume 0.49425E-02 ppm1 0.773 ppm2 3.236 CV 1
ASSI { 3751}
(( segid " " and resid 311 and name HB2 ))
(( segid " " and resid 311 and name HA ))
3.800 1.800 1.800 peak 3751 spectrum 1 weight 0.10000E+01 volume 0.83739E-03 ppm1 2.070 ppm2 4.455 CV 1
ASSI { 3849}
( segid " " and resid 195 and name HB% )
( segid " " and resid 198 and name HG2%)
3.600 1.600 1.600 peak 3849 spectrum 1 weight 0.10000E+01 volume 0.48381E-02 ppm1 1.360 ppm2 0.594 CV 1
OR { 3849}
( segid " " and resid 195 and name HB% )
( segid " " and resid 198 and name HG1%)
ASSI { 1893}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 402 and name HA ))
4.100 2.100 1.900 peak 1893 spectrum 1 weight 0.10000E+01 volume 0.12039E-02 ppm1 0.704 ppm2 3.384 CV 1
ASSI { 1768}
( segid " " and resid 201 and name HG2%)
(( segid " " and resid 201 and name HA ))
3.000 1.200 1.200 peak 1768 spectrum 1 weight 0.10000E+01 volume 0.20639E-02 ppm1 1.294 ppm2 4.931 CV 1
ASSI { 4129}
( segid " " and resid 339 and name HG2%)
( segid " " and resid 358 and name HE% )
3.100 1.200 1.200 peak 4129 spectrum 1 weight 0.10000E+01 volume 0.42603E-02 ppm1 0.706 ppm2 6.702 CV 1
ASSI { 3185}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 321 and name HB2 ))
2.700 0.900 0.900 peak 3185 spectrum 1 weight 0.10000E+01 volume 0.81765E-03 ppm1 -0.160 ppm2 1.940 CV 1
ASSI { 1465}
(( segid " " and resid 430 and name HZ3 ))
(( segid " " and resid 427 and name HG2 ))
3.800 1.800 1.800 peak 1465 spectrum 1 weight 0.10000E+01 volume 0.33834E-03 ppm1 6.936 ppm2 2.214 CV 1
ASSI { 3395}
( segid " " and resid 329 and name HD1%)
(( segid " " and resid 328 and name HB ))
3.400 1.500 1.500 peak 3395 spectrum 1 weight 0.10000E+01 volume 0.81765E-03 ppm1 0.120 ppm2 2.398 CV 1
ASSI { 2697}
( segid " " and resid 307 and name HD2%)
(( segid " " and resid 307 and name H ))
3.600 1.600 1.600 peak 2697 spectrum 1 weight 0.10000E+01 volume 0.26588E-02 ppm1 1.029 ppm2 8.721 CV 1
ASSI { 583}
( segid " " and resid 386 and name HB% )
( segid " " and resid 387 and name HG2%)
3.900 1.900 1.900 peak 583 spectrum 1 weight 0.10000E+01 volume 0.25488E-02 ppm1 1.450 ppm2 1.092 CV 1
ASSI { 3002}
( segid " " and resid 223 and name HE% )
(( segid " " and resid 222 and name HB3 ))
3.300 1.300 1.300 peak 3002 spectrum 1 weight 0.10000E+01 volume 0.13167E-02 ppm1 6.646 ppm2 0.805 CV 1
ASSI { 2115}
(( segid " " and resid 186 and name HA ))
(( segid " " and resid 186 and name HB2 ))
1.900 0.500 0.500 peak 2115 spectrum 1 weight 0.10000E+01 volume 0.21296E-01 ppm1 4.251 ppm2 1.526 CV 1
OR { 2115}
(( segid " " and resid 186 and name HA ))
(( segid " " and resid 186 and name HB3 ))
ASSI { 4092}
(( segid " " and resid 382 and name HZ2 ))
( segid " " and resid 388 and name HE% )
4.900 2.900 1.100 peak 4092 spectrum 1 weight 0.10000E+01 volume 0.33552E-03 ppm1 7.468 ppm2 1.857 CV 1
OR { 4092}
(( segid " " and resid 382 and name HZ2 ))
(( segid " " and resid 388 and name HG2 ))
ASSI { 2875}
(( segid " " and resid 205 and name HA ))
( segid " " and resid 204 and name HD% )
4.000 2.000 2.000 peak 2875 spectrum 1 weight 0.10000E+01 volume 0.46802E-03 ppm1 3.809 ppm2 6.865 CV 1
ASSI { 197}
( segid " " and resid 315 and name HE% )
(( segid " " and resid 316 and name HA ))
4.800 2.900 1.200 peak 197 spectrum 1 weight 0.10000E+01 volume 0.28759E-03 ppm1 6.876 ppm2 3.588 CV 1
ASSI { 3991}
(( segid " " and resid 304 and name HG2 ))
( segid " " and resid 367 and name HD2%)
2.700 0.900 0.900 peak 3991 spectrum 1 weight 0.10000E+01 volume 0.36990E-02 ppm1 2.449 ppm2 0.798 CV 1
ASSI { 864}
(( segid " " and resid 392 and name HD3 ))
( segid " " and resid 390 and name HG2%)
2.700 2.700 3.300 peak 864 spectrum 1 weight 0.10000E+01 volume 0.92761E-03 ppm1 3.566 ppm2 1.039 CV 1
ASSI { 4203}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 209 and name HG ))
2.200 0.600 0.600 peak 4203 spectrum 1 weight 0.10000E+01 volume 0.66538E-02 ppm1 0.189 ppm2 0.748 CV 1
ASSI { 1882}
(( segid " " and resid 217 and name HB ))
( segid " " and resid 217 and name HG2%)
2.600 0.900 0.900 peak 1882 spectrum 1 weight 0.10000E+01 volume 0.20272E-02 ppm1 1.639 ppm2 0.476 CV 1
OR { 1882}
(( segid " " and resid 217 and name HB ))
(( segid " " and resid 217 and name HG12))
OR { 1882}
(( segid " " and resid 217 and name HB ))
(( segid " " and resid 217 and name HG13))
ASSI { 4340}
(( segid " " and resid 382 and name HD1 ))
(( segid " " and resid 382 and name HA ))
4.200 2.300 1.800 peak 4340 spectrum 1 weight 0.10000E+01 volume 0.31860E-03 ppm1 6.932 ppm2 4.918 CV 1
ASSI { 4369}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 329 and name HB ))
2.300 0.600 0.600 peak 4369 spectrum 1 weight 0.10000E+01 volume 0.46661E-02 ppm1 0.751 ppm2 1.728 CV 1
ASSI { 355}
( segid " " and resid 278 and name HD2%)
(( segid " " and resid 318 and name H ))
3.600 1.600 1.600 peak 355 spectrum 1 weight 0.10000E+01 volume 0.13928E-02 ppm1 0.746 ppm2 8.030 CV 1
ASSI { 384}
( segid " " and resid 253 and name HG2%)
( segid " " and resid 212 and name HG2%)
2.800 2.800 3.200 peak 384 spectrum 1 weight 0.10000E+01 volume 0.71333E-03 ppm1 0.615 ppm2 -0.170 CV 1
ASSI { 4533}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 287 and name HB2 ))
5.100 3.200 0.900 peak 4533 spectrum 1 weight 0.10000E+01 volume 0.45113E-03 ppm1 0.169 ppm2 3.050 CV 1
ASSI { 4365}
(( segid " " and resid 363 and name HA ))
(( segid " " and resid 363 and name HB3 ))
3.700 1.700 1.700 peak 4365 spectrum 1 weight 0.10000E+01 volume 0.38344E-03 ppm1 5.088 ppm2 2.638 CV 1
ASSI { 4289}
(( segid " " and resid 323 and name HB ))
( segid " " and resid 323 and name HG1%)
2.600 0.800 0.800 peak 4289 spectrum 1 weight 0.10000E+01 volume 0.19285E-02 ppm1 1.749 ppm2 0.786 CV 1
ASSI { 2430}
( segid " " and resid 297 and name HG2%)
(( segid " " and resid 301 and name HG2 ))
2.300 0.600 0.600 peak 2430 spectrum 1 weight 0.10000E+01 volume 0.78719E-02 ppm1 1.115 ppm2 2.473 CV 1
ASSI { 3586}
(( segid " " and resid 275 and name HA ))
(( segid " " and resid 276 and name H ))
3.800 1.800 1.800 peak 3586 spectrum 1 weight 0.10000E+01 volume 0.73589E-03 ppm1 4.318 ppm2 6.944 CV 1
ASSI { 2580}
(( segid " " and resid 334 and name HG2 ))
(( segid " " and resid 334 and name H ))
2.300 0.700 0.700 peak 2580 spectrum 1 weight 0.10000E+01 volume 0.27490E-02 ppm1 2.197 ppm2 8.118 CV 1
ASSI { 4199}
(( segid " " and resid 339 and name HB ))
(( segid " " and resid 339 and name HA ))
3.300 1.300 1.300 peak 4199 spectrum 1 weight 0.10000E+01 volume 0.92479E-03 ppm1 1.540 ppm2 2.994 CV 1
ASSI { 3059}
(( segid " " and resid 398 and name HG12))
(( segid " " and resid 398 and name HA ))
3.700 1.700 1.700 peak 3059 spectrum 1 weight 0.10000E+01 volume 0.27349E-03 ppm1 0.566 ppm2 3.404 CV 1
ASSI { 2196}
( segid " " and resid 357 and name HD1%)
(( segid " " and resid 357 and name HA ))
2.100 0.500 0.500 peak 2196 spectrum 1 weight 0.10000E+01 volume 0.44972E-02 ppm1 0.677 ppm2 3.865 CV 1
ASSI { 1841}
(( segid " " and resid 187 and name HB2 ))
(( segid " " and resid 188 and name HD2 ))
4.600 2.600 1.400 peak 1841 spectrum 1 weight 0.10000E+01 volume 0.13336E-02 ppm1 1.728 ppm2 3.487 CV 1
OR { 1841}
(( segid " " and resid 187 and name HB2 ))
(( segid " " and resid 188 and name HD3 ))
ASSI { 4202}
( segid " " and resid 435 and name HD1%)
(( segid " " and resid 435 and name H ))
4.100 2.100 1.900 peak 4202 spectrum 1 weight 0.10000E+01 volume 0.14267E-02 ppm1 0.869 ppm2 8.195 CV 1
ASSI { 3700}
( segid " " and resid 247 and name HE% )
( segid " " and resid 246 and name HB% )
4.500 2.500 1.500 peak 3700 spectrum 1 weight 0.10000E+01 volume 0.62875E-03 ppm1 6.476 ppm2 1.181 CV 1
ASSI { 4527}
(( segid " " and resid 441 and name HD2 ))
( segid " " and resid 437 and name HG2%)
2.700 0.900 0.900 peak 4527 spectrum 1 weight 0.10000E+01 volume 0.45677E-02 ppm1 3.125 ppm2 1.186 CV 1
OR { 4527}
(( segid " " and resid 441 and name HD3 ))
( segid " " and resid 437 and name HG2%)
ASSI { 2014}
(( segid " " and resid 361 and name HZ ))
(( segid " " and resid 325 and name HG2 ))
4.100 2.100 1.900 peak 2014 spectrum 1 weight 0.10000E+01 volume 0.29605E-03 ppm1 6.620 ppm2 2.426 CV 1
ASSI { 3697}
(( segid " " and resid 280 and name HA ))
(( segid " " and resid 280 and name HB ))
2.900 1.100 1.100 peak 3697 spectrum 1 weight 0.10000E+01 volume 0.63721E-03 ppm1 4.037 ppm2 4.553 CV 1
ASSI { 2921}
( segid " " and resid 416 and name HD1%)
(( segid " " and resid 416 and name H ))
3.400 1.400 1.400 peak 2921 spectrum 1 weight 0.10000E+01 volume 0.57291E-02 ppm1 0.854 ppm2 7.963 CV 1
ASSI { 2817}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 190 and name HZ ))
3.800 1.800 1.800 peak 2817 spectrum 1 weight 0.10000E+01 volume 0.10178E-02 ppm1 -0.168 ppm2 6.948 CV 1
ASSI { 4405}
(( segid " " and resid 304 and name HB2 ))
(( segid " " and resid 304 and name HE21))
5.000 3.100 1.000 peak 4405 spectrum 1 weight 0.10000E+01 volume 0.29605E-03 ppm1 2.225 ppm2 6.671 CV 1
ASSI { 4453}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 318 and name HG13))
2.100 0.500 0.500 peak 4453 spectrum 1 weight 0.10000E+01 volume 0.12079E-01 ppm1 0.348 ppm2 0.625 CV 1
ASSI { 4310}
(( segid " " and resid 399 and name HB3 ))
(( segid " " and resid 399 and name HA ))
2.700 0.900 0.900 peak 4310 spectrum 1 weight 0.10000E+01 volume 0.30338E-02 ppm1 1.798 ppm2 3.782 CV 1
ASSI { 3102}
(( segid " " and resid 287 and name HA ))
( segid " " and resid 306 and name HD1%)
4.100 2.100 1.900 peak 3102 spectrum 1 weight 0.10000E+01 volume 0.11419E-02 ppm1 3.482 ppm2 0.377 CV 1
ASSI { 2771}
(( segid " " and resid 222 and name HD3 ))
(( segid " " and resid 219 and name HA ))
3.000 1.100 1.100 peak 2771 spectrum 1 weight 0.10000E+01 volume 0.70769E-03 ppm1 1.262 ppm2 4.105 CV 1
ASSI { 1016}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 327 and name H ))
3.800 1.800 1.800 peak 1016 spectrum 1 weight 0.10000E+01 volume 0.30817E-02 ppm1 1.913 ppm2 7.603 CV 1
ASSI { 3887}
( segid " " and resid 438 and name HB% )
( segid " " and resid 437 and name HG2%)
3.900 1.900 1.900 peak 3887 spectrum 1 weight 0.10000E+01 volume 0.21767E-02 ppm1 1.600 ppm2 1.190 CV 1
ASSI { 970}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 321 and name H ))
4.400 2.500 1.600 peak 970 spectrum 1 weight 0.10000E+01 volume 0.88813E-03 ppm1 0.379 ppm2 8.566 CV 1
ASSI { 3661}
(( segid " " and resid 317 and name HG ))
( segid " " and resid 317 and name HD1%)
2.600 0.800 0.800 peak 3661 spectrum 1 weight 0.10000E+01 volume 0.26503E-02 ppm1 0.416 ppm2 0.169 CV 1
ASSI { 3730}
(( segid " " and resid 304 and name HG3 ))
(( segid " " and resid 304 and name H ))
2.200 0.600 0.600 peak 3730 spectrum 1 weight 0.10000E+01 volume 0.23966E-02 ppm1 2.292 ppm2 8.671 CV 1
ASSI { 1854}
( segid " " and resid 294 and name HG2%)
(( segid " " and resid 294 and name HB ))
1.900 0.500 0.500 peak 1854 spectrum 1 weight 0.10000E+01 volume 0.29977E-01 ppm1 1.221 ppm2 4.297 CV 1
ASSI { 3051}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 329 and name H ))
2.800 2.800 3.200 peak 3051 spectrum 1 weight 0.10000E+01 volume 0.77534E-03 ppm1 0.658 ppm2 7.949 CV 1
ASSI { 1494}
( segid " " and resid 255 and name HD1%)
( segid " " and resid 247 and name HD% )
4.500 2.500 1.500 peak 1494 spectrum 1 weight 0.10000E+01 volume 0.71897E-03 ppm1 0.600 ppm2 7.329 CV 1
ASSI { 2912}
(( segid " " and resid 216 and name HA ))
(( segid " " and resid 216 and name HB3 ))
3.400 1.400 1.400 peak 2912 spectrum 1 weight 0.10000E+01 volume 0.88531E-03 ppm1 3.864 ppm2 2.764 CV 1
OR { 2912}
(( segid " " and resid 216 and name HA ))
(( segid " " and resid 216 and name HG ))
ASSI { 2075}
( segid " " and resid 325 and name HE% )
( segid " " and resid 217 and name HD1%)
2.900 1.100 1.100 peak 2075 spectrum 1 weight 0.10000E+01 volume 0.23938E-02 ppm1 0.929 ppm2 -0.052 CV 1
ASSI { 4459}
( segid " " and resid 344 and name HD1%)
(( segid " " and resid 354 and name HD22))
3.000 1.100 1.100 peak 4459 spectrum 1 weight 0.10000E+01 volume 0.45113E-03 ppm1 0.819 ppm2 6.448 CV 1
ASSI { 4125}
(( segid " " and resid 268 and name HA ))
(( segid " " and resid 268 and name H ))
3.500 1.600 1.600 peak 4125 spectrum 1 weight 0.10000E+01 volume 0.42011E-03 ppm1 3.700 ppm2 7.866 CV 1
ASSI { 4412}
( segid " " and resid 318 and name HD1%)
( segid " " and resid 322 and name HD1%)
2.600 0.800 0.800 peak 4412 spectrum 1 weight 0.10000E+01 volume 0.42659E-02 ppm1 0.379 ppm2 -0.167 CV 1
ASSI { 3900}
( segid " " and resid 201 and name HG2%)
( segid " " and resid 211 and name HB% )
3.600 1.600 1.600 peak 3900 spectrum 1 weight 0.10000E+01 volume 0.35862E-02 ppm1 1.291 ppm2 1.686 CV 1
ASSI { 1697}
( segid " " and resid 372 and name HG1%)
(( segid " " and resid 374 and name HA ))
3.500 1.500 1.500 peak 1697 spectrum 1 weight 0.10000E+01 volume 0.23515E-02 ppm1 0.644 ppm2 4.046 CV 1
ASSI { 3206}
(( segid " " and resid 319 and name HB3 ))
(( segid " " and resid 319 and name HG ))
4.000 2.000 2.000 peak 3206 spectrum 1 weight 0.10000E+01 volume 0.29041E-03 ppm1 3.100 ppm2 4.074 CV 1
ASSI { 4212}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 342 and name HG13))
2.200 0.600 0.600 peak 4212 spectrum 1 weight 0.10000E+01 volume 0.46661E-02 ppm1 0.658 ppm2 1.298 CV 1
ASSI { 1683}
(( segid " " and resid 388 and name HG3 ))
(( segid " " and resid 388 and name HB2 ))
2.900 1.100 1.100 peak 1683 spectrum 1 weight 0.10000E+01 volume 0.31437E-02 ppm1 2.271 ppm2 1.548 CV 1
ASSI { 2932}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 443 and name H ))
3.100 1.200 1.200 peak 2932 spectrum 1 weight 0.10000E+01 volume 0.18242E-02 ppm1 0.808 ppm2 7.624 CV 1
ASSI { 1826}
(( segid " " and resid 244 and name HD3 ))
(( segid " " and resid 244 and name HA ))
4.800 2.900 1.200 peak 1826 spectrum 1 weight 0.10000E+01 volume 0.69641E-03 ppm1 1.229 ppm2 3.271 CV 1
ASSI { 810}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 317 and name HA ))
4.100 2.100 1.900 peak 810 spectrum 1 weight 0.10000E+01 volume 0.48494E-03 ppm1 -0.901 ppm2 3.119 CV 1
ASSI { 3878}
( segid " " and resid 359 and name HG1%)
( segid " " and resid 303 and name HE% )
3.300 1.400 1.400 peak 3878 spectrum 1 weight 0.10000E+01 volume 0.20893E-02 ppm1 0.893 ppm2 6.808 CV 1
ASSI { 4295}
(( segid " " and resid 296 and name HG2 ))
( segid " " and resid 300 and name HG2%)
4.400 2.400 1.600 peak 4295 spectrum 1 weight 0.10000E+01 volume 0.63721E-03 ppm1 2.401 ppm2 0.540 CV 1
OR { 4295}
(( segid " " and resid 296 and name HG3 ))
( segid " " and resid 300 and name HG2%)
ASSI { 2916}
(( segid " " and resid 409 and name HA ))
(( segid " " and resid 412 and name H ))
4.000 2.000 2.000 peak 2916 spectrum 1 weight 0.10000E+01 volume 0.38062E-03 ppm1 3.681 ppm2 8.461 CV 1
ASSI { 2965}
(( segid " " and resid 430 and name HH2 ))
(( segid " " and resid 430 and name HZ2 ))
2.500 0.800 0.800 peak 2965 spectrum 1 weight 0.10000E+01 volume 0.47789E-02 ppm1 6.993 ppm2 7.301 CV 1
ASSI { 3684}
( segid " " and resid 412 and name HD2%)
(( segid " " and resid 412 and name H ))
3.200 1.200 1.200 peak 3684 spectrum 1 weight 0.10000E+01 volume 0.40403E-02 ppm1 0.642 ppm2 8.466 CV 1
ASSI { 425}
(( segid " " and resid 345 and name HB ))
(( segid " " and resid 344 and name H ))
5.800 4.200 0.200 peak 425 spectrum 1 weight 0.10000E+01 volume 0.40600E-03 ppm1 2.145 ppm2 7.707 CV 1
ASSI { 1711}
(( segid " " and resid 226 and name HB3 ))
(( segid " " and resid 226 and name HE3 ))
3.900 1.900 1.900 peak 1711 spectrum 1 weight 0.10000E+01 volume 0.25742E-02 ppm1 1.955 ppm2 2.916 CV 1
OR { 1711}
(( segid " " and resid 226 and name HB3 ))
(( segid " " and resid 226 and name HE2 ))
ASSI { 1173}
(( segid " " and resid 305 and name HB3 ))
(( segid " " and resid 308 and name HE2 ))
5.400 3.600 0.600 peak 1173 spectrum 1 weight 0.10000E+01 volume 0.10319E-02 ppm1 1.843 ppm2 2.865 CV 1
OR { 1173}
(( segid " " and resid 305 and name HB3 ))
(( segid " " and resid 308 and name HE3 ))
OR { 1173}
(( segid " " and resid 305 and name HB2 ))
(( segid " " and resid 308 and name HE2 ))
OR { 1173}
(( segid " " and resid 305 and name HB2 ))
(( segid " " and resid 308 and name HE3 ))
ASSI { 1852}
(( segid " " and resid 217 and name HG13))
(( segid " " and resid 217 and name H ))
4.300 2.300 1.700 peak 1852 spectrum 1 weight 0.10000E+01 volume 0.80355E-03 ppm1 0.473 ppm2 7.484 CV 1
ASSI { 3238}
(( segid " " and resid 344 and name HB ))
( segid " " and resid 344 and name HG2%)
2.300 0.700 0.700 peak 3238 spectrum 1 weight 0.10000E+01 volume 0.71530E-02 ppm1 1.894 ppm2 0.864 CV 1
OR { 3238}
(( segid " " and resid 344 and name HB ))
( segid " " and resid 344 and name HD1%)
ASSI { 1808}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 209 and name HA ))
3.000 1.100 1.100 peak 1808 spectrum 1 weight 0.10000E+01 volume 0.11504E-02 ppm1 0.187 ppm2 4.373 CV 1
ASSI { 2431}
(( segid " " and resid 364 and name HB ))
( segid " " and resid 364 and name HG2%)
1.800 0.400 0.400 peak 2431 spectrum 1 weight 0.10000E+01 volume 0.71502E-02 ppm1 2.123 ppm2 0.900 CV 1
ASSI { 2341}
(( segid " " and resid 351 and name HG3 ))
(( segid " " and resid 277 and name HD22))
4.200 2.300 1.800 peak 2341 spectrum 1 weight 0.10000E+01 volume 0.91915E-03 ppm1 2.065 ppm2 6.125 CV 1
ASSI { 4031}
( segid " " and resid 316 and name HD2%)
(( segid " " and resid 316 and name H ))
4.000 2.000 2.000 peak 4031 spectrum 1 weight 0.10000E+01 volume 0.25996E-02 ppm1 0.746 ppm2 8.701 CV 1
ASSI { 3066}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 285 and name HD2 ))
4.300 2.300 1.700 peak 3066 spectrum 1 weight 0.10000E+01 volume 0.18214E-02 ppm1 2.587 ppm2 3.567 CV 1
OR { 3066}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 285 and name HD2 ))
ASSI { 1731}
(( segid " " and resid 282 and name HG2 ))
(( segid " " and resid 283 and name H ))
4.700 2.700 1.300 peak 1731 spectrum 1 weight 0.10000E+01 volume 0.98399E-03 ppm1 2.398 ppm2 7.313 CV 1
ASSI { 1128}
( segid " " and resid 325 and name HE% )
(( segid " " and resid 326 and name H ))
5.200 3.300 0.800 peak 1128 spectrum 1 weight 0.10000E+01 volume 0.56109E-03 ppm1 0.929 ppm2 8.953 CV 1
ASSI { 2508}
(( segid " " and resid 365 and name HG2 ))
( segid " " and resid 364 and name HG2%)
3.400 1.400 1.400 peak 2508 spectrum 1 weight 0.10000E+01 volume 0.10418E-01 ppm1 2.342 ppm2 0.898 CV 1
OR { 2508}
(( segid " " and resid 365 and name HG3 ))
( segid " " and resid 364 and name HG2%)
ASSI { 3958}
(( segid " " and resid 379 and name HD2 ))
(( segid " " and resid 378 and name HA ))
3.100 1.200 1.200 peak 3958 spectrum 1 weight 0.10000E+01 volume 0.11673E-02 ppm1 3.623 ppm2 4.455 CV 1
ASSI { 451}
(( segid " " and resid 351 and name HG2 ))
( segid " " and resid 350 and name HG2%)
4.400 2.500 1.600 peak 451 spectrum 1 weight 0.10000E+01 volume 0.16015E-02 ppm1 2.177 ppm2 0.721 CV 1
ASSI { 947}
( segid " " and resid 284 and name HE% )
( segid " " and resid 287 and name HD% )
4.400 2.400 1.600 peak 947 spectrum 1 weight 0.10000E+01 volume 0.10235E-02 ppm1 2.151 ppm2 6.348 CV 1
ASSI { 2311}
(( segid " " and resid 332 and name HG2 ))
(( segid " " and resid 329 and name HA ))
3.000 1.200 1.200 peak 2311 spectrum 1 weight 0.10000E+01 volume 0.10601E-02 ppm1 2.072 ppm2 3.830 CV 1
ASSI { 2958}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 209 and name H ))
4.700 2.800 1.300 peak 2958 spectrum 1 weight 0.10000E+01 volume 0.74435E-03 ppm1 0.883 ppm2 7.894 CV 1
ASSI { 2047}
(( segid " " and resid 202 and name HG2 ))
( segid " " and resid 198 and name HG1%)
3.500 1.500 1.500 peak 2047 spectrum 1 weight 0.10000E+01 volume 0.92761E-03 ppm1 2.313 ppm2 0.599 CV 1
OR { 2047}
(( segid " " and resid 202 and name HG2 ))
( segid " " and resid 198 and name HG2%)
ASSI { 1728}
( segid " " and resid 376 and name HG2%)
( segid " " and resid 203 and name HE% )
2.300 0.600 0.600 peak 1728 spectrum 1 weight 0.10000E+01 volume 0.95102E-02 ppm1 0.894 ppm2 2.218 CV 1
ASSI { 1917}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 322 and name HD1%)
2.100 0.500 0.500 peak 1917 spectrum 1 weight 0.10000E+01 volume 0.77393E-02 ppm1 0.399 ppm2 -0.165 CV 1
ASSI { 2307}
( segid " " and resid 317 and name HD1%)
( segid " " and resid 213 and name HE% )
3.300 1.300 1.300 peak 2307 spectrum 1 weight 0.10000E+01 volume 0.15507E-02 ppm1 0.169 ppm2 7.136 CV 1
ASSI { 4177}
( segid " " and resid 368 and name HE% )
( segid " " and resid 307 and name HD1%)
4.700 2.700 1.300 peak 4177 spectrum 1 weight 0.10000E+01 volume 0.51315E-03 ppm1 6.742 ppm2 1.207 CV 1
ASSI { 2093}
(( segid " " and resid 187 and name HB2 ))
(( segid " " and resid 187 and name HA ))
3.400 1.400 1.400 peak 2093 spectrum 1 weight 0.10000E+01 volume 0.12124E-02 ppm1 1.726 ppm2 4.610 CV 1
ASSI { 2539}
(( segid " " and resid 222 and name HG3 ))
(( segid " " and resid 222 and name HD2 ))
2.100 0.600 0.600 peak 2539 spectrum 1 weight 0.10000E+01 volume 0.72094E-02 ppm1 0.972 ppm2 1.273 CV 1
OR { 2539}
(( segid " " and resid 222 and name HG3 ))
(( segid " " and resid 222 and name HD3 ))
ASSI { 3306}
(( segid " " and resid 429 and name HG ))
(( segid " " and resid 429 and name H ))
4.100 2.100 1.900 peak 3306 spectrum 1 weight 0.10000E+01 volume 0.11278E-02 ppm1 1.388 ppm2 8.109 CV 1
ASSI { 2814}
(( segid " " and resid 294 and name HB ))
(( segid " " and resid 294 and name H ))
3.700 1.700 1.700 peak 2814 spectrum 1 weight 0.10000E+01 volume 0.91915E-03 ppm1 4.297 ppm2 8.523 CV 1
ASSI { 4165}
(( segid " " and resid 227 and name HB2 ))
(( segid " " and resid 227 and name HA ))
2.800 1.000 1.000 peak 4165 spectrum 1 weight 0.10000E+01 volume 0.15310E-02 ppm1 3.139 ppm2 4.207 CV 1
ASSI { 701}
( segid " " and resid 230 and name HG2%)
(( segid " " and resid 331 and name HB3 ))
3.800 1.800 1.800 peak 701 spectrum 1 weight 0.10000E+01 volume 0.75846E-03 ppm1 0.952 ppm2 2.548 CV 1
OR { 701}
( segid " " and resid 230 and name HG2%)
(( segid " " and resid 331 and name HB2 ))
ASSI { 3676}
(( segid " " and resid 371 and name HB ))
( segid " " and resid 373 and name HD1%)
5.100 3.300 0.900 peak 3676 spectrum 1 weight 0.10000E+01 volume 0.35244E-03 ppm1 1.915 ppm2 -0.202 CV 1
ASSI { 2647}
( segid " " and resid 202 and name HE% )
(( segid " " and resid 202 and name HA ))
3.500 1.500 1.500 peak 2647 spectrum 1 weight 0.10000E+01 volume 0.20216E-02 ppm1 1.867 ppm2 4.426 CV 1
ASSI { 743}
( segid " " and resid 357 and name HD1%)
(( segid " " and resid 361 and name H ))
5.200 3.400 0.800 peak 743 spectrum 1 weight 0.10000E+01 volume 0.52161E-03 ppm1 0.680 ppm2 8.378 CV 1
ASSI { 3034}
(( segid " " and resid 391 and name HA ))
( segid " " and resid 391 and name HD1%)
4.700 2.700 1.300 peak 3034 spectrum 1 weight 0.10000E+01 volume 0.78098E-03 ppm1 4.375 ppm2 0.711 CV 1
ASSI { 1781}
(( segid " " and resid 253 and name HB ))
(( segid " " and resid 252 and name HA ))
4.700 2.700 1.300 peak 1781 spectrum 1 weight 0.10000E+01 volume 0.10517E-02 ppm1 3.523 ppm2 4.334 CV 1
ASSI { 3000}
(( segid " " and resid 410 and name HA ))
(( segid " " and resid 410 and name H ))
3.400 1.500 1.500 peak 3000 spectrum 1 weight 0.10000E+01 volume 0.68794E-03 ppm1 4.345 ppm2 7.925 CV 1
ASSI { 4064}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 318 and name H ))
5.000 3.200 1.000 peak 4064 spectrum 1 weight 0.10000E+01 volume 0.51315E-03 ppm1 0.183 ppm2 8.039 CV 1
ASSI { 2171}
( segid " " and resid 233 and name HG1%)
(( segid " " and resid 261 and name HD21))
3.400 1.400 1.400 peak 2171 spectrum 1 weight 0.10000E+01 volume 0.27264E-02 ppm1 0.870 ppm2 7.510 CV 1
ASSI { 4010}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 342 and name H ))
3.600 1.600 1.600 peak 4010 spectrum 1 weight 0.10000E+01 volume 0.21118E-02 ppm1 0.656 ppm2 8.641 CV 1
ASSI { 4702}
(( segid " " and resid 239 and name HG3 ))
(( segid " " and resid 240 and name H ))
4.500 2.600 1.500 peak 4702 spectrum 1 weight 0.10000E+01 volume 0.42293E-03 ppm1 1.580 ppm2 7.997 CV 1
ASSI { 3621}
(( segid " " and resid 393 and name HB2 ))
(( segid " " and resid 393 and name HB3 ))
1.700 0.400 0.500 peak 3621 spectrum 1 weight 0.10000E+01 volume 0.10184E-01 ppm1 2.086 ppm2 1.847 CV 1
ASSI { 3956}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 285 and name HD3 ))
3.300 1.400 1.400 peak 3956 spectrum 1 weight 0.10000E+01 volume 0.26390E-02 ppm1 2.585 ppm2 3.684 CV 1
OR { 3956}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 285 and name HD3 ))
ASSI { 1322}
( segid " " and resid 443 and name HD1%)
(( segid " " and resid 443 and name H ))
3.400 1.400 1.400 peak 1322 spectrum 1 weight 0.10000E+01 volume 0.60534E-02 ppm1 0.845 ppm2 7.637 CV 1
ASSI { 3285}
(( segid " " and resid 225 and name HG2 ))
(( segid " " and resid 225 and name H ))
3.400 1.500 1.500 peak 3285 spectrum 1 weight 0.10000E+01 volume 0.75564E-03 ppm1 2.811 ppm2 7.792 CV 1
ASSI { 2763}
(( segid " " and resid 219 and name HA ))
(( segid " " and resid 219 and name H ))
3.300 1.400 1.400 peak 2763 spectrum 1 weight 0.10000E+01 volume 0.82611E-03 ppm1 4.126 ppm2 7.709 CV 1
ASSI { 4051}
(( segid " " and resid 256 and name HA ))
( segid " " and resid 223 and name HE% )
4.300 2.300 1.700 peak 4051 spectrum 1 weight 0.10000E+01 volume 0.35244E-03 ppm1 4.115 ppm2 6.667 CV 1
ASSI { 3200}
(( segid " " and resid 245 and name HA ))
(( segid " " and resid 248 and name HB2 ))
4.000 2.000 2.000 peak 3200 spectrum 1 weight 0.10000E+01 volume 0.64567E-03 ppm1 3.981 ppm2 2.511 CV 1
ASSI { 1269}
(( segid " " and resid 257 and name HB2 ))
( segid " " and resid 258 and name HE% )
5.900 4.300 0.100 peak 1269 spectrum 1 weight 0.10000E+01 volume 0.25657E-03 ppm1 2.440 ppm2 6.642 CV 1
ASSI { 3442}
( segid " " and resid 337 and name HE% )
( segid " " and resid 329 and name HD1%)
5.400 3.700 0.600 peak 3442 spectrum 1 weight 0.10000E+01 volume 0.47366E-03 ppm1 1.804 ppm2 0.108 CV 1
ASSI { 3538}
(( segid " " and resid 327 and name HD2 ))
( segid " " and resid 330 and name HB% )
2.900 2.900 3.100 peak 3538 spectrum 1 weight 0.10000E+01 volume 0.58644E-03 ppm1 7.210 ppm2 1.554 CV 1
ASSI { 4012}
(( segid " " and resid 424 and name HB2 ))
(( segid " " and resid 425 and name H ))
2.900 1.000 1.000 peak 4012 spectrum 1 weight 0.10000E+01 volume 0.20187E-02 ppm1 3.905 ppm2 7.748 CV 1
ASSI { 83}
(( segid " " and resid 302 and name HB2 ))
( segid " " and resid 306 and name HD2%)
5.100 3.200 0.900 peak 83 spectrum 1 weight 0.10000E+01 volume 0.51315E-03 ppm1 1.922 ppm2 -0.354 CV 1
ASSI { 3973}
( segid " " and resid 213 and name HE% )
( segid " " and resid 213 and name HD% )
3.400 1.400 1.400 peak 3973 spectrum 1 weight 0.10000E+01 volume 0.36652E-03 ppm1 7.099 ppm2 6.709 CV 1
ASSI { 2157}
(( segid " " and resid 429 and name HB3 ))
(( segid " " and resid 430 and name H ))
3.400 1.400 1.400 peak 2157 spectrum 1 weight 0.10000E+01 volume 0.52725E-03 ppm1 1.806 ppm2 7.719 CV 1
ASSI { 608}
( segid " " and resid 352 and name HG2%)
(( segid " " and resid 356 and name H ))
4.400 2.400 1.600 peak 608 spectrum 1 weight 0.10000E+01 volume 0.10432E-02 ppm1 0.918 ppm2 7.348 CV 1
ASSI { 3271}
( segid " " and resid 372 and name HG2%)
(( segid " " and resid 372 and name HB ))
1.900 0.400 0.400 peak 3271 spectrum 1 weight 0.10000E+01 volume 0.28324E-01 ppm1 0.746 ppm2 1.706 CV 1
ASSI { 1666}
( segid " " and resid 436 and name HD1%)
(( segid " " and resid 406 and name H ))
3.500 1.600 1.600 peak 1666 spectrum 1 weight 0.10000E+01 volume 0.11729E-02 ppm1 1.010 ppm2 9.246 CV 1
ASSI { 3902}
( segid " " and resid 358 and name HD% )
(( segid " " and resid 358 and name HA ))
2.900 1.100 1.100 peak 3902 spectrum 1 weight 0.10000E+01 volume 0.32593E-02 ppm1 7.015 ppm2 4.010 CV 1
ASSI { 3024}
(( segid " " and resid 340 and name HG3 ))
(( segid " " and resid 341 and name H ))
3.600 1.600 1.600 peak 3024 spectrum 1 weight 0.10000E+01 volume 0.50553E-02 ppm1 2.312 ppm2 8.508 CV 1
OR { 3024}
(( segid " " and resid 340 and name HG2 ))
(( segid " " and resid 341 and name H ))
ASSI { 651}
(( segid " " and resid 325 and name HG3 ))
( segid " " and resid 361 and name HE% )
5.300 3.500 0.700 peak 651 spectrum 1 weight 0.10000E+01 volume 0.37780E-03 ppm1 2.698 ppm2 7.092 CV 1
OR { 651}
(( segid " " and resid 325 and name HG3 ))
( segid " " and resid 361 and name HD% )
ASSI { 336}
(( segid " " and resid 332 and name HG3 ))
(( segid " " and resid 332 and name H ))
4.100 2.100 1.900 peak 336 spectrum 1 weight 0.10000E+01 volume 0.70205E-03 ppm1 1.972 ppm2 7.438 CV 1
ASSI { 1980}
(( segid " " and resid 222 and name HG3 ))
(( segid " " and resid 222 and name HA ))
2.900 1.100 1.100 peak 1980 spectrum 1 weight 0.10000E+01 volume 0.30422E-02 ppm1 0.972 ppm2 3.784 CV 1
ASSI { 2111}
(( segid " " and resid 395 and name HB2 ))
(( segid " " and resid 396 and name H ))
4.200 2.200 1.800 peak 2111 spectrum 1 weight 0.10000E+01 volume 0.70769E-03 ppm1 2.047 ppm2 8.674 CV 1
ASSI { 2970}
( segid " " and resid 213 and name HD% )
( segid " " and resid 267 and name HD2%)
3.400 1.500 1.500 peak 2970 spectrum 1 weight 0.10000E+01 volume 0.75846E-03 ppm1 6.713 ppm2 0.907 CV 1
OR { 2970}
( segid " " and resid 213 and name HD% )
( segid " " and resid 267 and name HD1%)
ASSI { 2639}
(( segid " " and resid 402 and name HB ))
(( segid " " and resid 402 and name H ))
3.300 1.300 1.300 peak 2639 spectrum 1 weight 0.10000E+01 volume 0.47084E-03 ppm1 1.940 ppm2 8.692 CV 1
ASSI { 1999}
( segid " " and resid 364 and name HG1%)
(( segid " " and resid 361 and name HA ))
2.000 0.500 0.500 peak 1999 spectrum 1 weight 0.10000E+01 volume 0.47733E-02 ppm1 1.059 ppm2 4.223 CV 1
ASSI { 2952}
(( segid " " and resid 413 and name HA ))
(( segid " " and resid 414 and name H ))
4.100 2.100 1.900 peak 2952 spectrum 1 weight 0.10000E+01 volume 0.51033E-03 ppm1 4.191 ppm2 7.664 CV 1
ASSI { 2864}
(( segid " " and resid 308 and name HG3 ))
(( segid " " and resid 308 and name H ))
3.200 1.300 1.300 peak 2864 spectrum 1 weight 0.10000E+01 volume 0.42659E-02 ppm1 1.376 ppm2 7.087 CV 1
ASSI { 1056}
( segid " " and resid 435 and name HD1%)
(( segid " " and resid 435 and name HB ))
3.500 1.600 1.600 peak 1056 spectrum 1 weight 0.10000E+01 volume 0.34341E-02 ppm1 0.869 ppm2 1.996 CV 1
ASSI { 1379}
(( segid " " and resid 377 and name HG2 ))
( segid " " and resid 204 and name HE% )
4.000 2.000 2.000 peak 1379 spectrum 1 weight 0.10000E+01 volume 0.44267E-03 ppm1 2.519 ppm2 6.880 CV 1
OR { 1379}
(( segid " " and resid 377 and name HG2 ))
( segid " " and resid 204 and name HD% )
ASSI { 2768}
(( segid " " and resid 299 and name HG3 ))
(( segid " " and resid 300 and name H ))
4.300 2.300 1.700 peak 2768 spectrum 1 weight 0.10000E+01 volume 0.69641E-03 ppm1 1.345 ppm2 7.951 CV 1
OR { 2768}
(( segid " " and resid 299 and name HG2 ))
(( segid " " and resid 300 and name H ))
ASSI { 4571}
(( segid " " and resid 342 and name HB ))
(( segid " " and resid 343 and name H ))
3.300 1.400 1.400 peak 4571 spectrum 1 weight 0.10000E+01 volume 0.53289E-03 ppm1 1.705 ppm2 8.182 CV 1
ASSI { 4256}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 214 and name H ))
3.600 1.600 1.600 peak 4256 spectrum 1 weight 0.10000E+01 volume 0.23148E-02 ppm1 2.220 ppm2 7.181 CV 1
ASSI { 2061}
(( segid " " and resid 420 and name HB ))
(( segid " " and resid 420 and name HA ))
2.600 0.800 0.800 peak 2061 spectrum 1 weight 0.10000E+01 volume 0.48889E-02 ppm1 1.767 ppm2 3.979 CV 1
ASSI { 4693}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 340 and name H ))
5.500 3.800 0.500 peak 4693 spectrum 1 weight 0.10000E+01 volume 0.66820E-03 ppm1 0.750 ppm2 8.149 CV 1
ASSI { 1873}
( segid " " and resid 438 and name HB% )
(( segid " " and resid 439 and name H ))
2.800 1.000 1.000 peak 1873 spectrum 1 weight 0.10000E+01 volume 0.24304E-02 ppm1 1.599 ppm2 8.763 CV 1
ASSI { 2240}
(( segid " " and resid 187 and name HG3 ))
(( segid " " and resid 188 and name HD2 ))
2.600 2.600 3.400 peak 2240 spectrum 1 weight 0.10000E+01 volume 0.11870E-02 ppm1 1.330 ppm2 3.488 CV 1
OR { 2240}
(( segid " " and resid 187 and name HG3 ))
(( segid " " and resid 188 and name HD3 ))
ASSI { 4386}
(( segid " " and resid 288 and name HB2 ))
(( segid " " and resid 288 and name H ))
2.700 0.900 0.900 peak 4386 spectrum 1 weight 0.10000E+01 volume 0.26672E-02 ppm1 1.984 ppm2 7.460 CV 1
ASSI { 510}
( segid " " and resid 402 and name HG2%)
( segid " " and resid 436 and name HD1%)
2.200 0.600 0.600 peak 510 spectrum 1 weight 0.10000E+01 volume 0.62255E-02 ppm1 0.768 ppm2 1.014 CV 1
ASSI { 4595}
(( segid " " and resid 346 and name HB2 ))
(( segid " " and resid 346 and name HB3 ))
1.900 0.400 0.400 peak 4595 spectrum 1 weight 0.10000E+01 volume 0.21795E-02 ppm1 1.706 ppm2 1.481 CV 1
ASSI { 4598}
(( segid " " and resid 183 and name HB2 ))
(( segid " " and resid 183 and name HG3 ))
2.000 0.500 0.500 peak 4598 spectrum 1 weight 0.10000E+01 volume 0.21713E-01 ppm1 1.996 ppm2 2.487 CV 1
OR { 4598}
(( segid " " and resid 183 and name HB2 ))
(( segid " " and resid 183 and name HG2 ))
ASSI { 3320}
(( segid " " and resid 368 and name HB2 ))
( segid " " and resid 323 and name HG1%)
4.900 3.000 1.100 peak 3320 spectrum 1 weight 0.10000E+01 volume 0.35809E-03 ppm1 3.252 ppm2 0.768 CV 1
ASSI { 4615}
(( segid " " and resid 187 and name HD2 ))
(( segid " " and resid 188 and name HD2 ))
2.600 2.600 3.400 peak 4615 spectrum 1 weight 0.10000E+01 volume 0.10094E-02 ppm1 1.634 ppm2 3.489 CV 1
OR { 4615}
(( segid " " and resid 187 and name HD2 ))
(( segid " " and resid 188 and name HD3 ))
ASSI { 1052}
(( segid " " and resid 419 and name HA2 ))
( segid " " and resid 420 and name HG2%)
5.900 4.400 0.100 peak 1052 spectrum 1 weight 0.10000E+01 volume 0.48212E-03 ppm1 3.778 ppm2 0.803 CV 1
OR { 1052}
(( segid " " and resid 419 and name HA2 ))
( segid " " and resid 420 and name HD1%)
ASSI { 1955}
( segid " " and resid 407 and name HE% )
( segid " " and resid 407 and name HD% )
4.100 2.100 1.900 peak 1955 spectrum 1 weight 0.10000E+01 volume 0.18891E-03 ppm1 6.886 ppm2 7.282 CV 1
ASSI { 3370}
( segid " " and resid 307 and name HD1%)
(( segid " " and resid 307 and name HA ))
2.300 0.700 0.700 peak 3370 spectrum 1 weight 0.10000E+01 volume 0.40121E-02 ppm1 1.210 ppm2 4.154 CV 1
ASSI { 328}
(( segid " " and resid 376 and name HB ))
( segid " " and resid 376 and name HG1%)
2.300 0.700 0.700 peak 328 spectrum 1 weight 0.10000E+01 volume 0.79480E-02 ppm1 2.033 ppm2 0.920 CV 1
OR { 328}
(( segid " " and resid 376 and name HB ))
( segid " " and resid 376 and name HG2%)
ASSI { 421}
(( segid " " and resid 332 and name HG2 ))
(( segid " " and resid 332 and name H ))
3.300 1.300 1.300 peak 421 spectrum 1 weight 0.10000E+01 volume 0.11363E-02 ppm1 2.069 ppm2 7.442 CV 1
ASSI { 748}
( segid " " and resid 358 and name HE% )
( segid " " and resid 339 and name HD1%)
2.700 0.900 0.900 peak 748 spectrum 1 weight 0.10000E+01 volume 0.63806E-02 ppm1 6.702 ppm2 0.689 CV 1
OR { 748}
( segid " " and resid 358 and name HE% )
( segid " " and resid 339 and name HG2%)
ASSI { 1712}
(( segid " " and resid 310 and name HA ))
( segid " " and resid 310 and name HD2%)
2.900 1.000 1.000 peak 1712 spectrum 1 weight 0.10000E+01 volume 0.14126E-02 ppm1 4.330 ppm2 1.077 CV 1
OR { 1712}
(( segid " " and resid 310 and name HA ))
( segid " " and resid 310 and name HD1%)
ASSI { 2637}
(( segid " " and resid 430 and name HH2 ))
( segid " " and resid 423 and name HD1%)
4.000 2.000 2.000 peak 2637 spectrum 1 weight 0.10000E+01 volume 0.47648E-03 ppm1 6.995 ppm2 0.826 CV 1
OR { 2637}
(( segid " " and resid 430 and name HH2 ))
( segid " " and resid 423 and name HD2%)
ASSI { 2388}
(( segid " " and resid 239 and name HD2 ))
(( segid " " and resid 239 and name HG2 ))
2.600 0.900 0.900 peak 2388 spectrum 1 weight 0.10000E+01 volume 0.25319E-02 ppm1 1.752 ppm2 1.416 CV 1
ASSI { 3237}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 370 and name H ))
4.000 2.000 2.000 peak 3237 spectrum 1 weight 0.10000E+01 volume 0.11645E-02 ppm1 0.370 ppm2 8.417 CV 1
ASSI { 3633}
(( segid " " and resid 187 and name HD2 ))
(( segid " " and resid 187 and name HA ))
3.900 1.900 1.900 peak 3633 spectrum 1 weight 0.10000E+01 volume 0.95582E-03 ppm1 1.640 ppm2 4.613 CV 1
ASSI { 3420}
(( segid " " and resid 308 and name HG3 ))
(( segid " " and resid 308 and name HB2 ))
1.900 0.500 0.500 peak 3420 spectrum 1 weight 0.10000E+01 volume 0.11749E-01 ppm1 1.382 ppm2 1.833 CV 1
OR { 3420}
(( segid " " and resid 308 and name HG3 ))
(( segid " " and resid 308 and name HB3 ))
ASSI { 938}
(( segid " " and resid 360 and name HZ ))
(( segid " " and resid 318 and name HG12))
3.900 1.900 1.900 peak 938 spectrum 1 weight 0.10000E+01 volume 0.41165E-03 ppm1 6.606 ppm2 1.031 CV 1
ASSI { 1449}
( segid " " and resid 345 and name HG2%)
(( segid " " and resid 231 and name HB2 ))
2.600 0.800 0.800 peak 1449 spectrum 1 weight 0.10000E+01 volume 0.31494E-02 ppm1 0.915 ppm2 2.815 CV 1
OR { 1449}
( segid " " and resid 345 and name HG2%)
(( segid " " and resid 231 and name HB3 ))
ASSI { 638}
(( segid " " and resid 446 and name HA ))
(( segid " " and resid 445 and name HG2 ))
3.100 1.200 1.200 peak 638 spectrum 1 weight 0.10000E+01 volume 0.11278E-02 ppm1 4.045 ppm2 2.248 CV 1
ASSI { 111}
( segid " " and resid 358 and name HE% )
( segid " " and resid 359 and name HG1%)
5.100 3.200 0.900 peak 111 spectrum 1 weight 0.10000E+01 volume 0.11081E-02 ppm1 6.702 ppm2 0.885 CV 1
ASSI { 1244}
(( segid " " and resid 389 and name HG2 ))
(( segid " " and resid 390 and name H ))
2.400 2.400 3.600 peak 1244 spectrum 1 weight 0.10000E+01 volume 0.17058E-02 ppm1 1.594 ppm2 8.096 CV 1
ASSI { 3401}
( segid " " and resid 325 and name HE% )
(( segid " " and resid 325 and name HG3 ))
3.100 1.200 1.200 peak 3401 spectrum 1 weight 0.10000E+01 volume 0.52527E-02 ppm1 0.929 ppm2 2.709 CV 1
ASSI { 4514}
(( segid " " and resid 315 and name HB2 ))
( segid " " and resid 315 and name HD% )
3.800 1.800 1.800 peak 4514 spectrum 1 weight 0.10000E+01 volume 0.35527E-03 ppm1 3.157 ppm2 7.033 CV 1
ASSI { 3645}
(( segid " " and resid 318 and name HG12))
(( segid " " and resid 318 and name HB ))
2.200 0.600 0.600 peak 3645 spectrum 1 weight 0.10000E+01 volume 0.36624E-02 ppm1 0.988 ppm2 1.354 CV 1
ASSI { 4242}
( segid " " and resid 315 and name HE% )
(( segid " " and resid 315 and name HB2 ))
5.200 3.400 0.800 peak 4242 spectrum 1 weight 0.10000E+01 volume 0.57798E-03 ppm1 6.876 ppm2 3.130 CV 1
ASSI { 4777}
(( segid " " and resid 308 and name HE3 ))
(( segid " " and resid 308 and name H ))
4.000 2.000 2.000 peak 4777 spectrum 1 weight 0.10000E+01 volume 0.33467E-02 ppm1 2.847 ppm2 7.079 CV 1
OR { 4777}
(( segid " " and resid 308 and name HE2 ))
(( segid " " and resid 308 and name H ))
ASSI { 3727}
(( segid " " and resid 342 and name HB ))
( segid " " and resid 342 and name HG2%)
2.400 0.700 0.700 peak 3727 spectrum 1 weight 0.10000E+01 volume 0.24896E-02 ppm1 1.708 ppm2 0.514 CV 1
ASSI { 2603}
(( segid " " and resid 375 and name HB3 ))
(( segid " " and resid 376 and name H ))
4.400 2.400 1.600 peak 2603 spectrum 1 weight 0.10000E+01 volume 0.10601E-02 ppm1 1.856 ppm2 9.507 CV 1
ASSI { 11}
(( segid " " and resid 308 and name HD3 ))
(( segid " " and resid 304 and name HB2 ))
3.500 1.600 1.600 peak 11 spectrum 1 weight 0.10000E+01 volume 0.23091E-02 ppm1 1.530 ppm2 2.229 CV 1
OR { 11}
(( segid " " and resid 308 and name HD2 ))
(( segid " " and resid 304 and name HB2 ))
ASSI { 3078}
( segid " " and resid 247 and name HD% )
( segid " " and resid 243 and name HD2%)
5.500 3.800 0.500 peak 3078 spectrum 1 weight 0.10000E+01 volume 0.27913E-03 ppm1 7.328 ppm2 0.161 CV 1
ASSI { 4272}
(( segid " " and resid 402 and name HA ))
(( segid " " and resid 402 and name HB ))
3.200 1.300 1.300 peak 4272 spectrum 1 weight 0.10000E+01 volume 0.11955E-02 ppm1 3.389 ppm2 1.930 CV 1
ASSI { 2986}
(( segid " " and resid 210 and name HB3 ))
( segid " " and resid 212 and name HG1%)
4.100 2.100 1.900 peak 2986 spectrum 1 weight 0.10000E+01 volume 0.76970E-03 ppm1 1.393 ppm2 -0.344 CV 1
ASSI { 3583}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 203 and name HA ))
3.900 1.900 1.900 peak 3583 spectrum 1 weight 0.10000E+01 volume 0.16522E-02 ppm1 2.220 ppm2 4.468 CV 1
ASSI { 1132}
(( segid " " and resid 331 and name HG2 ))
(( segid " " and resid 331 and name HB3 ))
3.100 1.200 1.200 peak 1132 spectrum 1 weight 0.10000E+01 volume 0.84021E-03 ppm1 1.530 ppm2 2.533 CV 1
OR { 1132}
(( segid " " and resid 331 and name HG2 ))
(( segid " " and resid 331 and name HB2 ))
ASSI { 2012}
(( segid " " and resid 424 and name HA ))
(( segid " " and resid 424 and name HB3 ))
2.800 1.000 1.000 peak 2012 spectrum 1 weight 0.10000E+01 volume 0.33298E-02 ppm1 4.242 ppm2 3.891 CV 1
OR { 2012}
(( segid " " and resid 424 and name HA ))
(( segid " " and resid 424 and name HB2 ))
ASSI { 4173}
( segid " " and resid 420 and name HD1%)
(( segid " " and resid 420 and name HG12))
1.900 0.400 0.400 peak 4173 spectrum 1 weight 0.10000E+01 volume 0.27727E-01 ppm1 0.770 ppm2 1.121 CV 1
ASSI { 2424}
(( segid " " and resid 244 and name HD3 ))
(( segid " " and resid 244 and name HG3 ))
3.300 1.400 1.400 peak 2424 spectrum 1 weight 0.10000E+01 volume 0.66820E-03 ppm1 1.222 ppm2 -0.550 CV 1
ASSI { 3916}
( segid " " and resid 436 and name HD2%)
(( segid " " and resid 402 and name HA ))
4.400 2.400 1.600 peak 3916 spectrum 1 weight 0.10000E+01 volume 0.10996E-02 ppm1 0.855 ppm2 3.365 CV 1
ASSI { 3047}
(( segid " " and resid 260 and name HB2 ))
( segid " " and resid 219 and name HE% )
4.300 2.300 1.700 peak 3047 spectrum 1 weight 0.10000E+01 volume 0.45677E-03 ppm1 2.090 ppm2 6.399 CV 1
OR { 3047}
(( segid " " and resid 260 and name HB3 ))
( segid " " and resid 219 and name HE% )
ASSI { 323}
(( segid " " and resid 430 and name HZ2 ))
(( segid " " and resid 427 and name HB3 ))
4.200 2.200 1.800 peak 323 spectrum 1 weight 0.10000E+01 volume 0.59491E-03 ppm1 7.300 ppm2 1.987 CV 1
ASSI { 2741}
(( segid " " and resid 330 and name HA ))
(( segid " " and resid 331 and name H ))
3.800 1.800 1.800 peak 2741 spectrum 1 weight 0.10000E+01 volume 0.77534E-03 ppm1 4.124 ppm2 7.173 CV 1
ASSI { 3218}
(( segid " " and resid 374 and name HD2 ))
(( segid " " and resid 374 and name H ))
4.100 2.100 1.900 peak 3218 spectrum 1 weight 0.10000E+01 volume 0.14351E-02 ppm1 1.604 ppm2 6.324 CV 1
OR { 3218}
(( segid " " and resid 374 and name HD3 ))
(( segid " " and resid 374 and name H ))
ASSI { 19}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 440 and name HE2 ))
3.100 1.200 1.200 peak 19 spectrum 1 weight 0.10000E+01 volume 0.19370E-02 ppm1 0.769 ppm2 2.841 CV 1
ASSI { 3808}
(( segid " " and resid 213 and name HA ))
(( segid " " and resid 213 and name HB3 ))
3.400 1.400 1.400 peak 3808 spectrum 1 weight 0.10000E+01 volume 0.93607E-03 ppm1 3.598 ppm2 2.736 CV 1
ASSI { 655}
( segid " " and resid 189 and name HG2%)
( segid " " and resid 270 and name HE% )
2.700 0.900 0.900 peak 655 spectrum 1 weight 0.10000E+01 volume 0.20300E-02 ppm1 0.941 ppm2 6.066 CV 1
ASSI { 2499}
(( segid " " and resid 264 and name HA ))
( segid " " and resid 264 and name HB% )
2.600 0.900 0.900 peak 2499 spectrum 1 weight 0.10000E+01 volume 0.33947E-02 ppm1 3.907 ppm2 0.935 CV 1
ASSI { 3796}
(( segid " " and resid 299 and name HB2 ))
( segid " " and resid 359 and name HG2%)
4.200 2.200 1.800 peak 3796 spectrum 1 weight 0.10000E+01 volume 0.47648E-03 ppm1 1.465 ppm2 -0.444 CV 1
ASSI { 4094}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 372 and name H ))
2.400 0.700 0.700 peak 4094 spectrum 1 weight 0.10000E+01 volume 0.46774E-02 ppm1 0.365 ppm2 7.907 CV 1
ASSI { 3847}
( segid " " and resid 211 and name HB% )
(( segid " " and resid 211 and name HA ))
2.500 0.800 0.800 peak 3847 spectrum 1 weight 0.10000E+01 volume 0.37019E-02 ppm1 1.690 ppm2 3.821 CV 1
ASSI { 3305}
(( segid " " and resid 377 and name HG2 ))
( segid " " and resid 408 and name HD2%)
3.500 1.500 1.500 peak 3305 spectrum 1 weight 0.10000E+01 volume 0.15592E-02 ppm1 2.517 ppm2 0.881 CV 1
ASSI { 781}
( segid " " and resid 409 and name HD2%)
(( segid " " and resid 433 and name HG2 ))
2.900 1.000 1.000 peak 781 spectrum 1 weight 0.10000E+01 volume 0.49481E-02 ppm1 0.741 ppm2 2.204 CV 1
OR { 781}
( segid " " and resid 409 and name HD2%)
(( segid " " and resid 433 and name HB3 ))
ASSI { 2982}
(( segid " " and resid 187 and name HB3 ))
(( segid " " and resid 187 and name HA ))
2.700 0.900 0.900 peak 2982 spectrum 1 weight 0.10000E+01 volume 0.13421E-02 ppm1 1.673 ppm2 4.612 CV 1
ASSI { 878}
( segid " " and resid 297 and name HG2%)
( segid " " and resid 300 and name HG1%)
4.200 2.200 1.800 peak 878 spectrum 1 weight 0.10000E+01 volume 0.26503E-02 ppm1 1.111 ppm2 0.076 CV 1
ASSI { 2340}
(( segid " " and resid 334 and name HG2 ))
(( segid " " and resid 335 and name H ))
3.300 1.400 1.400 peak 2340 spectrum 1 weight 0.10000E+01 volume 0.10432E-02 ppm1 2.195 ppm2 8.869 CV 1
ASSI { 3843}
( segid " " and resid 186 and name HD1%)
(( segid " " and resid 186 and name HG ))
1.800 0.400 0.400 peak 3843 spectrum 1 weight 0.10000E+01 volume 0.52316E-01 ppm1 0.774 ppm2 1.514 CV 1
OR { 3843}
( segid " " and resid 186 and name HD1%)
(( segid " " and resid 186 and name HB2 ))
OR { 3843}
( segid " " and resid 186 and name HD1%)
(( segid " " and resid 186 and name HB3 ))
ASSI { 681}
( segid " " and resid 209 and name HD1%)
( segid " " and resid 213 and name HD% )
4.100 2.100 1.900 peak 681 spectrum 1 weight 0.10000E+01 volume 0.65131E-03 ppm1 0.184 ppm2 6.692 CV 1
ASSI { 2571}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 398 and name H ))
3.600 1.600 1.600 peak 2571 spectrum 1 weight 0.10000E+01 volume 0.26334E-02 ppm1 0.557 ppm2 8.680 CV 1
ASSI { 4263}
( segid " " and resid 328 and name HG2%)
(( segid " " and resid 328 and name H ))
2.200 0.600 0.600 peak 4263 spectrum 1 weight 0.10000E+01 volume 0.40403E-02 ppm1 0.758 ppm2 7.180 CV 1
OR { 4263}
( segid " " and resid 328 and name HG1%)
(( segid " " and resid 328 and name H ))
ASSI { 4021}
( segid " " and resid 306 and name HD2%)
( segid " " and resid 303 and name HE% )
2.700 2.700 3.300 peak 4021 spectrum 1 weight 0.10000E+01 volume 0.81201E-03 ppm1 -0.355 ppm2 6.816 CV 1
ASSI { 2716}
(( segid " " and resid 336 and name HD3 ))
(( segid " " and resid 337 and name H ))
4.200 2.200 1.800 peak 2716 spectrum 1 weight 0.10000E+01 volume 0.59773E-03 ppm1 1.572 ppm2 7.309 CV 1
ASSI { 2395}
(( segid " " and resid 407 and name HA ))
( segid " " and resid 407 and name HD% )
2.600 0.900 0.900 peak 2395 spectrum 1 weight 0.10000E+01 volume 0.11842E-02 ppm1 4.297 ppm2 7.289 CV 1
ASSI { 1284}
( segid " " and resid 436 and name HD1%)
(( segid " " and resid 405 and name H ))
4.300 2.300 1.700 peak 1284 spectrum 1 weight 0.10000E+01 volume 0.95582E-03 ppm1 1.012 ppm2 8.307 CV 1
ASSI { 2899}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 321 and name H ))
4.500 2.600 1.500 peak 2899 spectrum 1 weight 0.10000E+01 volume 0.55827E-03 ppm1 0.174 ppm2 8.567 CV 1
ASSI { 3935}
(( segid " " and resid 430 and name HD1 ))
( segid " " and resid 429 and name HD2%)
4.100 2.100 1.900 peak 3935 spectrum 1 weight 0.10000E+01 volume 0.92479E-03 ppm1 7.180 ppm2 0.653 CV 1
ASSI { 2837}
( segid " " and resid 294 and name HG2%)
(( segid " " and resid 293 and name HD3 ))
3.900 1.900 1.900 peak 2837 spectrum 1 weight 0.10000E+01 volume 0.16325E-02 ppm1 1.219 ppm2 3.107 CV 1
OR { 2837}
( segid " " and resid 294 and name HG2%)
(( segid " " and resid 293 and name HD2 ))
ASSI { 229}
( segid " " and resid 274 and name HD2%)
(( segid " " and resid 191 and name HA3 ))
3.700 1.700 1.700 peak 229 spectrum 1 weight 0.10000E+01 volume 0.24191E-02 ppm1 0.778 ppm2 4.250 CV 1
ASSI { 3441}
(( segid " " and resid 222 and name HG2 ))
(( segid " " and resid 223 and name H ))
5.600 3.900 0.400 peak 3441 spectrum 1 weight 0.10000E+01 volume 0.37216E-03 ppm1 0.385 ppm2 8.408 CV 1
ASSI { 4418}
( segid " " and resid 380 and name HD1%)
(( segid " " and resid 380 and name H ))
4.100 2.100 1.900 peak 4418 spectrum 1 weight 0.10000E+01 volume 0.10291E-02 ppm1 0.759 ppm2 9.039 CV 1
ASSI { 2128}
(( segid " " and resid 368 and name HA ))
( segid " " and resid 371 and name HG1%)
6.000 5.200 0.000 peak 2128 spectrum 1 weight 0.10000E+01 volume 0.48494E-03 ppm1 5.173 ppm2 0.375 CV 1
ASSI { 3182}
(( segid " " and resid 366 and name HG2 ))
(( segid " " and resid 366 and name HA ))
2.700 0.900 0.900 peak 3182 spectrum 1 weight 0.10000E+01 volume 0.60562E-02 ppm1 2.278 ppm2 3.924 CV 1
ASSI { 3955}
(( segid " " and resid 184 and name HD3 ))
(( segid " " and resid 183 and name HA ))
1.800 0.400 0.400 peak 3955 spectrum 1 weight 0.10000E+01 volume 0.20673E-01 ppm1 3.613 ppm2 4.710 CV 1
ASSI { 3097}
(( segid " " and resid 314 and name HA ))
(( segid " " and resid 314 and name HB2 ))
3.100 1.200 1.200 peak 3097 spectrum 1 weight 0.10000E+01 volume 0.88813E-03 ppm1 3.862 ppm2 2.811 CV 1
OR { 3097}
(( segid " " and resid 314 and name HA ))
(( segid " " and resid 314 and name HB3 ))
ASSI { 1672}
(( segid " " and resid 293 and name HA ))
(( segid " " and resid 293 and name HD3 ))
3.100 1.200 1.200 peak 1672 spectrum 1 weight 0.10000E+01 volume 0.10150E-02 ppm1 4.284 ppm2 3.132 CV 1
OR { 1672}
(( segid " " and resid 293 and name HA ))
(( segid " " and resid 293 and name HD2 ))
ASSI { 2547}
(( segid " " and resid 419 and name HA3 ))
(( segid " " and resid 420 and name HB ))
5.300 3.500 0.700 peak 2547 spectrum 1 weight 0.10000E+01 volume 0.62311E-03 ppm1 3.999 ppm2 1.768 CV 1
ASSI { 2026}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 279 and name HB2 ))
3.300 1.400 1.400 peak 2026 spectrum 1 weight 0.10000E+01 volume 0.26757E-02 ppm1 0.168 ppm2 1.564 CV 1
ASSI { 1427}
(( segid " " and resid 308 and name HD3 ))
(( segid " " and resid 304 and name HG2 ))
3.800 1.800 1.800 peak 1427 spectrum 1 weight 0.10000E+01 volume 0.90223E-03 ppm1 1.531 ppm2 2.452 CV 1
OR { 1427}
(( segid " " and resid 308 and name HD2 ))
(( segid " " and resid 304 and name HG2 ))
ASSI { 3411}
(( segid " " and resid 302 and name HG3 ))
( segid " " and resid 306 and name HD2%)
2.800 1.000 1.000 peak 3411 spectrum 1 weight 0.10000E+01 volume 0.17368E-02 ppm1 2.078 ppm2 -0.358 CV 1
ASSI { 3626}
(( segid " " and resid 430 and name HE3 ))
(( segid " " and resid 430 and name HZ3 ))
3.400 1.400 1.400 peak 3626 spectrum 1 weight 0.10000E+01 volume 0.97553E-03 ppm1 7.542 ppm2 6.945 CV 1
ASSI { 606}
(( segid " " and resid 333 and name HB3 ))
( segid " " and resid 333 and name HD2%)
2.300 0.600 0.600 peak 606 spectrum 1 weight 0.10000E+01 volume 0.17027E-01 ppm1 1.507 ppm2 0.851 CV 1
OR { 606}
(( segid " " and resid 333 and name HB3 ))
( segid " " and resid 333 and name HD1%)
ASSI { 4555}
(( segid " " and resid 333 and name HG ))
( segid " " and resid 333 and name HD1%)
1.800 0.400 0.400 peak 4555 spectrum 1 weight 0.10000E+01 volume 0.45208E-01 ppm1 1.601 ppm2 0.847 CV 1
OR { 4555}
(( segid " " and resid 333 and name HG ))
( segid " " and resid 333 and name HD2%)
ASSI { 2644}
( segid " " and resid 446 and name HB% )
( segid " " and resid 398 and name HD1%)
2.400 0.700 0.700 peak 2644 spectrum 1 weight 0.10000E+01 volume 0.57601E-02 ppm1 1.264 ppm2 0.566 CV 1
ASSI { 4515}
(( segid " " and resid 213 and name HA ))
(( segid " " and resid 213 and name HB2 ))
3.400 1.400 1.400 peak 4515 spectrum 1 weight 0.10000E+01 volume 0.36934E-03 ppm1 3.584 ppm2 2.292 CV 1
ASSI { 3526}
(( segid " " and resid 189 and name HB ))
(( segid " " and resid 189 and name HA ))
3.900 1.900 1.900 peak 3526 spectrum 1 weight 0.10000E+01 volume 0.36370E-03 ppm1 2.203 ppm2 4.340 CV 1
ASSI { 2331}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 361 and name HZ ))
2.600 0.800 0.800 peak 2331 spectrum 1 weight 0.10000E+01 volume 0.24417E-02 ppm1 0.514 ppm2 6.628 CV 1
ASSI { 3357}
(( segid " " and resid 285 and name HB2 ))
(( segid " " and resid 285 and name HG2 ))
2.300 0.700 0.700 peak 3357 spectrum 1 weight 0.10000E+01 volume 0.62311E-02 ppm1 2.298 ppm2 1.961 CV 1
OR { 3357}
(( segid " " and resid 285 and name HB2 ))
(( segid " " and resid 285 and name HG3 ))
ASSI { 1255}
(( segid " " and resid 389 and name HA ))
(( segid " " and resid 389 and name HB2 ))
3.300 1.400 1.400 peak 1255 spectrum 1 weight 0.10000E+01 volume 0.22866E-02 ppm1 4.261 ppm2 1.593 CV 1
OR { 1255}
(( segid " " and resid 389 and name HA ))
(( segid " " and resid 389 and name HG2 ))
ASSI { 4432}
(( segid " " and resid 223 and name HB3 ))
(( segid " " and resid 223 and name HB2 ))
2.700 0.900 0.900 peak 4432 spectrum 1 weight 0.10000E+01 volume 0.60901E-03 ppm1 2.927 ppm2 1.796 CV 1
ASSI { 4303}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 319 and name HG ))
3.100 1.200 1.200 peak 4303 spectrum 1 weight 0.10000E+01 volume 0.23430E-02 ppm1 0.348 ppm2 4.084 CV 1
ASSI { 378}
(( segid " " and resid 272 and name HG3 ))
(( segid " " and resid 269 and name HA ))
3.100 1.200 1.200 peak 378 spectrum 1 weight 0.10000E+01 volume 0.30028E-02 ppm1 1.801 ppm2 3.803 CV 1
OR { 378}
(( segid " " and resid 272 and name HG2 ))
(( segid " " and resid 269 and name HA ))
ASSI { 1807}
( segid " " and resid 233 and name HG2%)
(( segid " " and resid 233 and name HB ))
2.200 0.600 0.600 peak 1807 spectrum 1 weight 0.10000E+01 volume 0.11799E-01 ppm1 0.948 ppm2 1.774 CV 1
ASSI { 2742}
( segid " " and resid 385 and name HE% )
(( segid " " and resid 382 and name HH2 ))
4.100 2.100 1.900 peak 2742 spectrum 1 weight 0.10000E+01 volume 0.11926E-02 ppm1 1.913 ppm2 7.169 CV 1
OR { 2742}
( segid " " and resid 385 and name HE% )
(( segid " " and resid 382 and name HE3 ))
ASSI { 3235}
(( segid " " and resid 289 and name HG2 ))
( segid " " and resid 306 and name HD2%)
4.900 3.000 1.100 peak 3235 spectrum 1 weight 0.10000E+01 volume 0.35809E-03 ppm1 2.338 ppm2 -0.357 CV 1
ASSI { 2364}
( segid " " and resid 225 and name HE% )
( segid " " and resid 220 and name HG2%)
2.400 0.700 0.700 peak 2364 spectrum 1 weight 0.10000E+01 volume 0.10830E-01 ppm1 1.913 ppm2 1.120 CV 1
OR { 2364}
( segid " " and resid 225 and name HE% )
( segid " " and resid 220 and name HG1%)
ASSI { 2968}
(( segid " " and resid 185 and name HB3 ))
( segid " " and resid 186 and name HD2%)
4.700 2.700 1.300 peak 2968 spectrum 1 weight 0.10000E+01 volume 0.17142E-02 ppm1 2.653 ppm2 0.794 CV 1
OR { 2968}
(( segid " " and resid 185 and name HB3 ))
( segid " " and resid 186 and name HD1%)
ASSI { 3445}
(( segid " " and resid 403 and name HG3 ))
(( segid " " and resid 403 and name HA ))
2.600 0.900 0.900 peak 3445 spectrum 1 weight 0.10000E+01 volume 0.29520E-02 ppm1 1.880 ppm2 4.083 CV 1
ASSI { 2081}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 279 and name H ))
4.400 2.500 1.600 peak 2081 spectrum 1 weight 0.10000E+01 volume 0.66538E-03 ppm1 0.377 ppm2 9.015 CV 1
ASSI { 1777}
(( segid " " and resid 202 and name HG3 ))
( segid " " and resid 198 and name HG1%)
4.000 2.000 2.000 peak 1777 spectrum 1 weight 0.10000E+01 volume 0.98399E-03 ppm1 2.773 ppm2 0.602 CV 1
OR { 1777}
(( segid " " and resid 202 and name HG3 ))
( segid " " and resid 198 and name HG2%)
ASSI { 972}
(( segid " " and resid 409 and name HA ))
( segid " " and resid 409 and name HD1%)
3.100 1.200 1.200 peak 972 spectrum 1 weight 0.10000E+01 volume 0.25770E-02 ppm1 3.691 ppm2 0.746 CV 1
OR { 972}
(( segid " " and resid 409 and name HA ))
( segid " " and resid 409 and name HD2%)
ASSI { 248}
( segid " " and resid 267 and name HD2%)
( segid " " and resid 231 and name HE% )
2.600 0.800 0.800 peak 248 spectrum 1 weight 0.10000E+01 volume 0.52104E-02 ppm1 0.907 ppm2 6.779 CV 1
OR { 248}
( segid " " and resid 267 and name HD2%)
( segid " " and resid 231 and name HD% )
ASSI { 2938}
(( segid " " and resid 351 and name HA ))
(( segid " " and resid 351 and name HB2 ))
2.800 1.000 1.000 peak 2938 spectrum 1 weight 0.10000E+01 volume 0.23373E-02 ppm1 3.826 ppm2 2.051 CV 1
OR { 2938}
(( segid " " and resid 351 and name HA ))
(( segid " " and resid 351 and name HG3 ))
ASSI { 1315}
(( segid " " and resid 440 and name HE3 ))
(( segid " " and resid 440 and name HA ))
4.000 2.000 2.000 peak 1315 spectrum 1 weight 0.10000E+01 volume 0.11081E-02 ppm1 2.733 ppm2 3.776 CV 1
ASSI { 3681}
(( segid " " and resid 228 and name HB3 ))
(( segid " " and resid 228 and name H ))
3.400 1.500 1.500 peak 3681 spectrum 1 weight 0.10000E+01 volume 0.17368E-02 ppm1 1.978 ppm2 8.437 CV 1
ASSI { 3672}
(( segid " " and resid 276 and name HG2 ))
(( segid " " and resid 281 and name H ))
4.500 2.600 1.500 peak 3672 spectrum 1 weight 0.10000E+01 volume 0.71333E-03 ppm1 2.367 ppm2 9.158 CV 1
ASSI { 3351}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 284 and name H ))
2.100 2.100 3.900 peak 3351 spectrum 1 weight 0.10000E+01 volume 0.44323E-02 ppm1 2.151 ppm2 8.101 CV 1
ASSI { 3485}
(( segid " " and resid 308 and name HD2 ))
(( segid " " and resid 308 and name HB2 ))
2.400 0.700 0.700 peak 3485 spectrum 1 weight 0.10000E+01 volume 0.19519E-01 ppm1 1.530 ppm2 1.824 CV 1
OR { 3485}
(( segid " " and resid 308 and name HD2 ))
(( segid " " and resid 308 and name HB3 ))
OR { 3485}
(( segid " " and resid 308 and name HD3 ))
(( segid " " and resid 308 and name HB2 ))
OR { 3485}
(( segid " " and resid 308 and name HD3 ))
(( segid " " and resid 308 and name HB3 ))
ASSI { 3240}
( segid " " and resid 357 and name HD1%)
(( segid " " and resid 360 and name HB3 ))
4.500 2.500 1.500 peak 3240 spectrum 1 weight 0.10000E+01 volume 0.67948E-03 ppm1 0.676 ppm2 3.078 CV 1
ASSI { 4729}
(( segid " " and resid 391 and name HB3 ))
(( segid " " and resid 391 and name HA ))
3.500 1.500 1.500 peak 4729 spectrum 1 weight 0.10000E+01 volume 0.29323E-03 ppm1 1.493 ppm2 4.377 CV 1
ASSI { 3766}
( segid " " and resid 362 and name HG2%)
(( segid " " and resid 359 and name HA ))
3.600 1.600 1.600 peak 3766 spectrum 1 weight 0.10000E+01 volume 0.10489E-02 ppm1 0.561 ppm2 3.314 CV 1
ASSI { 3162}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 328 and name HA ))
2.300 0.700 0.700 peak 3162 spectrum 1 weight 0.10000E+01 volume 0.46717E-02 ppm1 1.914 ppm2 3.450 CV 1
ASSI { 853}
(( segid " " and resid 253 and name HB ))
( segid " " and resid 247 and name HE% )
4.200 2.200 1.800 peak 853 spectrum 1 weight 0.10000E+01 volume 0.59208E-03 ppm1 3.520 ppm2 6.482 CV 1
ASSI { 3371}
(( segid " " and resid 308 and name HG2 ))
(( segid " " and resid 308 and name HA ))
3.000 1.100 1.100 peak 3371 spectrum 1 weight 0.10000E+01 volume 0.49058E-02 ppm1 1.546 ppm2 3.969 CV 1
ASSI { 3361}
(( segid " " and resid 430 and name HH2 ))
(( segid " " and resid 430 and name HE1 ))
5.700 4.000 0.300 peak 3361 spectrum 1 weight 0.10000E+01 volume 0.36652E-03 ppm1 6.981 ppm2 10.069 CV 1
ASSI { 1864}
( segid " " and resid 328 and name HG2%)
( segid " " and resid 231 and name HE% )
2.900 1.000 1.000 peak 1864 spectrum 1 weight 0.10000E+01 volume 0.21851E-02 ppm1 0.758 ppm2 6.776 CV 1
OR { 1864}
( segid " " and resid 328 and name HG2%)
( segid " " and resid 231 and name HD% )
ASSI { 183}
( segid " " and resid 189 and name HG2%)
( segid " " and resid 190 and name HD% )
3.700 1.700 1.700 peak 183 spectrum 1 weight 0.10000E+01 volume 0.10630E-02 ppm1 0.941 ppm2 7.854 CV 1
ASSI { 149}
( segid " " and resid 364 and name HG1%)
( segid " " and resid 368 and name HE% )
4.700 2.800 1.300 peak 149 spectrum 1 weight 0.10000E+01 volume 0.94736E-03 ppm1 1.056 ppm2 6.747 CV 1
ASSI { 1018}
(( segid " " and resid 418 and name HA3 ))
(( segid " " and resid 417 and name HB3 ))
4.200 2.200 1.800 peak 1018 spectrum 1 weight 0.10000E+01 volume 0.51315E-03 ppm1 3.992 ppm2 2.073 CV 1
ASSI { 880}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 342 and name HG13))
3.600 1.600 1.600 peak 880 spectrum 1 weight 0.10000E+01 volume 0.25742E-02 ppm1 1.802 ppm2 1.293 CV 1
ASSI { 4636}
( segid " " and resid 364 and name HG2%)
(( segid " " and resid 364 and name H ))
3.100 1.200 1.200 peak 4636 spectrum 1 weight 0.10000E+01 volume 0.52048E-02 ppm1 0.907 ppm2 7.496 CV 1
ASSI { 3175}
( segid " " and resid 190 and name HD% )
(( segid " " and resid 189 and name HB ))
3.600 1.600 1.600 peak 3175 spectrum 1 weight 0.10000E+01 volume 0.40600E-03 ppm1 7.873 ppm2 2.178 CV 1
ASSI { 112}
( segid " " and resid 307 and name HD2%)
( segid " " and resid 367 and name HD1%)
3.400 1.500 1.500 peak 112 spectrum 1 weight 0.10000E+01 volume 0.52866E-02 ppm1 1.028 ppm2 0.672 CV 1
ASSI { 3474}
( segid " " and resid 230 and name HD1%)
(( segid " " and resid 224 and name H ))
3.000 3.000 3.000 peak 3474 spectrum 1 weight 0.10000E+01 volume 0.43703E-03 ppm1 0.651 ppm2 9.055 CV 1
ASSI { 3133}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 330 and name H ))
3.400 1.400 1.400 peak 3133 spectrum 1 weight 0.10000E+01 volume 0.22528E-02 ppm1 0.747 ppm2 8.627 CV 1
ASSI { 3523}
( segid " " and resid 372 and name HG1%)
(( segid " " and resid 375 and name H ))
4.700 2.700 1.300 peak 3523 spectrum 1 weight 0.10000E+01 volume 0.10798E-02 ppm1 0.643 ppm2 8.469 CV 1
ASSI { 2933}
( segid " " and resid 329 and name HD1%)
(( segid " " and resid 326 and name HA ))
3.900 1.900 1.900 peak 2933 spectrum 1 weight 0.10000E+01 volume 0.17001E-02 ppm1 0.117 ppm2 4.410 CV 1
ASSI { 1700}
(( segid " " and resid 317 and name HA ))
(( segid " " and resid 317 and name HB2 ))
3.400 1.400 1.400 peak 1700 spectrum 1 weight 0.10000E+01 volume 0.38344E-03 ppm1 3.147 ppm2 1.351 CV 1
ASSI { 1924}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 199 and name H ))
4.100 2.100 1.900 peak 1924 spectrum 1 weight 0.10000E+01 volume 0.14464E-02 ppm1 0.623 ppm2 7.766 CV 1
ASSI { 3818}
(( segid " " and resid 302 and name HG3 ))
(( segid " " and resid 302 and name HA ))
2.900 1.000 1.000 peak 3818 spectrum 1 weight 0.10000E+01 volume 0.17848E-02 ppm1 2.077 ppm2 4.322 CV 1
ASSI { 2551}
( segid " " and resid 420 and name HG2%)
(( segid " " and resid 420 and name HB ))
1.700 0.400 0.500 peak 2551 spectrum 1 weight 0.10000E+01 volume 0.30690E-01 ppm1 0.806 ppm2 1.765 CV 1
ASSI { 3099}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 320 and name HD1 ))
2.800 1.000 1.000 peak 3099 spectrum 1 weight 0.10000E+01 volume 0.25093E-02 ppm1 0.366 ppm2 7.238 CV 1
ASSI { 1163}
(( segid " " and resid 297 and name HB ))
(( segid " " and resid 298 and name HG3 ))
3.500 1.600 1.600 peak 1163 spectrum 1 weight 0.10000E+01 volume 0.15169E-02 ppm1 3.943 ppm2 2.165 CV 1
OR { 1163}
(( segid " " and resid 297 and name HB ))
(( segid " " and resid 298 and name HG2 ))
ASSI { 1100}
( segid " " and resid 192 and name HG2%)
(( segid " " and resid 196 and name HB3 ))
4.600 2.600 1.400 peak 1100 spectrum 1 weight 0.10000E+01 volume 0.79227E-03 ppm1 0.693 ppm2 2.741 CV 1
ASSI { 4233}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 225 and name HG3 ))
2.500 0.800 0.800 peak 4233 spectrum 1 weight 0.10000E+01 volume 0.62988E-02 ppm1 1.914 ppm2 2.688 CV 1
ASSI { 3106}
(( segid " " and resid 244 and name HE2 ))
(( segid " " and resid 244 and name HA ))
4.600 2.700 1.400 peak 3106 spectrum 1 weight 0.10000E+01 volume 0.36370E-03 ppm1 2.556 ppm2 3.264 CV 1
ASSI { 185}
( segid " " and resid 186 and name HD1%)
(( segid " " and resid 187 and name H ))
3.800 1.800 1.800 peak 185 spectrum 1 weight 0.10000E+01 volume 0.35273E-02 ppm1 0.775 ppm2 8.514 CV 1
ASSI { 2755}
( segid " " and resid 438 and name HB% )
(( segid " " and resid 382 and name HZ3 ))
3.000 1.100 1.100 peak 2755 spectrum 1 weight 0.10000E+01 volume 0.22838E-02 ppm1 1.599 ppm2 6.865 CV 1
ASSI { 1267}
( segid " " and resid 437 and name HG2%)
(( segid " " and resid 439 and name H ))
5.300 3.400 0.700 peak 1267 spectrum 1 weight 0.10000E+01 volume 0.47084E-03 ppm1 1.184 ppm2 8.766 CV 1
ASSI { 4619}
(( segid " " and resid 285 and name HB2 ))
(( segid " " and resid 285 and name HA ))
3.100 1.200 1.200 peak 4619 spectrum 1 weight 0.10000E+01 volume 0.29943E-02 ppm1 2.305 ppm2 4.350 CV 1
ASSI { 1345}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 233 and name H ))
2.700 2.700 3.300 peak 1345 spectrum 1 weight 0.10000E+01 volume 0.90223E-03 ppm1 1.004 ppm2 7.989 CV 1
ASSI { 2019}
( segid " " and resid 388 and name HE% )
( segid " " and resid 390 and name HG2%)
3.200 1.300 1.300 peak 2019 spectrum 1 weight 0.10000E+01 volume 0.38739E-02 ppm1 1.847 ppm2 1.079 CV 1
ASSI { 3259}
(( segid " " and resid 208 and name HG2 ))
(( segid " " and resid 208 and name H ))
3.000 1.100 1.100 peak 3259 spectrum 1 weight 0.10000E+01 volume 0.29379E-02 ppm1 0.746 ppm2 8.269 CV 1
OR { 3259}
(( segid " " and resid 208 and name HG3 ))
(( segid " " and resid 208 and name H ))
ASSI { 3927}
( segid " " and resid 376 and name HG1%)
( segid " " and resid 203 and name HE% )
2.500 0.800 0.800 peak 3927 spectrum 1 weight 0.10000E+01 volume 0.92931E-02 ppm1 0.957 ppm2 2.219 CV 1
ASSI { 1801}
( segid " " and resid 207 and name HD1%)
( segid " " and resid 209 and name HD2%)
3.300 1.300 1.300 peak 1801 spectrum 1 weight 0.10000E+01 volume 0.18186E-02 ppm1 0.884 ppm2 -0.907 CV 1
ASSI { 4501}
( segid " " and resid 255 and name HD1%)
( segid " " and resid 247 and name HE% )
3.200 1.300 1.300 peak 4501 spectrum 1 weight 0.10000E+01 volume 0.22556E-02 ppm1 0.599 ppm2 6.467 CV 1
ASSI { 3862}
( segid " " and resid 267 and name HD1%)
(( segid " " and resid 267 and name H ))
4.000 2.000 2.000 peak 3862 spectrum 1 weight 0.10000E+01 volume 0.25883E-02 ppm1 0.915 ppm2 8.053 CV 1
ASSI { 4755}
(( segid " " and resid 404 and name HB2 ))
(( segid " " and resid 404 and name HG3 ))
2.700 0.900 0.900 peak 4755 spectrum 1 weight 0.10000E+01 volume 0.30902E-02 ppm1 1.844 ppm2 1.384 CV 1
OR { 4755}
(( segid " " and resid 404 and name HB3 ))
(( segid " " and resid 404 and name HG3 ))
ASSI { 1996}
( segid " " and resid 372 and name HG1%)
(( segid " " and resid 372 and name HA ))
2.800 1.000 1.000 peak 1996 spectrum 1 weight 0.10000E+01 volume 0.12059E-01 ppm1 0.644 ppm2 3.804 CV 1
ASSI { 3113}
( segid " " and resid 211 and name HB% )
(( segid " " and resid 211 and name H ))
2.700 0.900 0.900 peak 3113 spectrum 1 weight 0.10000E+01 volume 0.24332E-02 ppm1 1.692 ppm2 7.454 CV 1
ASSI { 3225}
( segid " " and resid 377 and name HE% )
( segid " " and resid 409 and name HD1%)
3.500 3.500 2.500 peak 3225 spectrum 1 weight 0.10000E+01 volume 0.33270E-02 ppm1 1.992 ppm2 0.755 CV 1
OR { 3225}
( segid " " and resid 377 and name HE% )
( segid " " and resid 409 and name HD2%)
ASSI { 2125}
( segid " " and resid 439 and name HD1%)
(( segid " " and resid 439 and name HA ))
3.400 1.500 1.500 peak 2125 spectrum 1 weight 0.10000E+01 volume 0.12349E-02 ppm1 0.816 ppm2 3.836 CV 1
ASSI { 2271}
(( segid " " and resid 217 and name HG13))
(( segid " " and resid 217 and name HB ))
3.400 1.500 1.500 peak 2271 spectrum 1 weight 0.10000E+01 volume 0.86560E-03 ppm1 0.469 ppm2 1.631 CV 1
ASSI { 2288}
( segid " " and resid 236 and name HD1%)
(( segid " " and resid 239 and name HE2 ))
3.400 1.500 1.500 peak 2288 spectrum 1 weight 0.10000E+01 volume 0.35471E-02 ppm1 0.832 ppm2 2.928 CV 1
OR { 2288}
( segid " " and resid 236 and name HD1%)
(( segid " " and resid 239 and name HE3 ))
ASSI { 1983}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 350 and name HA ))
3.700 1.700 1.700 peak 1983 spectrum 1 weight 0.10000E+01 volume 0.15733E-02 ppm1 0.729 ppm2 4.561 CV 1
ASSI { 2337}
(( segid " " and resid 320 and name HZ2 ))
(( segid " " and resid 320 and name HH2 ))
2.500 0.800 0.800 peak 2337 spectrum 1 weight 0.10000E+01 volume 0.28139E-02 ppm1 7.381 ppm2 7.126 CV 1
ASSI { 3355}
(( segid " " and resid 216 and name HA ))
(( segid " " and resid 216 and name HB2 ))
3.700 1.700 1.700 peak 3355 spectrum 1 weight 0.10000E+01 volume 0.54135E-03 ppm1 3.883 ppm2 2.318 CV 1
ASSI { 255}
( segid " " and resid 367 and name HD2%)
( segid " " and resid 359 and name HG2%)
2.300 2.300 3.700 peak 255 spectrum 1 weight 0.10000E+01 volume 0.21823E-02 ppm1 0.779 ppm2 -0.454 CV 1
ASSI { 3156}
( segid " " and resid 357 and name HD2%)
(( segid " " and resid 358 and name H ))
4.600 2.700 1.400 peak 3156 spectrum 1 weight 0.10000E+01 volume 0.69923E-03 ppm1 0.874 ppm2 8.566 CV 1
ASSI { 2168}
( segid " " and resid 192 and name HG2%)
(( segid " " and resid 192 and name HA ))
2.700 0.900 0.900 peak 2168 spectrum 1 weight 0.10000E+01 volume 0.24417E-02 ppm1 0.684 ppm2 4.846 CV 1
ASSI { 3827}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 368 and name HE% )
4.500 2.600 1.500 peak 3827 spectrum 1 weight 0.10000E+01 volume 0.21202E-02 ppm1 0.397 ppm2 6.751 CV 1
ASSI { 4198}
(( segid " " and resid 368 and name HA ))
(( segid " " and resid 368 and name HB3 ))
3.000 1.200 1.200 peak 4198 spectrum 1 weight 0.10000E+01 volume 0.62029E-03 ppm1 5.171 ppm2 2.669 CV 1
ASSI { 3417}
( segid " " and resid 284 and name HE% )
( segid " " and resid 279 and name HD2%)
1.800 0.400 0.400 peak 3417 spectrum 1 weight 0.10000E+01 volume 0.14940E-01 ppm1 2.151 ppm2 0.376 CV 1
ASSI { 946}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 279 and name H ))
4.500 2.500 1.500 peak 946 spectrum 1 weight 0.10000E+01 volume 0.98963E-03 ppm1 0.603 ppm2 9.011 CV 1
ASSI { 2421}
(( segid " " and resid 375 and name HG3 ))
(( segid " " and resid 375 and name HA ))
4.000 2.000 2.000 peak 2421 spectrum 1 weight 0.10000E+01 volume 0.10996E-02 ppm1 2.267 ppm2 4.693 CV 1
ASSI { 3644}
(( segid " " and resid 367 and name HB3 ))
( segid " " and resid 367 and name HD1%)
4.300 2.300 1.700 peak 3644 spectrum 1 weight 0.10000E+01 volume 0.67102E-03 ppm1 0.011 ppm2 0.671 CV 1
ASSI { 3888}
(( segid " " and resid 444 and name HB3 ))
(( segid " " and resid 444 and name HD2 ))
2.500 0.800 0.800 peak 3888 spectrum 1 weight 0.10000E+01 volume 0.51794E-02 ppm1 1.759 ppm2 3.147 CV 1
OR { 3888}
(( segid " " and resid 444 and name HB3 ))
(( segid " " and resid 444 and name HD3 ))
ASSI { 4563}
( segid " " and resid 356 and name HG1%)
(( segid " " and resid 356 and name HA ))
2.400 0.700 0.700 peak 4563 spectrum 1 weight 0.10000E+01 volume 0.41672E-02 ppm1 0.786 ppm2 3.613 CV 1
ASSI { 4785}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 322 and name HA ))
2.200 0.600 0.600 peak 4785 spectrum 1 weight 0.10000E+01 volume 0.54051E-02 ppm1 -0.166 ppm2 3.376 CV 1
ASSI { 1974}
(( segid " " and resid 367 and name HA ))
(( segid " " and resid 368 and name H ))
4.000 2.000 2.000 peak 1974 spectrum 1 weight 0.10000E+01 volume 0.63157E-03 ppm1 4.022 ppm2 8.183 CV 1
ASSI { 4108}
( segid " " and resid 194 and name HD1%)
(( segid " " and resid 194 and name HA ))
2.800 1.000 1.000 peak 4108 spectrum 1 weight 0.10000E+01 volume 0.33524E-02 ppm1 0.745 ppm2 3.803 CV 1
ASSI { 458}
(( segid " " and resid 374 and name HB3 ))
(( segid " " and resid 374 and name HB2 ))
1.800 0.400 0.400 peak 458 spectrum 1 weight 0.10000E+01 volume 0.66905E-02 ppm1 1.786 ppm2 1.626 CV 1
OR { 458}
(( segid " " and resid 374 and name HB3 ))
(( segid " " and resid 374 and name HD3 ))
OR { 458}
(( segid " " and resid 374 and name HB3 ))
(( segid " " and resid 374 and name HD2 ))
ASSI { 3038}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 323 and name HB ))
2.200 0.600 0.600 peak 3038 spectrum 1 weight 0.10000E+01 volume 0.41870E-02 ppm1 0.436 ppm2 1.736 CV 1
ASSI { 3158}
(( segid " " and resid 366 and name HG2 ))
( segid " " and resid 300 and name HG1%)
4.100 2.100 1.900 peak 3158 spectrum 1 weight 0.10000E+01 volume 0.89659E-03 ppm1 2.277 ppm2 0.068 CV 1
ASSI { 3978}
(( segid " " and resid 213 and name HA ))
( segid " " and resid 213 and name HD% )
3.700 1.700 1.700 peak 3978 spectrum 1 weight 0.10000E+01 volume 0.66260E-03 ppm1 3.590 ppm2 6.690 CV 1
ASSI { 4584}
(( segid " " and resid 309 and name HG2 ))
(( segid " " and resid 310 and name H ))
3.700 1.700 1.700 peak 4584 spectrum 1 weight 0.10000E+01 volume 0.22302E-02 ppm1 2.300 ppm2 7.076 CV 1
ASSI { 4137}
(( segid " " and resid 234 and name HB2 ))
(( segid " " and resid 234 and name HA ))
3.100 1.200 1.200 peak 4137 spectrum 1 weight 0.10000E+01 volume 0.20893E-02 ppm1 3.780 ppm2 4.173 CV 1
ASSI { 4511}
( segid " " and resid 283 and name HD1%)
(( segid " " and resid 283 and name H ))
2.900 1.000 1.000 peak 4511 spectrum 1 weight 0.10000E+01 volume 0.33524E-02 ppm1 0.716 ppm2 7.314 CV 1
ASSI { 3520}
( segid " " and resid 223 and name HE% )
(( segid " " and resid 222 and name HB2 ))
3.300 1.400 1.400 peak 3520 spectrum 1 weight 0.10000E+01 volume 0.24078E-02 ppm1 6.643 ppm2 1.268 CV 1
OR { 3520}
( segid " " and resid 223 and name HE% )
(( segid " " and resid 222 and name HD3 ))
ASSI { 592}
(( segid " " and resid 368 and name HB2 ))
(( segid " " and resid 371 and name HB ))
4.000 2.000 2.000 peak 592 spectrum 1 weight 0.10000E+01 volume 0.30732E-03 ppm1 3.281 ppm2 1.909 CV 1
ASSI { 3199}
( segid " " and resid 373 and name HD2%)
(( segid " " and resid 324 and name H ))
3.300 1.400 1.400 peak 3199 spectrum 1 weight 0.10000E+01 volume 0.17565E-02 ppm1 0.515 ppm2 8.490 CV 1
ASSI { 2182}
( segid " " and resid 360 and name HD% )
(( segid " " and resid 360 and name HB3 ))
3.700 1.700 1.700 peak 2182 spectrum 1 weight 0.10000E+01 volume 0.43703E-03 ppm1 7.077 ppm2 3.073 CV 1
ASSI { 2087}
( segid " " and resid 223 and name HD% )
(( segid " " and resid 222 and name HB3 ))
3.600 1.600 1.600 peak 2087 spectrum 1 weight 0.10000E+01 volume 0.68230E-03 ppm1 6.436 ppm2 0.804 CV 1
ASSI { 3443}
( segid " " and resid 189 and name HG2%)
(( segid " " and resid 189 and name HA ))
2.900 1.000 1.000 peak 3443 spectrum 1 weight 0.10000E+01 volume 0.21033E-02 ppm1 0.940 ppm2 4.370 CV 1
ASSI { 3096}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 301 and name H ))
3.800 1.800 1.800 peak 3096 spectrum 1 weight 0.10000E+01 volume 0.27518E-02 ppm1 0.076 ppm2 8.041 CV 1
ASSI { 1146}
( segid " " and resid 258 and name HE% )
(( segid " " and resid 255 and name HA ))
4.500 2.600 1.500 peak 1146 spectrum 1 weight 0.10000E+01 volume 0.52443E-03 ppm1 6.644 ppm2 3.976 CV 1
ASSI { 4753}
(( segid " " and resid 406 and name HG3 ))
(( segid " " and resid 407 and name H ))
5.000 3.200 1.000 peak 4753 spectrum 1 weight 0.10000E+01 volume 0.44549E-03 ppm1 2.100 ppm2 7.802 CV 1
ASSI { 2706}
(( segid " " and resid 444 and name HB3 ))
(( segid " " and resid 444 and name H ))
3.400 1.500 1.500 peak 2706 spectrum 1 weight 0.10000E+01 volume 0.37019E-02 ppm1 1.758 ppm2 7.762 CV 1
ASSI { 1544}
(( segid " " and resid 304 and name HG2 ))
(( segid " " and resid 307 and name HB3 ))
3.700 1.700 1.700 peak 1544 spectrum 1 weight 0.10000E+01 volume 0.20469E-02 ppm1 2.445 ppm2 1.624 CV 1
OR { 1544}
(( segid " " and resid 304 and name HG2 ))
(( segid " " and resid 307 and name HB2 ))
ASSI { 2339}
(( segid " " and resid 377 and name HB3 ))
(( segid " " and resid 377 and name HA ))
3.600 1.600 1.600 peak 2339 spectrum 1 weight 0.10000E+01 volume 0.39754E-03 ppm1 1.929 ppm2 4.661 CV 1
ASSI { 3713}
(( segid " " and resid 351 and name HA ))
(( segid " " and resid 351 and name HB3 ))
2.900 1.000 1.000 peak 3713 spectrum 1 weight 0.10000E+01 volume 0.24163E-02 ppm1 3.828 ppm2 2.188 CV 1
OR { 3713}
(( segid " " and resid 351 and name HA ))
(( segid " " and resid 351 and name HG2 ))
ASSI { 1417}
( segid " " and resid 295 and name HG2%)
(( segid " " and resid 298 and name HG3 ))
3.900 1.900 1.900 peak 1417 spectrum 1 weight 0.10000E+01 volume 0.31776E-02 ppm1 1.184 ppm2 2.169 CV 1
OR { 1417}
( segid " " and resid 295 and name HG2%)
(( segid " " and resid 298 and name HG2 ))
ASSI { 2122}
( segid " " and resid 323 and name HG2%)
( segid " " and resid 323 and name HG1%)
2.100 0.500 0.500 peak 2122 spectrum 1 weight 0.10000E+01 volume 0.12913E-01 ppm1 0.436 ppm2 0.771 CV 1
ASSI { 3597}
(( segid " " and resid 281 and name HG2 ))
(( segid " " and resid 282 and name H ))
3.300 1.300 1.300 peak 3597 spectrum 1 weight 0.10000E+01 volume 0.35640E-02 ppm1 1.405 ppm2 8.693 CV 1
OR { 3597}
(( segid " " and resid 281 and name HG3 ))
(( segid " " and resid 282 and name H ))
ASSI { 2417}
( segid " " and resid 390 and name HG2%)
(( segid " " and resid 390 and name HB ))
2.000 0.500 0.500 peak 2417 spectrum 1 weight 0.10000E+01 volume 0.30284E-01 ppm1 1.077 ppm2 3.863 CV 1
OR { 2417}
( segid " " and resid 390 and name HG2%)
(( segid " " and resid 390 and name HA ))
ASSI { 119}
( segid " " and resid 317 and name HD2%)
( segid " " and resid 217 and name HD1%)
4.300 2.300 1.700 peak 119 spectrum 1 weight 0.10000E+01 volume 0.10742E-02 ppm1 0.343 ppm2 -0.031 CV 1
ASSI { 4323}
( segid " " and resid 346 and name HD2%)
(( segid " " and resid 346 and name H ))
3.600 1.600 1.600 peak 4323 spectrum 1 weight 0.10000E+01 volume 0.32452E-02 ppm1 0.749 ppm2 8.990 CV 1
ASSI { 4396}
(( segid " " and resid 374 and name HB3 ))
(( segid " " and resid 375 and name H ))
3.800 1.800 1.800 peak 4396 spectrum 1 weight 0.10000E+01 volume 0.62029E-03 ppm1 1.787 ppm2 8.467 CV 1
ASSI { 2618}
( segid " " and resid 446 and name HB% )
(( segid " " and resid 395 and name HB2 ))
3.500 1.500 1.500 peak 2618 spectrum 1 weight 0.10000E+01 volume 0.15084E-02 ppm1 1.267 ppm2 2.058 CV 1
OR { 2618}
( segid " " and resid 446 and name HB% )
(( segid " " and resid 395 and name HB3 ))
ASSI { 4090}
(( segid " " and resid 421 and name HG2 ))
(( segid " " and resid 421 and name H ))
4.100 2.100 1.900 peak 4090 spectrum 1 weight 0.10000E+01 volume 0.95582E-03 ppm1 1.285 ppm2 8.377 CV 1
ASSI { 395}
( segid " " and resid 236 and name HG2%)
(( segid " " and resid 239 and name HE2 ))
3.600 1.600 1.600 peak 395 spectrum 1 weight 0.10000E+01 volume 0.24276E-02 ppm1 0.961 ppm2 2.922 CV 1
OR { 395}
( segid " " and resid 236 and name HG2%)
(( segid " " and resid 239 and name HE3 ))
ASSI { 126}
(( segid " " and resid 388 and name HB3 ))
(( segid " " and resid 388 and name HG2 ))
3.400 1.400 1.400 peak 126 spectrum 1 weight 0.10000E+01 volume 0.10855E-02 ppm1 1.370 ppm2 1.827 CV 1
OR { 126}
(( segid " " and resid 388 and name HB3 ))
( segid " " and resid 388 and name HE% )
ASSI { 2440}
(( segid " " and resid 192 and name HG12))
( segid " " and resid 192 and name HG2%)
2.500 0.800 0.800 peak 2440 spectrum 1 weight 0.10000E+01 volume 0.38175E-02 ppm1 1.362 ppm2 0.654 CV 1
ASSI { 2836}
( segid " " and resid 436 and name HD1%)
(( segid " " and resid 406 and name HG2 ))
3.400 1.400 1.400 peak 2836 spectrum 1 weight 0.10000E+01 volume 0.21118E-02 ppm1 1.011 ppm2 2.576 CV 1
ASSI { 3636}
(( segid " " and resid 333 and name HB3 ))
(( segid " " and resid 334 and name H ))
2.900 1.100 1.100 peak 3636 spectrum 1 weight 0.10000E+01 volume 0.18496E-02 ppm1 1.504 ppm2 8.119 CV 1
ASSI { 2201}
( segid " " and resid 372 and name HG1%)
( segid " " and resid 373 and name HD1%)
4.100 2.100 1.900 peak 2201 spectrum 1 weight 0.10000E+01 volume 0.17735E-02 ppm1 0.646 ppm2 -0.177 CV 1
ASSI { 1965}
(( segid " " and resid 229 and name HA2 ))
(( segid " " and resid 229 and name HA3 ))
2.300 0.700 0.700 peak 1965 spectrum 1 weight 0.10000E+01 volume 0.19849E-02 ppm1 3.783 ppm2 3.991 CV 1
ASSI { 3277}
(( segid " " and resid 354 and name HB2 ))
(( segid " " and resid 354 and name HA ))
2.800 1.000 1.000 peak 3277 spectrum 1 weight 0.10000E+01 volume 0.14746E-02 ppm1 2.738 ppm2 4.168 CV 1
ASSI { 20}
(( segid " " and resid 368 and name HA ))
( segid " " and resid 368 and name HE% )
5.500 3.800 0.500 peak 20 spectrum 1 weight 0.10000E+01 volume 0.36934E-03 ppm1 5.165 ppm2 6.747 CV 1
ASSI { 1316}
( segid " " and resid 307 and name HD2%)
(( segid " " and resid 368 and name HZ ))
3.200 1.300 1.300 peak 1316 spectrum 1 weight 0.10000E+01 volume 0.90505E-03 ppm1 1.032 ppm2 6.291 CV 1
ASSI { 929}
(( segid " " and resid 348 and name HD3 ))
(( segid " " and resid 346 and name HB3 ))
4.800 2.900 1.200 peak 929 spectrum 1 weight 0.10000E+01 volume 0.58080E-03 ppm1 3.751 ppm2 1.493 CV 1
ASSI { 202}
( segid " " and resid 358 and name HE% )
(( segid " " and resid 358 and name H ))
5.900 4.300 0.100 peak 202 spectrum 1 weight 0.10000E+01 volume 0.60619E-03 ppm1 6.701 ppm2 8.552 CV 1
ASSI { 2135}
(( segid " " and resid 308 and name HG3 ))
(( segid " " and resid 308 and name HE2 ))
2.200 0.600 0.600 peak 2135 spectrum 1 weight 0.10000E+01 volume 0.80637E-02 ppm1 1.380 ppm2 2.873 CV 1
OR { 2135}
(( segid " " and resid 308 and name HG3 ))
(( segid " " and resid 308 and name HE3 ))
ASSI { 2737}
(( segid " " and resid 253 and name HB ))
(( segid " " and resid 253 and name HA ))
2.600 0.800 0.800 peak 2737 spectrum 1 weight 0.10000E+01 volume 0.34201E-02 ppm1 3.522 ppm2 4.152 CV 1
ASSI { 299}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 338 and name HA ))
3.700 1.700 1.700 peak 299 spectrum 1 weight 0.10000E+01 volume 0.14577E-02 ppm1 0.749 ppm2 4.622 CV 1
ASSI { 4287}
(( segid " " and resid 293 and name HD2 ))
(( segid " " and resid 293 and name HE ))
3.600 1.600 1.600 peak 4287 spectrum 1 weight 0.10000E+01 volume 0.43985E-03 ppm1 3.074 ppm2 7.815 CV 1
ASSI { 3969}
(( segid " " and resid 367 and name HA ))
(( segid " " and resid 367 and name HB2 ))
3.300 1.300 1.300 peak 3969 spectrum 1 weight 0.10000E+01 volume 0.12716E-02 ppm1 4.019 ppm2 1.028 CV 1
ASSI { 2094}
( segid " " and resid 391 and name HD2%)
(( segid " " and resid 388 and name HG3 ))
2.500 2.500 3.500 peak 2094 spectrum 1 weight 0.10000E+01 volume 0.14859E-02 ppm1 0.532 ppm2 2.269 CV 1
ASSI { 1425}
(( segid " " and resid 239 and name HD3 ))
(( segid " " and resid 242 and name HB2 ))
3.200 1.300 1.300 peak 1425 spectrum 1 weight 0.10000E+01 volume 0.22866E-02 ppm1 1.683 ppm2 2.214 CV 1
OR { 1425}
(( segid " " and resid 239 and name HD3 ))
(( segid " " and resid 242 and name HB3 ))
OR { 1425}
(( segid " " and resid 239 and name HD3 ))
(( segid " " and resid 242 and name HG2 ))
ASSI { 1492}
( segid " " and resid 357 and name HD2%)
(( segid " " and resid 347 and name HA ))
3.000 1.100 1.100 peak 1492 spectrum 1 weight 0.10000E+01 volume 0.69923E-03 ppm1 0.870 ppm2 4.617 CV 1
ASSI { 3074}
(( segid " " and resid 189 and name HB ))
(( segid " " and resid 189 and name HG12))
3.000 1.100 1.100 peak 3074 spectrum 1 weight 0.10000E+01 volume 0.88813E-03 ppm1 2.197 ppm2 1.710 CV 1
OR { 3074}
(( segid " " and resid 189 and name HB ))
(( segid " " and resid 189 and name HG13))
ASSI { 4596}
(( segid " " and resid 279 and name HG ))
( segid " " and resid 279 and name HD1%)
2.800 1.000 1.000 peak 4596 spectrum 1 weight 0.10000E+01 volume 0.10996E-02 ppm1 1.426 ppm2 0.170 CV 1
ASSI { 1639}
(( segid " " and resid 293 and name HD3 ))
(( segid " " and resid 298 and name HG2 ))
4.400 2.400 1.600 peak 1639 spectrum 1 weight 0.10000E+01 volume 0.10883E-02 ppm1 3.166 ppm2 2.185 CV 1
OR { 1639}
(( segid " " and resid 293 and name HD3 ))
(( segid " " and resid 298 and name HG3 ))
ASSI { 2332}
( segid " " and resid 416 and name HD2%)
(( segid " " and resid 416 and name HA ))
3.000 1.100 1.100 peak 2332 spectrum 1 weight 0.10000E+01 volume 0.37667E-02 ppm1 0.699 ppm2 4.252 CV 1
ASSI { 3231}
(( segid " " and resid 305 and name HD2 ))
( segid " " and resid 306 and name HD1%)
2.100 0.600 0.600 peak 3231 spectrum 1 weight 0.10000E+01 volume 0.39275E-02 ppm1 3.146 ppm2 0.379 CV 1
ASSI { 2117}
( segid " " and resid 243 and name HD1%)
(( segid " " and resid 267 and name H ))
5.400 3.700 0.600 peak 2117 spectrum 1 weight 0.10000E+01 volume 0.35809E-03 ppm1 0.024 ppm2 8.051 CV 1
ASSI { 2704}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 319 and name H ))
2.100 0.600 0.600 peak 2704 spectrum 1 weight 0.10000E+01 volume 0.55489E-02 ppm1 0.348 ppm2 7.849 CV 1
ASSI { 4482}
(( segid " " and resid 430 and name HE3 ))
(( segid " " and resid 427 and name HG2 ))
4.700 2.800 1.300 peak 4482 spectrum 1 weight 0.10000E+01 volume 0.42857E-03 ppm1 7.538 ppm2 2.205 CV 1
ASSI { 2748}
(( segid " " and resid 276 and name HG2 ))
(( segid " " and resid 276 and name HB2 ))
2.300 0.700 0.700 peak 2748 spectrum 1 weight 0.10000E+01 volume 0.91154E-02 ppm1 2.361 ppm2 1.815 CV 1
OR { 2748}
(( segid " " and resid 276 and name HG2 ))
(( segid " " and resid 276 and name HB3 ))
ASSI { 2070}
(( segid " " and resid 313 and name HA ))
(( segid " " and resid 313 and name HB2 ))
3.800 1.800 1.800 peak 2070 spectrum 1 weight 0.10000E+01 volume 0.40883E-03 ppm1 4.389 ppm2 2.876 CV 1
OR { 2070}
(( segid " " and resid 313 and name HA ))
(( segid " " and resid 313 and name HB3 ))
ASSI { 2620}
(( segid " " and resid 279 and name HG ))
(( segid " " and resid 279 and name HA ))
4.300 2.300 1.700 peak 2620 spectrum 1 weight 0.10000E+01 volume 0.54699E-03 ppm1 1.419 ppm2 4.302 CV 1
ASSI { 259}
(( segid " " and resid 415 and name HB3 ))
( segid " " and resid 416 and name HD1%)
3.800 1.800 1.800 peak 259 spectrum 1 weight 0.10000E+01 volume 0.10291E-02 ppm1 2.588 ppm2 0.868 CV 1
ASSI { 3901}
(( segid " " and resid 227 and name HB3 ))
(( segid " " and resid 230 and name HB ))
2.700 0.900 0.900 peak 3901 spectrum 1 weight 0.10000E+01 volume 0.87402E-03 ppm1 2.823 ppm2 1.811 CV 1
ASSI { 4282}
(( segid " " and resid 302 and name HA ))
(( segid " " and resid 305 and name HB2 ))
2.900 1.100 1.100 peak 4282 spectrum 1 weight 0.10000E+01 volume 0.17650E-02 ppm1 4.312 ppm2 1.869 CV 1
OR { 4282}
(( segid " " and resid 302 and name HA ))
(( segid " " and resid 305 and name HB3 ))
ASSI { 1671}
(( segid " " and resid 186 and name HG ))
( segid " " and resid 186 and name HD1%)
1.900 0.400 0.400 peak 1671 spectrum 1 weight 0.10000E+01 volume 0.28096E-01 ppm1 1.502 ppm2 0.793 CV 1
OR { 1671}
(( segid " " and resid 186 and name HG ))
( segid " " and resid 186 and name HD2%)
ASSI { 3860}
(( segid " " and resid 369 and name HA2 ))
(( segid " " and resid 369 and name HA3 ))
2.200 0.600 0.600 peak 3860 spectrum 1 weight 0.10000E+01 volume 0.26080E-02 ppm1 3.845 ppm2 3.969 CV 1
ASSI { 3327}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 374 and name H ))
3.800 1.800 1.800 peak 3327 spectrum 1 weight 0.10000E+01 volume 0.19003E-02 ppm1 0.884 ppm2 6.325 CV 1
ASSI { 2556}
( segid " " and resid 371 and name HG1%)
( segid " " and resid 373 and name HD1%)
2.800 1.000 1.000 peak 2556 spectrum 1 weight 0.10000E+01 volume 0.47987E-02 ppm1 0.364 ppm2 -0.194 CV 1
ASSI { 2178}
( segid " " and resid 352 and name HG2%)
(( segid " " and resid 352 and name H ))
3.500 1.500 1.500 peak 2178 spectrum 1 weight 0.10000E+01 volume 0.35075E-02 ppm1 0.922 ppm2 7.073 CV 1
ASSI { 2382}
( segid " " and resid 230 and name HD1%)
(( segid " " and resid 231 and name H ))
2.700 0.900 0.900 peak 2382 spectrum 1 weight 0.10000E+01 volume 0.27039E-02 ppm1 0.650 ppm2 8.439 CV 1
ASSI { 3033}
(( segid " " and resid 393 and name HA ))
(( segid " " and resid 393 and name H ))
3.600 1.700 1.700 peak 3033 spectrum 1 weight 0.10000E+01 volume 0.63721E-03 ppm1 4.278 ppm2 8.240 CV 1
ASSI { 2931}
(( segid " " and resid 314 and name HB2 ))
(( segid " " and resid 314 and name HA ))
3.700 1.700 1.700 peak 2931 spectrum 1 weight 0.10000E+01 volume 0.53289E-03 ppm1 2.829 ppm2 3.869 CV 1
ASSI { 4817}
( segid " " and resid 271 and name HD1%)
(( segid " " and resid 271 and name H ))
3.600 1.600 1.600 peak 4817 spectrum 1 weight 0.10000E+01 volume 0.31296E-02 ppm1 0.842 ppm2 7.703 CV 1
ASSI { 3315}
( segid " " and resid 307 and name HD2%)
( segid " " and resid 307 and name HD1%)
2.400 0.700 0.700 peak 3315 spectrum 1 weight 0.10000E+01 volume 0.81145E-02 ppm1 1.029 ppm2 1.213 CV 1
ASSI { 3573}
(( segid " " and resid 195 and name HA ))
( segid " " and resid 198 and name HG2%)
3.300 1.300 1.300 peak 3573 spectrum 1 weight 0.10000E+01 volume 0.24332E-02 ppm1 3.894 ppm2 0.616 CV 1
OR { 3573}
(( segid " " and resid 195 and name HA ))
( segid " " and resid 198 and name HG1%)
ASSI { 2884}
(( segid " " and resid 241 and name HB2 ))
(( segid " " and resid 241 and name HA ))
3.500 1.500 1.500 peak 2884 spectrum 1 weight 0.10000E+01 volume 0.11024E-02 ppm1 2.458 ppm2 4.124 CV 1
ASSI { 2918}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 343 and name H ))
4.800 2.900 1.200 peak 2918 spectrum 1 weight 0.10000E+01 volume 0.10489E-02 ppm1 0.658 ppm2 8.181 CV 1
ASSI { 1792}
( segid " " and resid 346 and name HD1%)
(( segid " " and resid 325 and name HG2 ))
2.400 0.700 0.700 peak 1792 spectrum 1 weight 0.10000E+01 volume 0.41052E-02 ppm1 0.840 ppm2 2.420 CV 1
ASSI { 3045}
( segid " " and resid 243 and name HD1%)
(( segid " " and resid 243 and name HG ))
2.200 0.600 0.600 peak 3045 spectrum 1 weight 0.10000E+01 volume 0.70374E-02 ppm1 0.012 ppm2 1.105 CV 1
ASSI { 3366}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 352 and name HA ))
4.200 2.200 1.800 peak 3366 spectrum 1 weight 0.10000E+01 volume 0.17509E-02 ppm1 0.603 ppm2 4.155 CV 1
ASSI { 2765}
( segid " " and resid 432 and name HG1%)
(( segid " " and resid 432 and name H ))
2.900 1.100 1.100 peak 2765 spectrum 1 weight 0.10000E+01 volume 0.25545E-02 ppm1 1.092 ppm2 8.469 CV 1
OR { 2765}
( segid " " and resid 432 and name HG2%)
(( segid " " and resid 432 and name H ))
ASSI { 1979}
(( segid " " and resid 332 and name HG3 ))
(( segid " " and resid 332 and name HB3 ))
3.100 1.200 1.200 peak 1979 spectrum 1 weight 0.10000E+01 volume 0.10686E-02 ppm1 1.978 ppm2 2.627 CV 1
ASSI { 2611}
(( segid " " and resid 242 and name HA ))
(( segid " " and resid 242 and name HB3 ))
2.200 0.600 0.600 peak 2611 spectrum 1 weight 0.10000E+01 volume 0.11591E-01 ppm1 3.994 ppm2 2.202 CV 1
OR { 2611}
(( segid " " and resid 242 and name HA ))
(( segid " " and resid 242 and name HB2 ))
ASSI { 2873}
( segid " " and resid 279 and name HD2%)
( segid " " and resid 287 and name HD% )
4.300 2.300 1.700 peak 2873 spectrum 1 weight 0.10000E+01 volume 0.90787E-03 ppm1 0.373 ppm2 6.345 CV 1
ASSI { 652}
(( segid " " and resid 359 and name HB ))
( segid " " and resid 303 and name HE% )
5.400 3.700 0.600 peak 652 spectrum 1 weight 0.10000E+01 volume 0.40600E-03 ppm1 1.599 ppm2 6.811 CV 1
ASSI { 1682}
(( segid " " and resid 438 and name HA ))
(( segid " " and resid 441 and name HD3 ))
3.500 1.500 1.500 peak 1682 spectrum 1 weight 0.10000E+01 volume 0.88813E-03 ppm1 4.090 ppm2 3.130 CV 1
OR { 1682}
(( segid " " and resid 438 and name HA ))
(( segid " " and resid 441 and name HD2 ))
ASSI { 4420}
(( segid " " and resid 373 and name HB2 ))
( segid " " and resid 373 and name HD1%)
4.400 2.400 1.600 peak 4420 spectrum 1 weight 0.10000E+01 volume 0.55827E-03 ppm1 0.419 ppm2 -0.185 CV 1
ASSI { 2992}
(( segid " " and resid 404 and name HA ))
(( segid " " and resid 404 and name HB3 ))
3.600 1.700 1.700 peak 2992 spectrum 1 weight 0.10000E+01 volume 0.42011E-03 ppm1 3.445 ppm2 1.820 CV 1
OR { 2992}
(( segid " " and resid 404 and name HA ))
(( segid " " and resid 404 and name HB2 ))
ASSI { 4118}
( segid " " and resid 333 and name HD1%)
(( segid " " and resid 333 and name H ))
3.000 1.100 1.100 peak 4118 spectrum 1 weight 0.10000E+01 volume 0.87910E-02 ppm1 0.878 ppm2 8.638 CV 1
ASSI { 3659}
(( segid " " and resid 243 and name HG ))
( segid " " and resid 243 and name HD2%)
2.700 0.900 0.900 peak 3659 spectrum 1 weight 0.10000E+01 volume 0.19624E-02 ppm1 1.130 ppm2 0.162 CV 1
ASSI { 2002}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 368 and name HZ ))
5.300 3.500 0.700 peak 2002 spectrum 1 weight 0.10000E+01 volume 0.48494E-03 ppm1 0.379 ppm2 6.281 CV 1
ASSI { 2960}
( segid " " and resid 364 and name HG1%)
(( segid " " and resid 365 and name H ))
1.800 0.400 0.400 peak 2960 spectrum 1 weight 0.10000E+01 volume 0.71248E-02 ppm1 1.060 ppm2 8.356 CV 1
ASSI { 2940}
( segid " " and resid 233 and name HG1%)
(( segid " " and resid 261 and name HD22))
3.300 1.400 1.400 peak 2940 spectrum 1 weight 0.10000E+01 volume 0.33636E-02 ppm1 0.868 ppm2 6.623 CV 1
ASSI { 2764}
(( segid " " and resid 263 and name HA ))
( segid " " and resid 263 and name HG1%)
3.000 1.100 1.100 peak 2764 spectrum 1 weight 0.10000E+01 volume 0.17058E-02 ppm1 3.166 ppm2 0.056 CV 1
ASSI { 3374}
( segid " " and resid 346 and name HD1%)
(( segid " " and resid 361 and name HZ ))
3.200 1.300 1.300 peak 3374 spectrum 1 weight 0.10000E+01 volume 0.29435E-02 ppm1 0.834 ppm2 6.631 CV 1
ASSI { 38}
( segid " " and resid 359 and name HG2%)
(( segid " " and resid 362 and name HB ))
4.200 2.200 1.800 peak 38 spectrum 1 weight 0.10000E+01 volume 0.11447E-02 ppm1 -0.459 ppm2 3.785 CV 1
ASSI { 2766}
(( segid " " and resid 302 and name HG3 ))
(( segid " " and resid 302 and name HG2 ))
1.600 0.300 0.600 peak 2766 spectrum 1 weight 0.10000E+01 volume 0.11284E-01 ppm1 2.076 ppm2 2.269 CV 1
ASSI { 2643}
(( segid " " and resid 357 and name HG ))
(( segid " " and resid 357 and name H ))
4.600 2.700 1.400 peak 2643 spectrum 1 weight 0.10000E+01 volume 0.41729E-03 ppm1 1.794 ppm2 8.139 CV 1
ASSI { 2841}
(( segid " " and resid 272 and name HG3 ))
(( segid " " and resid 272 and name H ))
2.400 0.700 0.700 peak 2841 spectrum 1 weight 0.10000E+01 volume 0.41616E-02 ppm1 1.800 ppm2 8.499 CV 1
OR { 2841}
(( segid " " and resid 272 and name HG2 ))
(( segid " " and resid 272 and name H ))
ASSI { 3151}
(( segid " " and resid 419 and name HA2 ))
(( segid " " and resid 420 and name HB ))
5.500 3.700 0.500 peak 3151 spectrum 1 weight 0.10000E+01 volume 0.45677E-03 ppm1 3.773 ppm2 1.765 CV 1
ASSI { 3543}
( segid " " and resid 364 and name HG1%)
(( segid " " and resid 364 and name HB ))
1.600 0.300 0.600 peak 3543 spectrum 1 weight 0.10000E+01 volume 0.14464E-01 ppm1 1.060 ppm2 2.123 CV 1
ASSI { 2336}
(( segid " " and resid 222 and name HE2 ))
(( segid " " and resid 222 and name HD3 ))
1.900 0.400 0.400 peak 2336 spectrum 1 weight 0.10000E+01 volume 0.24166E-01 ppm1 2.682 ppm2 1.280 CV 1
OR { 2336}
(( segid " " and resid 222 and name HE3 ))
(( segid " " and resid 222 and name HD2 ))
OR { 2336}
(( segid " " and resid 222 and name HE2 ))
(( segid " " and resid 222 and name HD2 ))
OR { 2336}
(( segid " " and resid 222 and name HE3 ))
(( segid " " and resid 222 and name HD3 ))
ASSI { 3473}
(( segid " " and resid 331 and name HB3 ))
(( segid " " and resid 331 and name HA ))
3.300 1.400 1.400 peak 3473 spectrum 1 weight 0.10000E+01 volume 0.27913E-03 ppm1 2.571 ppm2 4.533 CV 1
ASSI { 1631}
(( segid " " and resid 409 and name HG ))
(( segid " " and resid 413 and name HD2 ))
3.700 1.700 1.700 peak 1631 spectrum 1 weight 0.10000E+01 volume 0.81765E-03 ppm1 1.402 ppm2 6.798 CV 1
ASSI { 3221}
(( segid " " and resid 436 and name HB2 ))
(( segid " " and resid 433 and name HA ))
3.900 1.900 1.900 peak 3221 spectrum 1 weight 0.10000E+01 volume 0.57798E-03 ppm1 1.418 ppm2 4.005 CV 1
ASSI { 1089}
( segid " " and resid 359 and name HG2%)
(( segid " " and resid 356 and name HA ))
5.600 3.900 0.400 peak 1089 spectrum 1 weight 0.10000E+01 volume 0.51597E-03 ppm1 -0.463 ppm2 3.630 CV 1
ASSI { 3936}
(( segid " " and resid 256 and name HB2 ))
( segid " " and resid 219 and name HE% )
5.800 4.200 0.200 peak 3936 spectrum 1 weight 0.10000E+01 volume 0.45959E-03 ppm1 2.027 ppm2 6.394 CV 1
ASSI { 3338}
(( segid " " and resid 407 and name HB2 ))
( segid " " and resid 407 and name HD% )
3.500 1.500 1.500 peak 3338 spectrum 1 weight 0.10000E+01 volume 0.42575E-03 ppm1 3.277 ppm2 7.318 CV 1
ASSI { 2343}
(( segid " " and resid 413 and name HD2 ))
(( segid " " and resid 413 and name HB2 ))
3.600 1.600 1.600 peak 2343 spectrum 1 weight 0.10000E+01 volume 0.42575E-03 ppm1 6.795 ppm2 3.071 CV 1
ASSI { 4740}
( segid " " and resid 446 and name HB% )
(( segid " " and resid 444 and name HD3 ))
2.700 2.700 3.300 peak 4740 spectrum 1 weight 0.10000E+01 volume 0.94172E-03 ppm1 1.267 ppm2 3.139 CV 1
ASSI { 2328}
(( segid " " and resid 205 and name HA ))
(( segid " " and resid 205 and name HB2 ))
3.600 1.600 1.600 peak 2328 spectrum 1 weight 0.10000E+01 volume 0.10122E-02 ppm1 3.810 ppm2 2.725 CV 1
ASSI { 1522}
(( segid " " and resid 444 and name HD3 ))
(( segid " " and resid 444 and name HG2 ))
1.700 0.400 0.500 peak 1522 spectrum 1 weight 0.10000E+01 volume 0.43424E-01 ppm1 3.149 ppm2 1.631 CV 1
OR { 1522}
(( segid " " and resid 444 and name HD2 ))
(( segid " " and resid 444 and name HG3 ))
OR { 1522}
(( segid " " and resid 444 and name HD2 ))
(( segid " " and resid 444 and name HG2 ))
OR { 1522}
(( segid " " and resid 444 and name HD3 ))
(( segid " " and resid 444 and name HG3 ))
ASSI { 2377}
(( segid " " and resid 308 and name HA ))
(( segid " " and resid 308 and name HB2 ))
2.300 0.600 0.600 peak 2377 spectrum 1 weight 0.10000E+01 volume 0.60619E-02 ppm1 3.971 ppm2 1.832 CV 1
OR { 2377}
(( segid " " and resid 308 and name HA ))
(( segid " " and resid 308 and name HB3 ))
ASSI { 2552}
(( segid " " and resid 293 and name HD2 ))
(( segid " " and resid 290 and name HA ))
4.200 2.200 1.800 peak 2552 spectrum 1 weight 0.10000E+01 volume 0.69641E-03 ppm1 3.077 ppm2 4.035 CV 1
ASSI { 3853}
(( segid " " and resid 302 and name HG3 ))
( segid " " and resid 306 and name HD1%)
3.700 1.700 1.700 peak 3853 spectrum 1 weight 0.10000E+01 volume 0.82047E-03 ppm1 2.079 ppm2 0.383 CV 1
ASSI { 3094}
( segid " " and resid 345 and name HG1%)
( segid " " and resid 342 and name HG2%)
4.100 2.100 1.900 peak 3094 spectrum 1 weight 0.10000E+01 volume 0.23176E-02 ppm1 1.009 ppm2 0.520 CV 1
ASSI { 4306}
( segid " " and resid 253 and name HG2%)
( segid " " and resid 247 and name HE% )
2.900 1.000 1.000 peak 4306 spectrum 1 weight 0.10000E+01 volume 0.35018E-02 ppm1 0.616 ppm2 6.476 CV 1
ASSI { 4353}
(( segid " " and resid 258 and name HB3 ))
( segid " " and resid 258 and name HD% )
3.600 1.600 1.600 peak 4353 spectrum 1 weight 0.10000E+01 volume 0.40883E-03 ppm1 2.688 ppm2 7.091 CV 1
OR { 4353}
(( segid " " and resid 258 and name HB2 ))
( segid " " and resid 258 and name HD% )
ASSI { 3052}
(( segid " " and resid 296 and name HA ))
( segid " " and resid 300 and name HG1%)
5.100 3.200 0.900 peak 3052 spectrum 1 weight 0.10000E+01 volume 0.27349E-03 ppm1 3.760 ppm2 0.060 CV 1
ASSI { 4704}
( segid " " and resid 189 and name HD1%)
(( segid " " and resid 189 and name HG13))
2.300 0.700 0.700 peak 4704 spectrum 1 weight 0.10000E+01 volume 0.47648E-02 ppm1 0.736 ppm2 1.695 CV 1
OR { 4704}
( segid " " and resid 189 and name HD1%)
(( segid " " and resid 189 and name HG12))
ASSI { 3292}
(( segid " " and resid 287 and name HA ))
(( segid " " and resid 287 and name HB2 ))
3.900 1.900 1.900 peak 3292 spectrum 1 weight 0.10000E+01 volume 0.44831E-03 ppm1 3.483 ppm2 3.036 CV 1
ASSI { 4271}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 199 and name H ))
4.300 2.300 1.700 peak 4271 spectrum 1 weight 0.10000E+01 volume 0.12293E-02 ppm1 1.459 ppm2 7.753 CV 1
ASSI { 3912}
(( segid " " and resid 283 and name HB2 ))
( segid " " and resid 283 and name HD1%)
4.000 2.000 2.000 peak 3912 spectrum 1 weight 0.10000E+01 volume 0.80637E-03 ppm1 2.324 ppm2 0.722 CV 1
ASSI { 4657}
(( segid " " and resid 429 and name HB2 ))
(( segid " " and resid 429 and name H ))
3.000 1.100 1.100 peak 4657 spectrum 1 weight 0.10000E+01 volume 0.71051E-03 ppm1 1.417 ppm2 8.103 CV 1
ASSI { 3765}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 314 and name HA ))
2.800 0.900 0.900 peak 3765 spectrum 1 weight 0.10000E+01 volume 0.29520E-02 ppm1 0.553 ppm2 3.836 CV 1
ASSI { 2020}
(( segid " " and resid 351 and name HG3 ))
(( segid " " and resid 352 and name H ))
4.400 2.400 1.600 peak 2020 spectrum 1 weight 0.10000E+01 volume 0.95018E-03 ppm1 2.066 ppm2 7.047 CV 1
ASSI { 1413}
(( segid " " and resid 210 and name HD3 ))
( segid " " and resid 198 and name HG2%)
3.300 1.300 1.300 peak 1413 spectrum 1 weight 0.10000E+01 volume 0.64003E-03 ppm1 2.890 ppm2 0.622 CV 1
OR { 1413}
(( segid " " and resid 210 and name HD3 ))
( segid " " and resid 198 and name HG1%)
ASSI { 3049}
(( segid " " and resid 351 and name HB3 ))
(( segid " " and resid 277 and name HD22))
4.200 2.200 1.800 peak 3049 spectrum 1 weight 0.10000E+01 volume 0.33552E-03 ppm1 2.096 ppm2 6.114 CV 1
ASSI { 3180}
(( segid " " and resid 403 and name HG2 ))
( segid " " and resid 407 and name HE% )
3.000 1.100 1.100 peak 3180 spectrum 1 weight 0.10000E+01 volume 0.98963E-03 ppm1 1.616 ppm2 6.866 CV 1
ASSI { 3428}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 398 and name HA ))
4.100 2.100 1.900 peak 3428 spectrum 1 weight 0.10000E+01 volume 0.18355E-02 ppm1 0.557 ppm2 3.428 CV 1
ASSI { 4055}
(( segid " " and resid 417 and name HG3 ))
(( segid " " and resid 417 and name H ))
3.200 1.300 1.300 peak 4055 spectrum 1 weight 0.10000E+01 volume 0.58814E-02 ppm1 2.367 ppm2 7.768 CV 1
OR { 4055}
(( segid " " and resid 417 and name HG2 ))
(( segid " " and resid 417 and name H ))
ASSI { 3570}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 207 and name HA ))
4.300 2.300 1.700 peak 3570 spectrum 1 weight 0.10000E+01 volume 0.34059E-02 ppm1 0.884 ppm2 3.777 CV 1
ASSI { 3615}
(( segid " " and resid 409 and name HA ))
(( segid " " and resid 409 and name HB2 ))
3.300 1.400 1.400 peak 3615 spectrum 1 weight 0.10000E+01 volume 0.59773E-03 ppm1 3.693 ppm2 1.625 CV 1
ASSI { 4652}
( segid " " and resid 202 and name HE% )
(( segid " " and resid 205 and name H ))
5.800 4.100 0.200 peak 4652 spectrum 1 weight 0.10000E+01 volume 0.62875E-03 ppm1 1.869 ppm2 6.381 CV 1
ASSI { 4449}
(( segid " " and resid 292 and name HA3 ))
(( segid " " and resid 293 and name H ))
4.400 2.500 1.600 peak 4449 spectrum 1 weight 0.10000E+01 volume 0.48212E-03 ppm1 4.193 ppm2 6.998 CV 1
ASSI { 4730}
(( segid " " and resid 219 and name HA ))
(( segid " " and resid 219 and name HB3 ))
3.400 1.400 1.400 peak 4730 spectrum 1 weight 0.10000E+01 volume 0.69923E-03 ppm1 4.131 ppm2 3.181 CV 1
OR { 4730}
(( segid " " and resid 219 and name HA ))
(( segid " " and resid 219 and name HB2 ))
ASSI { 4683}
(( segid " " and resid 186 and name HG ))
(( segid " " and resid 187 and name H ))
5.100 3.300 0.900 peak 4683 spectrum 1 weight 0.10000E+01 volume 0.14774E-02 ppm1 1.500 ppm2 8.513 CV 1
ASSI { 118}
( segid " " and resid 361 and name HE% )
(( segid " " and resid 325 and name HG2 ))
4.200 2.200 1.800 peak 118 spectrum 1 weight 0.10000E+01 volume 0.69641E-03 ppm1 7.054 ppm2 2.410 CV 1
ASSI { 104}
(( segid " " and resid 333 and name HB2 ))
(( segid " " and resid 334 and name HG2 ))
4.000 2.000 2.000 peak 104 spectrum 1 weight 0.10000E+01 volume 0.22415E-02 ppm1 1.619 ppm2 2.170 CV 1
OR { 104}
(( segid " " and resid 333 and name HB2 ))
(( segid " " and resid 334 and name HG3 ))
ASSI { 480}
( segid " " and resid 420 and name HG2%)
(( segid " " and resid 420 and name HG13))
2.700 0.900 0.900 peak 480 spectrum 1 weight 0.10000E+01 volume 0.17802E-01 ppm1 0.806 ppm2 1.386 CV 1
ASSI { 3140}
( segid " " and resid 420 and name HD1%)
(( segid " " and resid 421 and name H ))
2.500 2.500 3.500 peak 3140 spectrum 1 weight 0.10000E+01 volume 0.14492E-02 ppm1 0.770 ppm2 8.375 CV 1
ASSI { 4593}
( segid " " and resid 198 and name HG1%)
(( segid " " and resid 198 and name H ))
3.800 1.800 1.800 peak 4593 spectrum 1 weight 0.10000E+01 volume 0.22105E-02 ppm1 0.604 ppm2 8.598 CV 1
ASSI { 3865}
(( segid " " and resid 271 and name HA ))
(( segid " " and resid 271 and name H ))
3.600 1.600 1.600 peak 3865 spectrum 1 weight 0.10000E+01 volume 0.43421E-03 ppm1 3.670 ppm2 7.681 CV 1
ASSI { 2156}
(( segid " " and resid 352 and name HG13))
(( segid " " and resid 352 and name H ))
2.900 1.000 1.000 peak 2156 spectrum 1 weight 0.10000E+01 volume 0.10178E-02 ppm1 1.608 ppm2 7.000 CV 1
ASSI { 3907}
( segid " " and resid 189 and name HG2%)
(( segid " " and resid 189 and name HG12))
2.600 0.900 0.900 peak 3907 spectrum 1 weight 0.10000E+01 volume 0.48381E-02 ppm1 0.933 ppm2 1.683 CV 1
OR { 3907}
( segid " " and resid 189 and name HG2%)
(( segid " " and resid 189 and name HG13))
ASSI { 1667}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 409 and name HA ))
2.600 0.800 0.800 peak 1667 spectrum 1 weight 0.10000E+01 volume 0.52951E-02 ppm1 0.781 ppm2 3.679 CV 1
ASSI { 4206}
(( segid " " and resid 305 and name HG2 ))
( segid " " and resid 306 and name HD2%)
4.900 3.000 1.100 peak 4206 spectrum 1 weight 0.10000E+01 volume 0.78381E-03 ppm1 1.657 ppm2 -0.354 CV 1
ASSI { 971}
(( segid " " and resid 419 and name HA3 ))
( segid " " and resid 420 and name HD1%)
5.400 3.600 0.600 peak 971 spectrum 1 weight 0.10000E+01 volume 0.68512E-03 ppm1 3.989 ppm2 0.797 CV 1
OR { 971}
(( segid " " and resid 419 and name HA3 ))
( segid " " and resid 420 and name HG2%)
ASSI { 3498}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 320 and name HE1 ))
3.600 1.600 1.600 peak 3498 spectrum 1 weight 0.10000E+01 volume 0.15169E-02 ppm1 0.886 ppm2 10.111 CV 1
ASSI { 1031}
(( segid " " and resid 333 and name HB3 ))
(( segid " " and resid 334 and name HA ))
3.800 1.800 1.800 peak 1031 spectrum 1 weight 0.10000E+01 volume 0.78945E-03 ppm1 1.503 ppm2 4.421 CV 1
ASSI { 4119}
(( segid " " and resid 219 and name HA ))
( segid " " and resid 223 and name HE% )
5.000 3.100 1.000 peak 4119 spectrum 1 weight 0.10000E+01 volume 0.43703E-03 ppm1 4.138 ppm2 6.648 CV 1
ASSI { 2969}
( segid " " and resid 211 and name HB% )
(( segid " " and resid 201 and name HA ))
4.800 2.900 1.200 peak 2969 spectrum 1 weight 0.10000E+01 volume 0.37498E-03 ppm1 1.690 ppm2 4.925 CV 1
ASSI { 2495}
( segid " " and resid 372 and name HG2%)
(( segid " " and resid 372 and name H ))
3.000 1.100 1.100 peak 2495 spectrum 1 weight 0.10000E+01 volume 0.10421E-01 ppm1 0.745 ppm2 7.911 CV 1
ASSI { 747}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 317 and name HA ))
2.800 1.000 1.000 peak 747 spectrum 1 weight 0.10000E+01 volume 0.16522E-02 ppm1 0.189 ppm2 3.129 CV 1
ASSI { 3132}
(( segid " " and resid 379 and name HD3 ))
(( segid " " and resid 378 and name HG3 ))
3.100 3.100 2.900 peak 3132 spectrum 1 weight 0.10000E+01 volume 0.36652E-03 ppm1 3.839 ppm2 1.401 CV 1
ASSI { 3525}
(( segid " " and resid 382 and name HZ2 ))
(( segid " " and resid 382 and name HH2 ))
3.000 1.200 1.200 peak 3525 spectrum 1 weight 0.10000E+01 volume 0.18214E-02 ppm1 7.466 ppm2 7.167 CV 1
ASSI { 2653}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 279 and name HG ))
2.200 0.600 0.600 peak 2653 spectrum 1 weight 0.10000E+01 volume 0.64990E-02 ppm1 0.168 ppm2 1.414 CV 1
OR { 2653}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 279 and name HB3 ))
ASSI { 1478}
( segid " " and resid 376 and name HG2%)
(( segid " " and resid 377 and name HA ))
4.000 2.000 2.000 peak 1478 spectrum 1 weight 0.10000E+01 volume 0.85432E-03 ppm1 0.893 ppm2 4.687 CV 1
ASSI { 4539}
( segid " " and resid 352 and name HG2%)
( segid " " and resid 279 and name HD1%)
5.000 3.200 1.000 peak 4539 spectrum 1 weight 0.10000E+01 volume 0.12688E-02 ppm1 0.921 ppm2 0.167 CV 1
ASSI { 3875}
( segid " " and resid 295 and name HG2%)
(( segid " " and resid 295 and name HB ))
2.100 0.600 0.600 peak 3875 spectrum 1 weight 0.10000E+01 volume 0.69189E-02 ppm1 1.183 ppm2 4.367 CV 1
ASSI { 4488}
(( segid " " and resid 226 and name HG2 ))
(( segid " " and resid 227 and name H ))
5.100 3.300 0.900 peak 4488 spectrum 1 weight 0.10000E+01 volume 0.58926E-03 ppm1 1.283 ppm2 7.129 CV 1
ASSI { 2677}
(( segid " " and resid 336 and name HE3 ))
(( segid " " and resid 336 and name HG2 ))
2.300 0.700 0.700 peak 2677 spectrum 1 weight 0.10000E+01 volume 0.12175E-01 ppm1 2.866 ppm2 1.166 CV 1
OR { 2677}
(( segid " " and resid 336 and name HE2 ))
(( segid " " and resid 336 and name HG2 ))
ASSI { 2715}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 306 and name HG ))
2.300 0.600 0.600 peak 2715 spectrum 1 weight 0.10000E+01 volume 0.33693E-02 ppm1 -0.358 ppm2 1.349 CV 1
ASSI { 3830}
(( segid " " and resid 206 and name HA3 ))
(( segid " " and resid 207 and name H ))
4.400 2.400 1.600 peak 3830 spectrum 1 weight 0.10000E+01 volume 0.33834E-03 ppm1 3.821 ppm2 6.906 CV 1
ASSI { 4654}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 345 and name HB ))
5.100 3.200 0.900 peak 4654 spectrum 1 weight 0.10000E+01 volume 0.62875E-03 ppm1 0.514 ppm2 2.127 CV 1
ASSI { 2681}
(( segid " " and resid 307 and name HB2 ))
(( segid " " and resid 308 and name H ))
3.600 1.600 1.600 peak 2681 spectrum 1 weight 0.10000E+01 volume 0.43985E-03 ppm1 1.589 ppm2 7.081 CV 1
ASSI { 2177}
( segid " " and resid 362 and name HG2%)
(( segid " " and resid 362 and name HB ))
2.400 0.700 0.700 peak 2177 spectrum 1 weight 0.10000E+01 volume 0.76829E-02 ppm1 0.562 ppm2 3.774 CV 1
ASSI { 2368}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 218 and name H ))
3.200 1.300 1.300 peak 2368 spectrum 1 weight 0.10000E+01 volume 0.14605E-02 ppm1 0.464 ppm2 7.959 CV 1
ASSI { 4079}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 346 and name H ))
5.400 3.700 0.600 peak 4079 spectrum 1 weight 0.10000E+01 volume 0.52725E-03 ppm1 0.653 ppm2 8.973 CV 1
ASSI { 3703}
(( segid " " and resid 351 and name HG3 ))
(( segid " " and resid 351 and name H ))
2.900 1.100 1.100 peak 3703 spectrum 1 weight 0.10000E+01 volume 0.20328E-02 ppm1 2.065 ppm2 7.877 CV 1
ASSI { 1933}
(( segid " " and resid 393 and name HA ))
(( segid " " and resid 393 and name HG2 ))
2.700 0.900 0.900 peak 1933 spectrum 1 weight 0.10000E+01 volume 0.35075E-02 ppm1 4.281 ppm2 2.134 CV 1
ASSI { 890}
( segid " " and resid 429 and name HD2%)
(( segid " " and resid 413 and name HA ))
2.800 1.000 1.000 peak 890 spectrum 1 weight 0.10000E+01 volume 0.27913E-02 ppm1 0.643 ppm2 4.196 CV 1
ASSI { 769}
(( segid " " and resid 302 and name HG3 ))
(( segid " " and resid 290 and name H ))
5.000 3.100 1.000 peak 769 spectrum 1 weight 0.10000E+01 volume 0.46520E-03 ppm1 2.072 ppm2 7.812 CV 1
ASSI { 2743}
(( segid " " and resid 344 and name HG13))
(( segid " " and resid 344 and name HA ))
2.800 0.900 0.900 peak 2743 spectrum 1 weight 0.10000E+01 volume 0.29633E-02 ppm1 1.220 ppm2 3.886 CV 1
ASSI { 2083}
(( segid " " and resid 226 and name HB3 ))
(( segid " " and resid 226 and name HA ))
2.500 0.800 0.800 peak 2083 spectrum 1 weight 0.10000E+01 volume 0.38795E-02 ppm1 1.959 ppm2 4.389 CV 1
ASSI { 4341}
(( segid " " and resid 268 and name HE3 ))
(( segid " " and resid 268 and name HG2 ))
2.700 0.900 0.900 peak 4341 spectrum 1 weight 0.10000E+01 volume 0.46802E-02 ppm1 3.229 ppm2 1.254 CV 1
OR { 4341}
(( segid " " and resid 268 and name HE2 ))
(( segid " " and resid 268 and name HG2 ))
OR { 4341}
(( segid " " and resid 268 and name HE2 ))
(( segid " " and resid 268 and name HG3 ))
OR { 4341}
(( segid " " and resid 268 and name HE3 ))
(( segid " " and resid 268 and name HG3 ))
ASSI { 2397}
(( segid " " and resid 239 and name HD3 ))
(( segid " " and resid 239 and name HA ))
2.900 1.000 1.000 peak 2397 spectrum 1 weight 0.10000E+01 volume 0.17706E-02 ppm1 1.686 ppm2 4.290 CV 1
ASSI { 3286}
(( segid " " and resid 435 and name HB ))
(( segid " " and resid 436 and name H ))
3.100 1.200 1.200 peak 3286 spectrum 1 weight 0.10000E+01 volume 0.51597E-03 ppm1 1.976 ppm2 8.912 CV 1
ASSI { 3917}
(( segid " " and resid 272 and name HD2 ))
(( segid " " and resid 269 and name HA ))
2.500 0.800 0.800 peak 3917 spectrum 1 weight 0.10000E+01 volume 0.32621E-02 ppm1 3.229 ppm2 3.822 CV 1
OR { 3917}
(( segid " " and resid 272 and name HD3 ))
(( segid " " and resid 269 and name HA ))
ASSI { 1477}
(( segid " " and resid 304 and name HG2 ))
(( segid " " and resid 305 and name H ))
4.900 3.000 1.100 peak 1477 spectrum 1 weight 0.10000E+01 volume 0.84868E-03 ppm1 2.461 ppm2 7.502 CV 1
ASSI { 1684}
(( segid " " and resid 367 and name HA ))
(( segid " " and resid 367 and name HB3 ))
3.400 1.400 1.400 peak 1684 spectrum 1 weight 0.10000E+01 volume 0.73307E-03 ppm1 4.018 ppm2 0.022 CV 1
ASSI { 2230}
( segid " " and resid 294 and name HG2%)
(( segid " " and resid 295 and name H ))
3.400 1.400 1.400 peak 2230 spectrum 1 weight 0.10000E+01 volume 0.36342E-02 ppm1 1.221 ppm2 7.383 CV 1
ASSI { 503}
( segid " " and resid 192 and name HG2%)
(( segid " " and resid 197 and name H ))
5.500 3.700 0.500 peak 503 spectrum 1 weight 0.10000E+01 volume 0.55827E-03 ppm1 0.678 ppm2 8.042 CV 1
ASSI { 4276}
(( segid " " and resid 361 and name HA ))
( segid " " and resid 361 and name HD% )
2.700 0.900 0.900 peak 4276 spectrum 1 weight 0.10000E+01 volume 0.14295E-02 ppm1 4.214 ppm2 7.143 CV 1
ASSI { 2847}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 339 and name HA ))
2.600 2.600 3.400 peak 2847 spectrum 1 weight 0.10000E+01 volume 0.10178E-02 ppm1 0.656 ppm2 2.984 CV 1
ASSI { 2782}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 217 and name HG12))
1.800 0.400 0.400 peak 2782 spectrum 1 weight 0.10000E+01 volume 0.27752E-01 ppm1 -0.047 ppm2 0.472 CV 1
OR { 2782}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 217 and name HG13))
OR { 2782}
( segid " " and resid 217 and name HD1%)
( segid " " and resid 217 and name HG2%)
ASSI { 4495}
( segid " " and resid 358 and name HE% )
(( segid " " and resid 358 and name HA ))
3.700 1.700 1.700 peak 4495 spectrum 1 weight 0.10000E+01 volume 0.21908E-02 ppm1 6.702 ppm2 4.012 CV 1
ASSI { 3064}
( segid " " and resid 362 and name HG2%)
(( segid " " and resid 362 and name H ))
2.600 0.800 0.800 peak 3064 spectrum 1 weight 0.10000E+01 volume 0.28759E-02 ppm1 0.563 ppm2 7.817 CV 1
ASSI { 1293}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 231 and name HB2 ))
3.300 1.300 1.300 peak 1293 spectrum 1 weight 0.10000E+01 volume 0.20328E-02 ppm1 1.007 ppm2 2.815 CV 1
OR { 1293}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 231 and name HB3 ))
ASSI { 2346}
(( segid " " and resid 272 and name HG3 ))
(( segid " " and resid 349 and name HA ))
2.600 0.800 0.800 peak 2346 spectrum 1 weight 0.10000E+01 volume 0.37244E-02 ppm1 1.798 ppm2 3.949 CV 1
ASSI { 4660}
(( segid " " and resid 239 and name HD2 ))
(( segid " " and resid 239 and name HA ))
3.600 1.700 1.700 peak 4660 spectrum 1 weight 0.10000E+01 volume 0.17876E-02 ppm1 1.751 ppm2 4.284 CV 1
ASSI { 3793}
(( segid " " and resid 239 and name HD3 ))
( segid " " and resid 258 and name HE% )
2.800 1.000 1.000 peak 3793 spectrum 1 weight 0.10000E+01 volume 0.12378E-02 ppm1 1.686 ppm2 6.636 CV 1
ASSI { 4589}
(( segid " " and resid 182 and name HD2 ))
( segid " " and resid 186 and name HD1%)
4.500 2.600 1.500 peak 4589 spectrum 1 weight 0.10000E+01 volume 0.31014E-03 ppm1 6.922 ppm2 0.782 CV 1
OR { 4589}
(( segid " " and resid 182 and name HD2 ))
( segid " " and resid 186 and name HD2%)
ASSI { 3611}
(( segid " " and resid 373 and name HB2 ))
(( segid " " and resid 373 and name HB3 ))
2.500 0.800 0.800 peak 3611 spectrum 1 weight 0.10000E+01 volume 0.52443E-03 ppm1 0.413 ppm2 1.339 CV 1
ASSI { 4194}
(( segid " " and resid 424 and name HB2 ))
(( segid " " and resid 424 and name H ))
2.700 0.900 0.900 peak 4194 spectrum 1 weight 0.10000E+01 volume 0.32678E-02 ppm1 3.902 ppm2 8.271 CV 1
ASSI { 3535}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 318 and name HA ))
2.900 1.100 1.100 peak 3535 spectrum 1 weight 0.10000E+01 volume 0.57291E-02 ppm1 0.349 ppm2 3.364 CV 1
ASSI { 2609}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 360 and name HZ ))
3.000 1.100 1.100 peak 2609 spectrum 1 weight 0.10000E+01 volume 0.15958E-02 ppm1 0.379 ppm2 6.612 CV 1
ASSI { 2391}
( segid " " and resid 368 and name HD% )
(( segid " " and resid 368 and name HB2 ))
3.100 1.200 1.200 peak 2391 spectrum 1 weight 0.10000E+01 volume 0.42011E-03 ppm1 7.156 ppm2 3.281 CV 1
ASSI { 2220}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 225 and name HG2 ))
2.100 0.600 0.600 peak 2220 spectrum 1 weight 0.10000E+01 volume 0.75648E-02 ppm1 1.913 ppm2 2.817 CV 1
ASSI { 2559}
(( segid " " and resid 425 and name HG3 ))
(( segid " " and resid 425 and name HB2 ))
2.600 0.800 0.800 peak 2559 spectrum 1 weight 0.10000E+01 volume 0.27151E-02 ppm1 1.238 ppm2 1.610 CV 1
OR { 2559}
(( segid " " and resid 425 and name HG3 ))
(( segid " " and resid 425 and name HD2 ))
OR { 2559}
(( segid " " and resid 425 and name HG3 ))
(( segid " " and resid 425 and name HD3 ))
ASSI { 418}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 332 and name H ))
4.200 2.200 1.800 peak 418 spectrum 1 weight 0.10000E+01 volume 0.13308E-02 ppm1 1.913 ppm2 7.405 CV 1
ASSI { 514}
(( segid " " and resid 392 and name HD3 ))
(( segid " " and resid 391 and name HA ))
2.900 1.000 1.000 peak 514 spectrum 1 weight 0.10000E+01 volume 0.77816E-03 ppm1 3.564 ppm2 4.361 CV 1
ASSI { 1585}
( segid " " and resid 344 and name HD1%)
(( segid " " and resid 341 and name HB2 ))
2.300 2.300 3.700 peak 1585 spectrum 1 weight 0.10000E+01 volume 0.24417E-02 ppm1 0.819 ppm2 2.804 CV 1
OR { 1585}
( segid " " and resid 344 and name HD1%)
(( segid " " and resid 341 and name HB3 ))
ASSI { 2085}
(( segid " " and resid 351 and name HB3 ))
(( segid " " and resid 277 and name HD21))
5.000 3.100 1.000 peak 2085 spectrum 1 weight 0.10000E+01 volume 0.30169E-03 ppm1 2.107 ppm2 7.630 CV 1
ASSI { 4149}
(( segid " " and resid 251 and name HB3 ))
(( segid " " and resid 252 and name H ))
3.900 1.900 1.900 peak 4149 spectrum 1 weight 0.10000E+01 volume 0.45113E-03 ppm1 1.597 ppm2 8.388 CV 1
ASSI { 4463}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 194 and name HG ))
2.500 0.800 0.800 peak 4463 spectrum 1 weight 0.10000E+01 volume 0.43111E-02 ppm1 0.553 ppm2 1.341 CV 1
ASSI { 1978}
(( segid " " and resid 253 and name HB ))
( segid " " and resid 243 and name HD2%)
3.000 1.100 1.100 peak 1978 spectrum 1 weight 0.10000E+01 volume 0.23740E-02 ppm1 3.524 ppm2 0.162 CV 1
ASSI { 4270}
( segid " " and resid 359 and name HG1%)
(( segid " " and resid 291 and name HA ))
3.000 1.100 1.100 peak 4270 spectrum 1 weight 0.10000E+01 volume 0.22415E-02 ppm1 0.888 ppm2 3.976 CV 1
ASSI { 3169}
( segid " " and resid 230 and name HD1%)
( segid " " and resid 231 and name HD% )
4.400 2.400 1.600 peak 3169 spectrum 1 weight 0.10000E+01 volume 0.15423E-02 ppm1 0.650 ppm2 6.775 CV 1
OR { 3169}
( segid " " and resid 230 and name HD1%)
( segid " " and resid 231 and name HE% )
ASSI { 1521}
(( segid " " and resid 418 and name HA2 ))
( segid " " and resid 420 and name HD1%)
6.000 4.500 0.000 peak 1521 spectrum 1 weight 0.10000E+01 volume 0.41165E-03 ppm1 3.914 ppm2 0.764 CV 1
OR { 1521}
(( segid " " and resid 418 and name HA2 ))
( segid " " and resid 420 and name HG2%)
ASSI { 4249}
(( segid " " and resid 242 and name HG2 ))
(( segid " " and resid 242 and name H ))
3.600 1.700 1.700 peak 4249 spectrum 1 weight 0.10000E+01 volume 0.40403E-02 ppm1 2.241 ppm2 7.539 CV 1
ASSI { 3706}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 216 and name H ))
4.300 2.300 1.700 peak 3706 spectrum 1 weight 0.10000E+01 volume 0.74435E-03 ppm1 -0.047 ppm2 7.640 CV 1
ASSI { 1656}
(( segid " " and resid 318 and name HB ))
(( segid " " and resid 317 and name H ))
4.900 3.000 1.100 peak 1656 spectrum 1 weight 0.10000E+01 volume 0.50187E-03 ppm1 1.355 ppm2 7.518 CV 1
ASSI { 2936}
(( segid " " and resid 430 and name HE3 ))
(( segid " " and resid 427 and name HA ))
4.100 2.100 1.900 peak 2936 spectrum 1 weight 0.10000E+01 volume 0.31578E-03 ppm1 7.540 ppm2 3.939 CV 1
ASSI { 281}
(( segid " " and resid 271 and name HG ))
( segid " " and resid 271 and name HD1%)
3.000 1.100 1.100 peak 281 spectrum 1 weight 0.10000E+01 volume 0.12519E-02 ppm1 2.168 ppm2 0.883 CV 1
ASSI { 2909}
(( segid " " and resid 222 and name HB2 ))
(( segid " " and resid 222 and name HE2 ))
3.800 1.800 1.800 peak 2909 spectrum 1 weight 0.10000E+01 volume 0.90787E-03 ppm1 1.205 ppm2 2.681 CV 1
OR { 2909}
(( segid " " and resid 222 and name HB2 ))
(( segid " " and resid 222 and name HE3 ))
ASSI { 804}
( segid " " and resid 339 and name HG2%)
(( segid " " and resid 361 and name HA ))
4.700 2.800 1.300 peak 804 spectrum 1 weight 0.10000E+01 volume 0.16889E-02 ppm1 0.707 ppm2 4.184 CV 1
ASSI { 4403}
(( segid " " and resid 244 and name HE3 ))
(( segid " " and resid 244 and name HG2 ))
3.200 1.300 1.300 peak 4403 spectrum 1 weight 0.10000E+01 volume 0.15084E-02 ppm1 2.558 ppm2 0.422 CV 1
OR { 4403}
(( segid " " and resid 244 and name HE2 ))
(( segid " " and resid 244 and name HG2 ))
ASSI { 4735}
( segid " " and resid 258 and name HD% )
( segid " " and resid 258 and name HE% )
3.100 1.200 1.200 peak 4735 spectrum 1 weight 0.10000E+01 volume 0.91633E-03 ppm1 7.084 ppm2 6.640 CV 1
ASSI { 3571}
(( segid " " and resid 343 and name HA ))
(( segid " " and resid 343 and name H ))
3.400 1.500 1.500 peak 3571 spectrum 1 weight 0.10000E+01 volume 0.56670E-03 ppm1 4.043 ppm2 8.181 CV 1
ASSI { 1436}
( segid " " and resid 317 and name HD2%)
( segid " " and resid 213 and name HD% )
3.500 1.600 1.600 peak 1436 spectrum 1 weight 0.10000E+01 volume 0.11137E-02 ppm1 0.343 ppm2 6.690 CV 1
ASSI { 4557}
(( segid " " and resid 184 and name HD3 ))
(( segid " " and resid 184 and name HA ))
3.600 1.600 1.600 peak 4557 spectrum 1 weight 0.10000E+01 volume 0.17481E-02 ppm1 3.604 ppm2 4.321 CV 1
ASSI { 3924}
(( segid " " and resid 308 and name HG2 ))
(( segid " " and resid 308 and name HE3 ))
2.900 1.000 1.000 peak 3924 spectrum 1 weight 0.10000E+01 volume 0.79396E-02 ppm1 1.540 ppm2 2.863 CV 1
OR { 3924}
(( segid " " and resid 308 and name HG2 ))
(( segid " " and resid 308 and name HE2 ))
ASSI { 2046}
( segid " " and resid 372 and name HG2%)
(( segid " " and resid 374 and name H ))
4.000 2.000 2.000 peak 2046 spectrum 1 weight 0.10000E+01 volume 0.79509E-03 ppm1 0.747 ppm2 6.313 CV 1
ASSI { 1732}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 297 and name HA ))
3.300 1.400 1.400 peak 1732 spectrum 1 weight 0.10000E+01 volume 0.25968E-02 ppm1 0.076 ppm2 3.751 CV 1
ASSI { 4106}
( segid " " and resid 303 and name HD% )
(( segid " " and resid 303 and name HB2 ))
3.600 1.600 1.600 peak 4106 spectrum 1 weight 0.10000E+01 volume 0.54699E-03 ppm1 7.084 ppm2 3.455 CV 1
ASSI { 4509}
( segid " " and resid 438 and name HB% )
( segid " " and resid 391 and name HD1%)
2.400 0.700 0.700 peak 4509 spectrum 1 weight 0.10000E+01 volume 0.70797E-02 ppm1 1.600 ppm2 0.717 CV 1
ASSI { 269}
(( segid " " and resid 226 and name HG2 ))
(( segid " " and resid 334 and name HG3 ))
3.100 3.100 2.900 peak 269 spectrum 1 weight 0.10000E+01 volume 0.16607E-02 ppm1 1.280 ppm2 2.175 CV 1
OR { 269}
(( segid " " and resid 226 and name HG2 ))
(( segid " " and resid 334 and name HG2 ))
ASSI { 2375}
(( segid " " and resid 375 and name HG2 ))
(( segid " " and resid 375 and name HA ))
4.300 2.300 1.700 peak 2375 spectrum 1 weight 0.10000E+01 volume 0.11729E-02 ppm1 2.302 ppm2 4.695 CV 1
ASSI { 194}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 440 and name HG2 ))
3.300 1.400 1.400 peak 194 spectrum 1 weight 0.10000E+01 volume 0.27659E-02 ppm1 0.703 ppm2 1.336 CV 1
OR { 194}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 440 and name HG3 ))
ASSI { 2252}
( segid " " and resid 317 and name HD1%)
( segid " " and resid 209 and name HD2%)
3.900 1.900 1.900 peak 2252 spectrum 1 weight 0.10000E+01 volume 0.97835E-03 ppm1 0.170 ppm2 -0.906 CV 1
ASSI { 3404}
( segid " " and resid 283 and name HD2%)
( segid " " and resid 306 and name HD1%)
3.300 1.400 1.400 peak 3404 spectrum 1 weight 0.10000E+01 volume 0.79875E-02 ppm1 0.905 ppm2 0.413 CV 1
ASSI { 3707}
( segid " " and resid 294 and name HG2%)
(( segid " " and resid 294 and name HA ))
2.400 0.700 0.700 peak 3707 spectrum 1 weight 0.10000E+01 volume 0.16094E-01 ppm1 1.221 ppm2 3.897 CV 1
ASSI { 3795}
(( segid " " and resid 336 and name HD2 ))
(( segid " " and resid 336 and name H ))
4.100 2.100 1.900 peak 3795 spectrum 1 weight 0.10000E+01 volume 0.12800E-02 ppm1 1.466 ppm2 9.119 CV 1
ASSI { 4225}
(( segid " " and resid 368 and name HB2 ))
( segid " " and resid 371 and name HG2%)
4.400 2.500 1.600 peak 4225 spectrum 1 weight 0.10000E+01 volume 0.48776E-03 ppm1 3.268 ppm2 0.986 CV 1
ASSI { 4714}
(( segid " " and resid 425 and name HB2 ))
(( segid " " and resid 425 and name H ))
3.300 1.400 1.400 peak 4714 spectrum 1 weight 0.10000E+01 volume 0.40883E-03 ppm1 1.623 ppm2 7.757 CV 1
ASSI { 1703}
( segid " " and resid 364 and name HG2%)
(( segid " " and resid 364 and name HA ))
2.000 0.500 0.500 peak 1703 spectrum 1 weight 0.10000E+01 volume 0.65301E-02 ppm1 0.909 ppm2 3.656 CV 1
ASSI { 4385}
(( segid " " and resid 213 and name HA ))
(( segid " " and resid 214 and name H ))
4.100 2.100 1.900 peak 4385 spectrum 1 weight 0.10000E+01 volume 0.37498E-03 ppm1 3.596 ppm2 7.161 CV 1
ASSI { 772}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 280 and name HG1 ))
2.400 0.700 0.700 peak 772 spectrum 1 weight 0.10000E+01 volume 0.40318E-02 ppm1 0.903 ppm2 7.590 CV 1
ASSI { 1881}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 212 and name HA ))
2.700 0.900 0.900 peak 1881 spectrum 1 weight 0.10000E+01 volume 0.32734E-02 ppm1 -0.168 ppm2 3.230 CV 1
ASSI { 479}
(( segid " " and resid 421 and name HB2 ))
(( segid " " and resid 421 and name HA ))
2.400 0.700 0.700 peak 479 spectrum 1 weight 0.10000E+01 volume 0.53035E-02 ppm1 1.679 ppm2 4.285 CV 1
ASSI { 2092}
(( segid " " and resid 256 and name HA ))
( segid " " and resid 219 and name HE% )
2.900 1.100 1.100 peak 2092 spectrum 1 weight 0.10000E+01 volume 0.92197E-03 ppm1 4.114 ppm2 6.394 CV 1
ASSI { 3367}
(( segid " " and resid 279 and name HB3 ))
( segid " " and resid 279 and name HD1%)
3.600 1.600 1.600 peak 3367 spectrum 1 weight 0.10000E+01 volume 0.45677E-03 ppm1 1.404 ppm2 0.167 CV 1
ASSI { 1726}
( segid " " and resid 333 and name HD1%)
(( segid " " and resid 334 and name H ))
2.100 2.100 3.900 peak 1726 spectrum 1 weight 0.10000E+01 volume 0.36172E-02 ppm1 0.879 ppm2 8.092 CV 1
ASSI { 1784}
(( segid " " and resid 443 and name HB2 ))
(( segid " " and resid 443 and name H ))
2.400 0.700 0.700 peak 1784 spectrum 1 weight 0.10000E+01 volume 0.23768E-02 ppm1 1.682 ppm2 7.640 CV 1
ASSI { 3330}
(( segid " " and resid 323 and name HA ))
(( segid " " and resid 326 and name HB3 ))
3.600 1.700 1.700 peak 3330 spectrum 1 weight 0.10000E+01 volume 0.36934E-03 ppm1 3.288 ppm2 2.666 CV 1
ASSI { 3167}
(( segid " " and resid 323 and name HA ))
(( segid " " and resid 323 and name H ))
3.100 1.200 1.200 peak 3167 spectrum 1 weight 0.10000E+01 volume 0.63439E-03 ppm1 3.282 ppm2 7.776 CV 1
ASSI { 114}
( segid " " and resid 357 and name HD2%)
(( segid " " and resid 357 and name HG ))
2.400 0.700 0.700 peak 114 spectrum 1 weight 0.10000E+01 volume 0.43195E-02 ppm1 0.872 ppm2 1.757 CV 1
OR { 114}
( segid " " and resid 357 and name HD2%)
(( segid " " and resid 357 and name HB3 ))
ASSI { 4052}
( segid " " and resid 357 and name HD1%)
(( segid " " and resid 357 and name H ))
3.500 1.500 1.500 peak 4052 spectrum 1 weight 0.10000E+01 volume 0.22612E-02 ppm1 0.674 ppm2 8.133 CV 1
ASSI { 3026}
(( segid " " and resid 279 and name HG ))
( segid " " and resid 279 and name HD2%)
2.400 0.700 0.700 peak 3026 spectrum 1 weight 0.10000E+01 volume 0.22923E-02 ppm1 1.418 ppm2 0.377 CV 1
ASSI { 3997}
(( segid " " and resid 379 and name HD3 ))
(( segid " " and resid 379 and name HG3 ))
3.200 1.300 1.300 peak 3997 spectrum 1 weight 0.10000E+01 volume 0.11052E-02 ppm1 3.824 ppm2 1.819 CV 1
OR { 3997}
(( segid " " and resid 379 and name HD3 ))
(( segid " " and resid 379 and name HG2 ))
ASSI { 909}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 332 and name HB3 ))
4.000 2.000 2.000 peak 909 spectrum 1 weight 0.10000E+01 volume 0.14943E-02 ppm1 1.802 ppm2 2.587 CV 1
ASSI { 4530}
(( segid " " and resid 281 and name HD3 ))
(( segid " " and resid 281 and name H ))
3.600 1.700 1.700 peak 4530 spectrum 1 weight 0.10000E+01 volume 0.87120E-03 ppm1 1.658 ppm2 9.165 CV 1
OR { 4530}
(( segid " " and resid 281 and name HD2 ))
(( segid " " and resid 281 and name H ))
ASSI { 2729}
(( segid " " and resid 335 and name HA ))
( segid " " and resid 335 and name HG2%)
3.300 1.300 1.300 peak 2729 spectrum 1 weight 0.10000E+01 volume 0.12265E-02 ppm1 4.208 ppm2 1.244 CV 1
ASSI { 1058}
(( segid " " and resid 288 and name HB2 ))
( segid " " and resid 356 and name HG2%)
4.200 2.200 1.800 peak 1058 spectrum 1 weight 0.10000E+01 volume 0.53571E-03 ppm1 1.986 ppm2 0.379 CV 1
ASSI { 1080}
(( segid " " and resid 293 and name HD2 ))
(( segid " " and resid 298 and name HG2 ))
4.200 2.200 1.800 peak 1080 spectrum 1 weight 0.10000E+01 volume 0.11729E-02 ppm1 3.076 ppm2 2.170 CV 1
OR { 1080}
(( segid " " and resid 293 and name HD2 ))
(( segid " " and resid 298 and name HG3 ))
ASSI { 603}
(( segid " " and resid 342 and name HG12))
( segid " " and resid 342 and name HG2%)
3.600 1.600 1.600 peak 603 spectrum 1 weight 0.10000E+01 volume 0.18270E-02 ppm1 1.078 ppm2 0.530 CV 1
ASSI { 4538}
( segid " " and resid 412 and name HD2%)
(( segid " " and resid 412 and name HA ))
3.200 1.300 1.300 peak 4538 spectrum 1 weight 0.10000E+01 volume 0.44070E-02 ppm1 0.643 ppm2 3.981 CV 1
ASSI { 3800}
( segid " " and resid 189 and name HD1%)
(( segid " " and resid 189 and name HA ))
2.400 0.700 0.700 peak 3800 spectrum 1 weight 0.10000E+01 volume 0.27828E-02 ppm1 0.736 ppm2 4.354 CV 1
ASSI { 87}
(( segid " " and resid 445 and name HB2 ))
(( segid " " and resid 445 and name HG3 ))
2.300 0.700 0.700 peak 87 spectrum 1 weight 0.10000E+01 volume 0.10345E-01 ppm1 2.044 ppm2 2.205 CV 1
OR { 87}
(( segid " " and resid 445 and name HB2 ))
(( segid " " and resid 445 and name HG2 ))
ASSI { 1091}
(( segid " " and resid 331 and name HB3 ))
( segid " " and resid 328 and name HG1%)
4.700 2.800 1.300 peak 1091 spectrum 1 weight 0.10000E+01 volume 0.42575E-03 ppm1 2.584 ppm2 0.755 CV 1
ASSI { 2074}
( segid " " and resid 329 and name HD1%)
(( segid " " and resid 330 and name H ))
4.600 2.700 1.400 peak 2074 spectrum 1 weight 0.10000E+01 volume 0.12067E-02 ppm1 0.120 ppm2 8.636 CV 1
ASSI { 3601}
(( segid " " and resid 340 and name HA ))
( segid " " and resid 339 and name HG2%)
2.800 1.000 1.000 peak 3601 spectrum 1 weight 0.10000E+01 volume 0.32932E-02 ppm1 4.011 ppm2 0.708 CV 1
ASSI { 3393}
( segid " " and resid 247 and name HD% )
(( segid " " and resid 247 and name HB2 ))
3.700 1.700 1.700 peak 3393 spectrum 1 weight 0.10000E+01 volume 0.41165E-03 ppm1 7.329 ppm2 3.016 CV 1
OR { 3393}
( segid " " and resid 247 and name HD% )
(( segid " " and resid 247 and name HB3 ))
ASSI { 837}
(( segid " " and resid 339 and name HB ))
( segid " " and resid 339 and name HG2%)
2.400 0.700 0.700 peak 837 spectrum 1 weight 0.10000E+01 volume 0.50412E-02 ppm1 1.546 ppm2 0.685 CV 1
OR { 837}
(( segid " " and resid 339 and name HB ))
( segid " " and resid 339 and name HD1%)
ASSI { 2302}
( segid " " and resid 316 and name HD1%)
(( segid " " and resid 320 and name HE1 ))
2.700 0.900 0.900 peak 2302 spectrum 1 weight 0.10000E+01 volume 0.54333E-02 ppm1 0.824 ppm2 10.112 CV 1
ASSI { 4517}
(( segid " " and resid 374 and name HB2 ))
(( segid " " and resid 374 and name HG3 ))
2.400 0.700 0.700 peak 4517 spectrum 1 weight 0.10000E+01 volume 0.40939E-02 ppm1 1.625 ppm2 1.354 CV 1
OR { 4517}
(( segid " " and resid 374 and name HB2 ))
(( segid " " and resid 374 and name HG2 ))
ASSI { 2652}
(( segid " " and resid 226 and name HB3 ))
(( segid " " and resid 226 and name HG3 ))
2.400 0.700 0.700 peak 2652 spectrum 1 weight 0.10000E+01 volume 0.58898E-02 ppm1 1.960 ppm2 1.253 CV 1
OR { 2652}
(( segid " " and resid 226 and name HB3 ))
(( segid " " and resid 226 and name HG2 ))
ASSI { 4585}
(( segid " " and resid 380 and name HB2 ))
(( segid " " and resid 381 and name H ))
4.300 2.400 1.700 peak 4585 spectrum 1 weight 0.10000E+01 volume 0.58080E-03 ppm1 1.206 ppm2 8.188 CV 1
ASSI { 3337}
( segid " " and resid 198 and name HG1%)
(( segid " " and resid 198 and name HB ))
2.300 0.700 0.700 peak 3337 spectrum 1 weight 0.10000E+01 volume 0.52894E-02 ppm1 0.596 ppm2 2.050 CV 1
ASSI { 2527}
( segid " " and resid 328 and name HG2%)
(( segid " " and resid 326 and name H ))
5.000 3.200 1.000 peak 2527 spectrum 1 weight 0.10000E+01 volume 0.39190E-03 ppm1 0.760 ppm2 8.916 CV 1
OR { 2527}
( segid " " and resid 328 and name HG1%)
(( segid " " and resid 326 and name H ))
ASSI { 4062}
( segid " " and resid 358 and name HE% )
( segid " " and resid 358 and name HD% )
1.900 0.500 0.500 peak 4062 spectrum 1 weight 0.10000E+01 volume 0.27538E-01 ppm1 6.702 ppm2 7.009 CV 1
ASSI { 1927}
( segid " " and resid 339 and name HG2%)
(( segid " " and resid 340 and name HB3 ))
4.100 2.100 1.900 peak 1927 spectrum 1 weight 0.10000E+01 volume 0.23345E-02 ppm1 0.703 ppm2 2.027 CV 1
ASSI { 2878}
(( segid " " and resid 289 and name HB2 ))
(( segid " " and resid 290 and name H ))
2.800 1.000 1.000 peak 2878 spectrum 1 weight 0.10000E+01 volume 0.28054E-02 ppm1 1.977 ppm2 7.797 CV 1
ASSI { 4688}
(( segid " " and resid 368 and name HA ))
( segid " " and resid 368 and name HD% )
3.000 1.100 1.100 peak 4688 spectrum 1 weight 0.10000E+01 volume 0.10798E-02 ppm1 5.173 ppm2 7.163 CV 1
ASSI { 4285}
(( segid " " and resid 312 and name HB2 ))
(( segid " " and resid 312 and name H ))
3.300 1.400 1.400 peak 4285 spectrum 1 weight 0.10000E+01 volume 0.76692E-03 ppm1 2.131 ppm2 8.737 CV 1
ASSI { 2914}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 215 and name H ))
3.100 1.200 1.200 peak 2914 spectrum 1 weight 0.10000E+01 volume 0.28082E-02 ppm1 2.221 ppm2 8.880 CV 1
ASSI { 963}
( segid " " and resid 443 and name HD1%)
(( segid " " and resid 399 and name HE2 ))
2.500 0.800 0.800 peak 963 spectrum 1 weight 0.10000E+01 volume 0.66679E-02 ppm1 0.846 ppm2 2.849 CV 1
OR { 963}
( segid " " and resid 443 and name HD1%)
(( segid " " and resid 399 and name HE3 ))
ASSI { 3457}
(( segid " " and resid 208 and name HD3 ))
(( segid " " and resid 208 and name H ))
3.400 1.400 1.400 peak 3457 spectrum 1 weight 0.10000E+01 volume 0.11673E-02 ppm1 2.920 ppm2 8.269 CV 1
ASSI { 4475}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 309 and name HG3 ))
3.500 1.500 1.500 peak 4475 spectrum 1 weight 0.10000E+01 volume 0.33862E-02 ppm1 0.379 ppm2 2.147 CV 1
ASSI { 2977}
( segid " " and resid 346 and name HD1%)
(( segid " " and resid 325 and name HG3 ))
3.800 1.800 1.800 peak 2977 spectrum 1 weight 0.10000E+01 volume 0.20893E-02 ppm1 0.833 ppm2 2.709 CV 1
ASSI { 2923}
(( segid " " and resid 336 and name HD2 ))
(( segid " " and resid 336 and name HA ))
2.900 1.000 1.000 peak 2923 spectrum 1 weight 0.10000E+01 volume 0.27264E-02 ppm1 1.465 ppm2 3.967 CV 1
ASSI { 2345}
(( segid " " and resid 375 and name HG2 ))
(( segid " " and resid 376 and name H ))
5.100 3.300 0.900 peak 2345 spectrum 1 weight 0.10000E+01 volume 0.90787E-03 ppm1 2.296 ppm2 9.506 CV 1
ASSI { 2351}
( segid " " and resid 372 and name HG2%)
(( segid " " and resid 374 and name HG3 ))
3.300 1.400 1.400 peak 2351 spectrum 1 weight 0.10000E+01 volume 0.24304E-02 ppm1 0.748 ppm2 1.348 CV 1
OR { 2351}
( segid " " and resid 372 and name HG2%)
(( segid " " and resid 374 and name HG2 ))
ASSI { 3873}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 320 and name HZ2 ))
2.500 0.800 0.800 peak 3873 spectrum 1 weight 0.10000E+01 volume 0.53120E-02 ppm1 0.885 ppm2 7.369 CV 1
ASSI { 4232}
(( segid " " and resid 375 and name HB3 ))
(( segid " " and resid 375 and name HA ))
3.100 1.200 1.200 peak 4232 spectrum 1 weight 0.10000E+01 volume 0.10601E-02 ppm1 1.865 ppm2 4.696 CV 1
OR { 4232}
(( segid " " and resid 375 and name HB2 ))
(( segid " " and resid 375 and name HA ))
ASSI { 4114}
( segid " " and resid 201 and name HG2%)
(( segid " " and resid 201 and name HB ))
2.700 0.900 0.900 peak 4114 spectrum 1 weight 0.10000E+01 volume 0.22669E-02 ppm1 1.292 ppm2 4.428 CV 1
OR { 4114}
( segid " " and resid 201 and name HG2%)
(( segid " " and resid 201 and name HG1 ))
ASSI { 4046}
( segid " " and resid 219 and name HE% )
(( segid " " and resid 256 and name HG3 ))
4.600 2.700 1.400 peak 4046 spectrum 1 weight 0.10000E+01 volume 0.64285E-03 ppm1 6.397 ppm2 2.350 CV 1
OR { 4046}
( segid " " and resid 219 and name HE% )
(( segid " " and resid 256 and name HG2 ))
ASSI { 3058}
(( segid " " and resid 382 and name HZ2 ))
(( segid " " and resid 388 and name HB3 ))
5.400 3.700 0.600 peak 3058 spectrum 1 weight 0.10000E+01 volume 0.32706E-03 ppm1 7.461 ppm2 1.317 CV 1
ASSI { 318}
( segid " " and resid 192 and name HD1%)
(( segid " " and resid 200 and name HD2 ))
3.500 1.600 1.600 peak 318 spectrum 1 weight 0.10000E+01 volume 0.85150E-03 ppm1 0.867 ppm2 3.204 CV 1
OR { 318}
( segid " " and resid 192 and name HD1%)
(( segid " " and resid 200 and name HD3 ))
ASSI { 4127}
( segid " " and resid 420 and name HD1%)
(( segid " " and resid 415 and name HB2 ))
4.500 2.500 1.500 peak 4127 spectrum 1 weight 0.10000E+01 volume 0.59208E-03 ppm1 0.769 ppm2 2.722 CV 1
ASSI { 2016}
( segid " " and resid 203 and name HE% )
( segid " " and resid 376 and name HG1%)
2.000 0.500 0.500 peak 2016 spectrum 1 weight 0.10000E+01 volume 0.25375E-01 ppm1 2.221 ppm2 0.916 CV 1
OR { 2016}
( segid " " and resid 203 and name HE% )
( segid " " and resid 376 and name HG2%)
ASSI { 1151}
(( segid " " and resid 430 and name HH2 ))
(( segid " " and resid 427 and name HG2 ))
3.700 1.700 1.700 peak 1151 spectrum 1 weight 0.10000E+01 volume 0.33270E-03 ppm1 6.997 ppm2 2.224 CV 1
ASSI { 2004}
( segid " " and resid 377 and name HE% )
(( segid " " and resid 377 and name HA ))
3.700 1.700 1.700 peak 2004 spectrum 1 weight 0.10000E+01 volume 0.13646E-02 ppm1 1.994 ppm2 4.680 CV 1
ASSI { 4772}
(( segid " " and resid 318 and name HB ))
(( segid " " and resid 318 and name H ))
2.400 0.700 0.700 peak 4772 spectrum 1 weight 0.10000E+01 volume 0.32903E-02 ppm1 1.355 ppm2 8.040 CV 1
ASSI { 293}
(( segid " " and resid 285 and name HA ))
(( segid " " and resid 285 and name HD3 ))
4.300 2.300 1.700 peak 293 spectrum 1 weight 0.10000E+01 volume 0.42011E-03 ppm1 4.363 ppm2 3.646 CV 1
ASSI { 3403}
( segid " " and resid 189 and name HG2%)
(( segid " " and resid 189 and name HB ))
2.300 0.700 0.700 peak 3403 spectrum 1 weight 0.10000E+01 volume 0.38090E-02 ppm1 0.942 ppm2 2.181 CV 1
ASSI { 3836}
(( segid " " and resid 340 and name HG3 ))
(( segid " " and resid 340 and name HA ))
2.200 0.600 0.600 peak 3836 spectrum 1 weight 0.10000E+01 volume 0.12386E-01 ppm1 2.312 ppm2 4.016 CV 1
OR { 3836}
(( segid " " and resid 340 and name HG2 ))
(( segid " " and resid 340 and name HA ))
ASSI { 2615}
(( segid " " and resid 420 and name HB ))
(( segid " " and resid 421 and name H ))
4.200 2.200 1.800 peak 2615 spectrum 1 weight 0.10000E+01 volume 0.10911E-02 ppm1 1.766 ppm2 8.373 CV 1
ASSI { 3725}
( segid " " and resid 345 and name HG2%)
(( segid " " and resid 345 and name H ))
2.300 0.600 0.600 peak 3725 spectrum 1 weight 0.10000E+01 volume 0.43534E-02 ppm1 0.918 ppm2 7.002 CV 1
ASSI { 4389}
( segid " " and resid 278 and name HD2%)
(( segid " " and resid 278 and name HG ))
2.100 0.500 0.500 peak 4389 spectrum 1 weight 0.10000E+01 volume 0.10889E-01 ppm1 0.748 ppm2 1.721 CV 1
ASSI { 3410}
( segid " " and resid 359 and name HG2%)
(( segid " " and resid 360 and name HA ))
3.900 1.900 1.900 peak 3410 spectrum 1 weight 0.10000E+01 volume 0.62029E-03 ppm1 -0.459 ppm2 4.256 CV 1
ASSI { 3436}
(( segid " " and resid 443 and name HB3 ))
(( segid " " and resid 443 and name H ))
3.200 1.300 1.300 peak 3436 spectrum 1 weight 0.10000E+01 volume 0.15253E-02 ppm1 1.648 ppm2 7.640 CV 1
ASSI { 4461}
( segid " " and resid 416 and name HD2%)
(( segid " " and resid 426 and name HG2 ))
2.900 1.000 1.000 peak 4461 spectrum 1 weight 0.10000E+01 volume 0.29210E-02 ppm1 0.703 ppm2 2.255 CV 1
ASSI { 3510}
(( segid " " and resid 226 and name HA ))
(( segid " " and resid 226 and name HE2 ))
5.800 4.200 0.200 peak 3510 spectrum 1 weight 0.10000E+01 volume 0.47366E-03 ppm1 4.384 ppm2 2.924 CV 1
OR { 3510}
(( segid " " and resid 226 and name HA ))
(( segid " " and resid 226 and name HE3 ))
ASSI { 650}
( segid " " and resid 409 and name HD2%)
(( segid " " and resid 409 and name HB3 ))
2.400 0.700 0.700 peak 650 spectrum 1 weight 0.10000E+01 volume 0.57432E-02 ppm1 0.742 ppm2 1.919 CV 1
ASSI { 1002}
( segid " " and resid 429 and name HD2%)
(( segid " " and resid 413 and name HD2 ))
2.800 1.000 1.000 peak 1002 spectrum 1 weight 0.10000E+01 volume 0.38062E-02 ppm1 0.641 ppm2 6.797 CV 1
ASSI { 4397}
(( segid " " and resid 257 and name HB3 ))
(( segid " " and resid 257 and name H ))
3.100 1.200 1.200 peak 4397 spectrum 1 weight 0.10000E+01 volume 0.10263E-02 ppm1 2.365 ppm2 7.426 CV 1
ASSI { 3679}
( segid " " and resid 388 and name HE% )
(( segid " " and resid 382 and name HE1 ))
2.800 2.800 3.200 peak 3679 spectrum 1 weight 0.10000E+01 volume 0.67948E-03 ppm1 1.844 ppm2 9.602 CV 1
ASSI { 3859}
(( segid " " and resid 351 and name HG2 ))
(( segid " " and resid 352 and name H ))
4.900 3.000 1.100 peak 3859 spectrum 1 weight 0.10000E+01 volume 0.11391E-02 ppm1 2.170 ppm2 7.043 CV 1
ASSI { 4005}
(( segid " " and resid 308 and name HD2 ))
( segid " " and resid 315 and name HE% )
3.600 1.600 1.600 peak 4005 spectrum 1 weight 0.10000E+01 volume 0.74153E-03 ppm1 1.529 ppm2 6.881 CV 1
OR { 4005}
(( segid " " and resid 308 and name HD3 ))
( segid " " and resid 315 and name HE% )
ASSI { 2458}
( segid " " and resid 245 and name HB% )
(( segid " " and resid 245 and name H ))
2.200 0.600 0.600 peak 2458 spectrum 1 weight 0.10000E+01 volume 0.12871E-01 ppm1 1.329 ppm2 7.516 CV 1
ASSI { 3308}
(( segid " " and resid 277 and name HB2 ))
(( segid " " and resid 277 and name HA ))
3.900 1.900 1.900 peak 3308 spectrum 1 weight 0.10000E+01 volume 0.55263E-03 ppm1 2.659 ppm2 4.515 CV 1
ASSI { 2045}
(( segid " " and resid 436 and name HB3 ))
(( segid " " and resid 436 and name H ))
3.400 1.400 1.400 peak 2045 spectrum 1 weight 0.10000E+01 volume 0.47084E-03 ppm1 2.019 ppm2 8.914 CV 1
ASSI { 3016}
(( segid " " and resid 226 and name HD2 ))
(( segid " " and resid 226 and name H ))
3.900 1.900 1.900 peak 3016 spectrum 1 weight 0.10000E+01 volume 0.26644E-02 ppm1 1.599 ppm2 7.423 CV 1
OR { 3016}
(( segid " " and resid 226 and name HD3 ))
(( segid " " and resid 226 and name H ))
ASSI { 3590}
(( segid " " and resid 244 and name HD3 ))
(( segid " " and resid 245 and name H ))
3.100 3.100 2.900 peak 3590 spectrum 1 weight 0.10000E+01 volume 0.39190E-03 ppm1 1.226 ppm2 7.527 CV 1
ASSI { 4759}
(( segid " " and resid 373 and name HA ))
(( segid " " and resid 373 and name HG ))
4.600 2.600 1.400 peak 4759 spectrum 1 weight 0.10000E+01 volume 0.35527E-03 ppm1 2.345 ppm2 1.109 CV 1
ASSI { 1691}
( segid " " and resid 344 and name HG2%)
(( segid " " and resid 344 and name HA ))
2.100 0.600 0.600 peak 1691 spectrum 1 weight 0.10000E+01 volume 0.13071E-01 ppm1 0.895 ppm2 3.883 CV 1
ASSI { 2006}
(( segid " " and resid 398 and name HA ))
(( segid " " and resid 398 and name HG13))
3.300 1.400 1.400 peak 2006 spectrum 1 weight 0.10000E+01 volume 0.11052E-02 ppm1 3.431 ppm2 1.625 CV 1
ASSI { 275}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 321 and name H ))
4.700 2.700 1.300 peak 275 spectrum 1 weight 0.10000E+01 volume 0.62875E-03 ppm1 0.348 ppm2 8.573 CV 1
ASSI { 3598}
(( segid " " and resid 304 and name HG2 ))
( segid " " and resid 367 and name HD1%)
2.900 1.100 1.100 peak 3598 spectrum 1 weight 0.10000E+01 volume 0.44070E-02 ppm1 2.459 ppm2 0.670 CV 1
ASSI { 2058}
( segid " " and resid 295 and name HG2%)
(( segid " " and resid 295 and name HA ))
3.000 1.100 1.100 peak 2058 spectrum 1 weight 0.10000E+01 volume 0.20103E-02 ppm1 1.183 ppm2 4.741 CV 1
ASSI { 3416}
(( segid " " and resid 238 and name HA ))
(( segid " " and resid 241 and name HB3 ))
4.000 2.000 2.000 peak 3416 spectrum 1 weight 0.10000E+01 volume 0.86278E-03 ppm1 4.142 ppm2 2.600 CV 1
ASSI { 1636}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 322 and name H ))
4.100 2.200 1.900 peak 1636 spectrum 1 weight 0.10000E+01 volume 0.15225E-02 ppm1 0.347 ppm2 8.232 CV 1
ASSI { 4546}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 323 and name H ))
4.900 3.000 1.100 peak 4546 spectrum 1 weight 0.10000E+01 volume 0.87120E-03 ppm1 -0.164 ppm2 7.774 CV 1
ASSI { 3987}
(( segid " " and resid 254 and name HB2 ))
(( segid " " and resid 254 and name HA ))
2.900 1.000 1.000 peak 3987 spectrum 1 weight 0.10000E+01 volume 0.13844E-02 ppm1 2.615 ppm2 4.866 CV 1
ASSI { 2039}
( segid " " and resid 391 and name HD2%)
(( segid " " and resid 392 and name HD2 ))
3.800 1.800 1.800 peak 2039 spectrum 1 weight 0.10000E+01 volume 0.19229E-02 ppm1 0.531 ppm2 3.151 CV 1
ASSI { 1211}
(( segid " " and resid 420 and name HB ))
(( segid " " and resid 416 and name HA ))
2.500 0.800 0.800 peak 1211 spectrum 1 weight 0.10000E+01 volume 0.19031E-02 ppm1 1.767 ppm2 4.273 CV 1
ASSI { 2989}
( segid " " and resid 317 and name HD2%)
(( segid " " and resid 318 and name H ))
3.700 1.700 1.700 peak 2989 spectrum 1 weight 0.10000E+01 volume 0.17876E-02 ppm1 0.344 ppm2 8.037 CV 1
ASSI { 3804}
(( segid " " and resid 339 and name HB ))
(( segid " " and resid 340 and name H ))
2.800 1.000 1.000 peak 3804 spectrum 1 weight 0.10000E+01 volume 0.11137E-02 ppm1 1.543 ppm2 8.148 CV 1
ASSI { 1153}
(( segid " " and resid 344 and name HG13))
(( segid " " and resid 343 and name H ))
4.700 2.800 1.300 peak 1153 spectrum 1 weight 0.10000E+01 volume 0.30169E-03 ppm1 1.214 ppm2 8.171 CV 1
ASSI { 62}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 220 and name HB ))
2.700 0.900 0.900 peak 62 spectrum 1 weight 0.10000E+01 volume 0.47281E-02 ppm1 1.914 ppm2 2.275 CV 1
ASSI { 962}
( segid " " and resid 236 and name HG2%)
(( segid " " and resid 239 and name HA ))
4.000 2.000 2.000 peak 962 spectrum 1 weight 0.10000E+01 volume 0.12913E-02 ppm1 0.961 ppm2 4.277 CV 1
ASSI { 2365}
( segid " " and resid 316 and name HD2%)
(( segid " " and resid 316 and name HA ))
3.500 1.500 1.500 peak 2365 spectrum 1 weight 0.10000E+01 volume 0.23120E-02 ppm1 0.745 ppm2 3.584 CV 1
ASSI { 10}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 443 and name HA ))
2.900 1.100 1.100 peak 10 spectrum 1 weight 0.10000E+01 volume 0.15112E-02 ppm1 0.808 ppm2 4.110 CV 1
ASSI { 2265}
(( segid " " and resid 183 and name HB3 ))
(( segid " " and resid 184 and name HD2 ))
2.900 1.000 1.000 peak 2265 spectrum 1 weight 0.10000E+01 volume 0.45564E-02 ppm1 1.853 ppm2 3.629 CV 1
OR { 2265}
(( segid " " and resid 183 and name HB3 ))
(( segid " " and resid 184 and name HD3 ))
ASSI { 3377}
( segid " " and resid 243 and name HD1%)
( segid " " and resid 258 and name HD% )
3.300 1.400 1.400 peak 3377 spectrum 1 weight 0.10000E+01 volume 0.14408E-02 ppm1 0.013 ppm2 7.088 CV 1
ASSI { 1695}
(( segid " " and resid 433 and name HG3 ))
(( segid " " and resid 430 and name HA ))
3.600 1.600 1.600 peak 1695 spectrum 1 weight 0.10000E+01 volume 0.49904E-03 ppm1 2.488 ppm2 4.386 CV 1
ASSI { 2261}
( segid " " and resid 297 and name HG2%)
(( segid " " and resid 297 and name HA ))
2.200 0.600 0.600 peak 2261 spectrum 1 weight 0.10000E+01 volume 0.13683E-01 ppm1 1.115 ppm2 3.734 CV 1
ASSI { 2361}
(( segid " " and resid 445 and name HG3 ))
(( segid " " and resid 445 and name HA ))
2.200 0.600 0.600 peak 2361 spectrum 1 weight 0.10000E+01 volume 0.11374E-01 ppm1 2.268 ppm2 4.235 CV 1
ASSI { 1749}
(( segid " " and resid 308 and name HD2 ))
(( segid " " and resid 308 and name H ))
2.300 0.700 0.700 peak 1749 spectrum 1 weight 0.10000E+01 volume 0.75846E-02 ppm1 1.530 ppm2 7.086 CV 1
OR { 1749}
(( segid " " and resid 308 and name HD3 ))
(( segid " " and resid 308 and name H ))
ASSI { 3452}
(( segid " " and resid 256 and name HG2 ))
( segid " " and resid 223 and name HE% )
2.900 2.900 3.100 peak 3452 spectrum 1 weight 0.10000E+01 volume 0.14943E-02 ppm1 2.308 ppm2 6.644 CV 1
ASSI { 2723}
( segid " " and resid 255 and name HD1%)
( segid " " and resid 258 and name HD% )
3.400 1.400 1.400 peak 2723 spectrum 1 weight 0.10000E+01 volume 0.27180E-02 ppm1 0.600 ppm2 7.088 CV 1
ASSI { 42}
(( segid " " and resid 377 and name HG3 ))
( segid " " and resid 204 and name HE% )
4.800 2.800 1.200 peak 42 spectrum 1 weight 0.10000E+01 volume 0.39472E-03 ppm1 2.412 ppm2 6.866 CV 1
OR { 42}
(( segid " " and resid 377 and name HG3 ))
( segid " " and resid 204 and name HD% )
ASSI { 2446}
(( segid " " and resid 226 and name HA ))
(( segid " " and resid 227 and name H ))
3.900 1.900 1.900 peak 2446 spectrum 1 weight 0.10000E+01 volume 0.34680E-03 ppm1 4.390 ppm2 7.134 CV 1
ASSI { 4288}
(( segid " " and resid 213 and name HA ))
( segid " " and resid 267 and name HD2%)
2.700 0.900 0.900 peak 4288 spectrum 1 weight 0.10000E+01 volume 0.18609E-02 ppm1 3.584 ppm2 0.910 CV 1
OR { 4288}
(( segid " " and resid 213 and name HA ))
( segid " " and resid 267 and name HD1%)
ASSI { 4462}
(( segid " " and resid 393 and name HG3 ))
(( segid " " and resid 393 and name HB3 ))
2.400 0.700 0.700 peak 4462 spectrum 1 weight 0.10000E+01 volume 0.16990E-01 ppm1 2.266 ppm2 1.862 CV 1
ASSI { 3696}
(( segid " " and resid 226 and name HG3 ))
(( segid " " and resid 226 and name HD2 ))
2.100 0.600 0.600 peak 3696 spectrum 1 weight 0.10000E+01 volume 0.13491E-01 ppm1 1.210 ppm2 1.589 CV 1
OR { 3696}
(( segid " " and resid 226 and name HG3 ))
(( segid " " and resid 226 and name HD3 ))
ASSI { 4656}
(( segid " " and resid 339 and name HB ))
(( segid " " and resid 339 and name H ))
3.000 1.100 1.100 peak 4656 spectrum 1 weight 0.10000E+01 volume 0.11193E-02 ppm1 1.545 ppm2 8.365 CV 1
ASSI { 4296}
(( segid " " and resid 395 and name HG3 ))
(( segid " " and resid 395 and name HA ))
3.500 1.500 1.500 peak 4296 spectrum 1 weight 0.10000E+01 volume 0.15846E-02 ppm1 2.448 ppm2 3.768 CV 1
ASSI { 782}
( segid " " and resid 189 and name HD1%)
(( segid " " and resid 188 and name HA ))
5.200 3.400 0.800 peak 782 spectrum 1 weight 0.10000E+01 volume 0.48212E-03 ppm1 0.740 ppm2 4.692 CV 1
ASSI { 4190}
( segid " " and resid 364 and name HG1%)
(( segid " " and resid 364 and name H ))
2.300 0.600 0.600 peak 4190 spectrum 1 weight 0.10000E+01 volume 0.82019E-02 ppm1 1.059 ppm2 7.490 CV 1
ASSI { 3118}
(( segid " " and resid 332 and name HB2 ))
(( segid " " and resid 332 and name HA ))
2.800 1.000 1.000 peak 3118 spectrum 1 weight 0.10000E+01 volume 0.18411E-02 ppm1 1.805 ppm2 4.187 CV 1
ASSI { 2257}
(( segid " " and resid 437 and name HA ))
(( segid " " and resid 440 and name HD2 ))
4.400 2.500 1.600 peak 2257 spectrum 1 weight 0.10000E+01 volume 0.15366E-02 ppm1 3.786 ppm2 1.587 CV 1
OR { 2257}
(( segid " " and resid 437 and name HA ))
(( segid " " and resid 440 and name HD3 ))
ASSI { 4294}
( segid " " and resid 255 and name HD1%)
(( segid " " and resid 247 and name HH ))
4.000 2.000 2.000 peak 4294 spectrum 1 weight 0.10000E+01 volume 0.41447E-03 ppm1 0.600 ppm2 9.425 CV 1
ASSI { 3062}
( segid " " and resid 183 and name HE% )
(( segid " " and resid 183 and name HA ))
4.200 2.200 1.800 peak 3062 spectrum 1 weight 0.10000E+01 volume 0.74435E-03 ppm1 2.042 ppm2 4.735 CV 1
ASSI { 2392}
(( segid " " and resid 364 and name HA ))
(( segid " " and resid 364 and name HB ))
2.900 1.100 1.100 peak 2392 spectrum 1 weight 0.10000E+01 volume 0.85150E-03 ppm1 3.658 ppm2 2.137 CV 1
ASSI { 1085}
( segid " " and resid 186 and name HD2%)
(( segid " " and resid 185 and name H ))
3.200 1.300 1.300 peak 1085 spectrum 1 weight 0.10000E+01 volume 0.30056E-02 ppm1 0.831 ppm2 8.514 CV 1
ASSI { 4508}
(( segid " " and resid 305 and name HG2 ))
(( segid " " and resid 305 and name HD3 ))
2.500 0.800 0.800 peak 4508 spectrum 1 weight 0.10000E+01 volume 0.19060E-02 ppm1 1.652 ppm2 3.058 CV 1
ASSI { 2149}
(( segid " " and resid 318 and name HG13))
( segid " " and resid 368 and name HE% )
4.100 2.100 1.900 peak 2149 spectrum 1 weight 0.10000E+01 volume 0.27913E-03 ppm1 0.606 ppm2 6.754 CV 1
ASSI { 3596}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 213 and name HB3 ))
3.800 1.800 1.800 peak 3596 spectrum 1 weight 0.10000E+01 volume 0.64003E-03 ppm1 -0.903 ppm2 2.717 CV 1
ASSI { 3163}
( segid " " and resid 420 and name HG2%)
(( segid " " and resid 420 and name H ))
3.600 1.700 1.700 peak 3163 spectrum 1 weight 0.10000E+01 volume 0.48269E-02 ppm1 0.805 ppm2 7.499 CV 1
ASSI { 1234}
(( segid " " and resid 333 and name HB2 ))
(( segid " " and resid 334 and name HA ))
4.600 2.600 1.400 peak 1234 spectrum 1 weight 0.10000E+01 volume 0.59773E-03 ppm1 1.609 ppm2 4.424 CV 1
ASSI { 2251}
(( segid " " and resid 331 and name HB2 ))
(( segid " " and resid 331 and name HA ))
3.900 1.900 1.900 peak 2251 spectrum 1 weight 0.10000E+01 volume 0.30732E-03 ppm1 2.545 ppm2 4.552 CV 1
ASSI { 4507}
( segid " " and resid 217 and name HG2%)
( segid " " and resid 373 and name HD1%)
3.000 1.100 1.100 peak 4507 spectrum 1 weight 0.10000E+01 volume 0.27603E-02 ppm1 0.462 ppm2 -0.202 CV 1
ASSI { 549}
(( segid " " and resid 305 and name HD2 ))
(( segid " " and resid 283 and name HA ))
4.800 2.900 1.200 peak 549 spectrum 1 weight 0.10000E+01 volume 0.14802E-02 ppm1 3.148 ppm2 4.476 CV 1
ASSI { 3564}
( segid " " and resid 264 and name HB% )
(( segid " " and resid 261 and name HA ))
3.200 1.300 1.300 peak 3564 spectrum 1 weight 0.10000E+01 volume 0.95018E-03 ppm1 0.953 ppm2 4.496 CV 1
ASSI { 74}
( segid " " and resid 258 and name HE% )
(( segid " " and resid 239 and name HD2 ))
3.100 1.200 1.200 peak 74 spectrum 1 weight 0.10000E+01 volume 0.11419E-02 ppm1 6.641 ppm2 1.728 CV 1
OR { 74}
( segid " " and resid 258 and name HE% )
(( segid " " and resid 239 and name HD3 ))
OR { 74}
( segid " " and resid 258 and name HE% )
(( segid " " and resid 239 and name HB3 ))
ASSI { 1377}
(( segid " " and resid 304 and name HB3 ))
( segid " " and resid 367 and name HD1%)
5.000 3.100 1.000 peak 1377 spectrum 1 weight 0.10000E+01 volume 0.12378E-02 ppm1 1.889 ppm2 0.665 CV 1
ASSI { 2466}
(( segid " " and resid 205 and name HA ))
(( segid " " and resid 205 and name HB3 ))
3.500 1.500 1.500 peak 2466 spectrum 1 weight 0.10000E+01 volume 0.87402E-03 ppm1 3.806 ppm2 1.721 CV 1
ASSI { 4464}
(( segid " " and resid 257 and name HB2 ))
(( segid " " and resid 257 and name H ))
3.600 1.600 1.600 peak 4464 spectrum 1 weight 0.10000E+01 volume 0.84303E-03 ppm1 2.451 ppm2 7.432 CV 1
ASSI { 73}
( segid " " and resid 253 and name HG2%)
( segid " " and resid 258 and name HD% )
3.900 1.900 1.900 peak 73 spectrum 1 weight 0.10000E+01 volume 0.17199E-02 ppm1 0.618 ppm2 7.079 CV 1
ASSI { 3295}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 315 and name H ))
4.500 2.600 1.500 peak 3295 spectrum 1 weight 0.10000E+01 volume 0.64567E-03 ppm1 0.563 ppm2 8.321 CV 1
ASSI { 3479}
(( segid " " and resid 279 and name HB3 ))
( segid " " and resid 279 and name HD2%)
4.300 2.300 1.700 peak 3479 spectrum 1 weight 0.10000E+01 volume 0.54699E-03 ppm1 1.431 ppm2 0.378 CV 1
ASSI { 2112}
(( segid " " and resid 219 and name HA ))
(( segid " " and resid 222 and name H ))
4.000 2.000 2.000 peak 2112 spectrum 1 weight 0.10000E+01 volume 0.38626E-03 ppm1 4.133 ppm2 7.227 CV 1
ASSI { 4710}
(( segid " " and resid 419 and name HA3 ))
(( segid " " and resid 420 and name HG13))
4.600 2.600 1.400 peak 4710 spectrum 1 weight 0.10000E+01 volume 0.41729E-03 ppm1 4.000 ppm2 1.382 CV 1
ASSI { 1669}
( segid " " and resid 186 and name HD1%)
(( segid " " and resid 186 and name HA ))
1.800 0.400 0.400 peak 1669 spectrum 1 weight 0.10000E+01 volume 0.20453E-01 ppm1 0.774 ppm2 4.247 CV 1
ASSI { 1934}
(( segid " " and resid 403 and name HB2 ))
( segid " " and resid 407 and name HE% )
5.900 4.400 0.100 peak 1934 spectrum 1 weight 0.10000E+01 volume 0.43139E-03 ppm1 2.017 ppm2 6.862 CV 1
ASSI { 2805}
(( segid " " and resid 297 and name HB ))
(( segid " " and resid 299 and name H ))
4.700 2.700 1.300 peak 2805 spectrum 1 weight 0.10000E+01 volume 0.44267E-03 ppm1 3.948 ppm2 7.492 CV 1
ASSI { 3499}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 342 and name HG13))
2.500 0.800 0.800 peak 3499 spectrum 1 weight 0.10000E+01 volume 0.29943E-02 ppm1 0.515 ppm2 1.307 CV 1
ASSI { 4497}
( segid " " and resid 346 and name HD1%)
( segid " " and resid 322 and name HD1%)
3.000 1.100 1.100 peak 4497 spectrum 1 weight 0.10000E+01 volume 0.31578E-02 ppm1 0.835 ppm2 -0.168 CV 1
ASSI { 4258}
(( segid " " and resid 227 and name HB2 ))
(( segid " " and resid 228 and name H ))
4.600 2.600 1.400 peak 4258 spectrum 1 weight 0.10000E+01 volume 0.10968E-02 ppm1 3.132 ppm2 8.426 CV 1
ASSI { 4719}
(( segid " " and resid 437 and name HA ))
(( segid " " and resid 440 and name HB2 ))
3.300 1.400 1.400 peak 4719 spectrum 1 weight 0.10000E+01 volume 0.97835E-03 ppm1 3.787 ppm2 1.815 CV 1
OR { 4719}
(( segid " " and resid 437 and name HA ))
(( segid " " and resid 440 and name HB3 ))
ASSI { 4221}
(( segid " " and resid 226 and name HB2 ))
(( segid " " and resid 226 and name HG2 ))
2.500 0.800 0.800 peak 4221 spectrum 1 weight 0.10000E+01 volume 0.49820E-02 ppm1 1.505 ppm2 1.247 CV 1
OR { 4221}
(( segid " " and resid 226 and name HB2 ))
(( segid " " and resid 226 and name HG3 ))
ASSI { 3288}
(( segid " " and resid 279 and name HB3 ))
(( segid " " and resid 279 and name H ))
4.500 2.500 1.500 peak 3288 spectrum 1 weight 0.10000E+01 volume 0.31578E-03 ppm1 1.416 ppm2 9.053 CV 1
ASSI { 1627}
( segid " " and resid 325 and name HE% )
( segid " " and resid 329 and name HD1%)
4.800 2.800 1.200 peak 1627 spectrum 1 weight 0.10000E+01 volume 0.75846E-03 ppm1 0.930 ppm2 0.124 CV 1
ASSI { 4427}
(( segid " " and resid 342 and name HG13))
( segid " " and resid 329 and name HD1%)
2.900 1.000 1.000 peak 4427 spectrum 1 weight 0.10000E+01 volume 0.51879E-03 ppm1 1.286 ppm2 0.123 CV 1
ASSI { 1574}
( segid " " and resid 386 and name HB% )
(( segid " " and resid 385 and name HA ))
4.500 2.500 1.500 peak 1574 spectrum 1 weight 0.10000E+01 volume 0.87402E-03 ppm1 1.451 ppm2 4.202 CV 1
ASSI { 3329}
( segid " " and resid 436 and name HD2%)
(( segid " " and resid 410 and name HB3 ))
2.500 2.500 3.500 peak 3329 spectrum 1 weight 0.10000E+01 volume 0.12575E-02 ppm1 0.858 ppm2 2.742 CV 1
OR { 3329}
( segid " " and resid 436 and name HD2%)
(( segid " " and resid 410 and name HB2 ))
ASSI { 2558}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 279 and name H ))
3.000 1.100 1.100 peak 2558 spectrum 1 weight 0.10000E+01 volume 0.19595E-02 ppm1 0.169 ppm2 9.022 CV 1
ASSI { 1572}
( segid " " and resid 423 and name HD1%)
(( segid " " and resid 430 and name HZ2 ))
3.300 1.400 1.400 peak 1572 spectrum 1 weight 0.10000E+01 volume 0.30281E-02 ppm1 0.883 ppm2 7.310 CV 1
ASSI { 4641}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 284 and name H ))
3.600 1.600 1.600 peak 4641 spectrum 1 weight 0.10000E+01 volume 0.33467E-02 ppm1 2.587 ppm2 8.102 CV 1
OR { 4641}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 284 and name H ))
ASSI { 2832}
(( segid " " and resid 319 and name HA ))
(( segid " " and resid 319 and name HG ))
4.500 2.500 1.500 peak 2832 spectrum 1 weight 0.10000E+01 volume 0.28477E-03 ppm1 2.289 ppm2 4.088 CV 1
ASSI { 4692}
( segid " " and resid 246 and name HB% )
( segid " " and resid 243 and name HD2%)
3.600 1.600 1.600 peak 4692 spectrum 1 weight 0.10000E+01 volume 0.30253E-02 ppm1 1.176 ppm2 0.164 CV 1
ASSI { 1936}
(( segid " " and resid 402 and name HA ))
(( segid " " and resid 402 and name H ))
3.700 1.700 1.700 peak 1936 spectrum 1 weight 0.10000E+01 volume 0.36934E-03 ppm1 3.397 ppm2 8.690 CV 1
ASSI { 4122}
( segid " " and resid 358 and name HE% )
(( segid " " and resid 358 and name HB3 ))
4.500 2.600 1.500 peak 4122 spectrum 1 weight 0.10000E+01 volume 0.14013E-02 ppm1 6.700 ppm2 2.953 CV 1
ASSI { 1256}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 247 and name HB3 ))
4.400 2.400 1.600 peak 1256 spectrum 1 weight 0.10000E+01 volume 0.45113E-03 ppm1 -0.168 ppm2 3.036 CV 1
OR { 1256}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 247 and name HB2 ))
ASSI { 2245}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 232 and name HA ))
2.600 0.800 0.800 peak 2245 spectrum 1 weight 0.10000E+01 volume 0.47169E-02 ppm1 1.009 ppm2 4.431 CV 1
ASSI { 4545}
( segid " " and resid 318 and name HD1%)
( segid " " and resid 368 and name HE% )
4.500 2.600 1.500 peak 4545 spectrum 1 weight 0.10000E+01 volume 0.10883E-02 ppm1 0.377 ppm2 6.767 CV 1
ASSI { 2546}
(( segid " " and resid 222 and name HB3 ))
(( segid " " and resid 222 and name HG2 ))
2.600 0.800 0.800 peak 2546 spectrum 1 weight 0.10000E+01 volume 0.18496E-02 ppm1 0.806 ppm2 0.390 CV 1
ASSI { 2621}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 212 and name HA ))
4.400 2.400 1.600 peak 2621 spectrum 1 weight 0.10000E+01 volume 0.75564E-03 ppm1 2.222 ppm2 3.235 CV 1
ASSI { 4337}
( segid " " and resid 436 and name HD1%)
(( segid " " and resid 436 and name HA ))
2.200 0.600 0.600 peak 4337 spectrum 1 weight 0.10000E+01 volume 0.41870E-02 ppm1 1.015 ppm2 3.912 CV 1
ASSI { 4390}
( segid " " and resid 183 and name HE% )
(( segid " " and resid 184 and name HD2 ))
2.500 2.500 3.500 peak 4390 spectrum 1 weight 0.10000E+01 volume 0.14379E-02 ppm1 2.041 ppm2 3.670 CV 1
ASSI { 3879}
( segid " " and resid 279 and name HD2%)
(( segid " " and resid 279 and name HA ))
3.300 1.400 1.400 peak 3879 spectrum 1 weight 0.10000E+01 volume 0.21597E-02 ppm1 0.372 ppm2 4.302 CV 1
ASSI { 134}
( segid " " and resid 416 and name HD1%)
(( segid " " and resid 426 and name HG3 ))
2.700 0.900 0.900 peak 134 spectrum 1 weight 0.10000E+01 volume 0.53261E-02 ppm1 0.853 ppm2 1.985 CV 1
ASSI { 580}
( segid " " and resid 212 and name HG1%)
( segid " " and resid 270 and name HE% )
4.000 2.000 2.000 peak 580 spectrum 1 weight 0.10000E+01 volume 0.46520E-03 ppm1 -0.350 ppm2 6.066 CV 1
ASSI { 2380}
(( segid " " and resid 307 and name HG ))
( segid " " and resid 307 and name HD1%)
3.000 1.200 1.200 peak 2380 spectrum 1 weight 0.10000E+01 volume 0.10009E-02 ppm1 2.309 ppm2 1.211 CV 1
ASSI { 4445}
(( segid " " and resid 420 and name HG13))
(( segid " " and resid 421 and name H ))
5.600 3.900 0.400 peak 4445 spectrum 1 weight 0.10000E+01 volume 0.71897E-03 ppm1 1.376 ppm2 8.382 CV 1
ASSI { 2197}
( segid " " and resid 396 and name HB% )
(( segid " " and resid 396 and name HA ))
2.100 0.600 0.600 peak 2197 spectrum 1 weight 0.10000E+01 volume 0.18315E-01 ppm1 1.341 ppm2 3.992 CV 1
ASSI { 28}
(( segid " " and resid 393 and name HB2 ))
(( segid " " and resid 442 and name HE3 ))
4.900 3.000 1.100 peak 28 spectrum 1 weight 0.10000E+01 volume 0.64567E-03 ppm1 2.081 ppm2 2.879 CV 1
OR { 28}
(( segid " " and resid 393 and name HB2 ))
(( segid " " and resid 442 and name HE2 ))
ASSI { 2065}
( segid " " and resid 310 and name HD2%)
(( segid " " and resid 310 and name HA ))
2.200 0.600 0.600 peak 2065 spectrum 1 weight 0.10000E+01 volume 0.52612E-02 ppm1 1.088 ppm2 4.326 CV 1
ASSI { 1819}
( segid " " and resid 373 and name HD1%)
(( segid " " and resid 323 and name H ))
2.800 2.800 3.200 peak 1819 spectrum 1 weight 0.10000E+01 volume 0.68230E-03 ppm1 -0.194 ppm2 7.774 CV 1
ASSI { 3757}
(( segid " " and resid 411 and name HB2 ))
(( segid " " and resid 412 and name H ))
4.300 2.300 1.700 peak 3757 spectrum 1 weight 0.10000E+01 volume 0.31014E-03 ppm1 2.818 ppm2 8.431 CV 1
ASSI { 4023}
( segid " " and resid 438 and name HB% )
( segid " " and resid 388 and name HE% )
2.600 0.800 0.800 peak 4023 spectrum 1 weight 0.10000E+01 volume 0.63806E-02 ppm1 1.599 ppm2 1.860 CV 1
ASSI { 2009}
(( segid " " and resid 331 and name HB3 ))
(( segid " " and resid 331 and name H ))
4.600 2.700 1.400 peak 2009 spectrum 1 weight 0.10000E+01 volume 0.36652E-03 ppm1 2.583 ppm2 7.177 CV 1
ASSI { 3044}
( segid " " and resid 358 and name HD% )
(( segid " " and resid 358 and name HB3 ))
2.800 1.000 1.000 peak 3044 spectrum 1 weight 0.10000E+01 volume 0.25375E-02 ppm1 7.014 ppm2 2.954 CV 1
ASSI { 4146}
(( segid " " and resid 420 and name HA ))
(( segid " " and resid 420 and name HG12))
2.400 0.700 0.700 peak 4146 spectrum 1 weight 0.10000E+01 volume 0.40600E-02 ppm1 3.980 ppm2 1.112 CV 1
ASSI { 70}
( segid " " and resid 202 and name HE% )
(( segid " " and resid 209 and name H ))
3.300 1.400 1.400 peak 70 spectrum 1 weight 0.10000E+01 volume 0.24276E-02 ppm1 1.869 ppm2 7.806 CV 1
ASSI { 3693}
(( segid " " and resid 339 and name HB ))
( segid " " and resid 329 and name HD1%)
4.600 2.600 1.400 peak 3693 spectrum 1 weight 0.10000E+01 volume 0.97553E-03 ppm1 1.540 ppm2 0.117 CV 1
ASSI { 1467}
( segid " " and resid 204 and name HE% )
(( segid " " and resid 204 and name HB3 ))
5.400 3.700 0.600 peak 1467 spectrum 1 weight 0.10000E+01 volume 0.52443E-03 ppm1 6.862 ppm2 2.596 CV 1
ASSI { 4277}
(( segid " " and resid 242 and name HB2 ))
( segid " " and resid 243 and name HD1%)
5.200 3.400 0.800 peak 4277 spectrum 1 weight 0.10000E+01 volume 0.47648E-03 ppm1 2.221 ppm2 0.014 CV 1
OR { 4277}
(( segid " " and resid 242 and name HB3 ))
( segid " " and resid 243 and name HD1%)
ASSI { 3805}
( segid " " and resid 192 and name HD1%)
(( segid " " and resid 192 and name HA ))
5.200 3.400 0.800 peak 3805 spectrum 1 weight 0.10000E+01 volume 0.71897E-03 ppm1 0.872 ppm2 4.874 CV 1
ASSI { 3663}
(( segid " " and resid 378 and name HG2 ))
(( segid " " and resid 378 and name HE3 ))
3.100 1.200 1.200 peak 3663 spectrum 1 weight 0.10000E+01 volume 0.26870E-02 ppm1 1.495 ppm2 2.952 CV 1
OR { 3663}
(( segid " " and resid 378 and name HG2 ))
(( segid " " and resid 378 and name HE2 ))
ASSI { 2598}
( segid " " and resid 246 and name HB% )
( segid " " and resid 243 and name HD1%)
5.000 3.100 1.000 peak 2598 spectrum 1 weight 0.10000E+01 volume 0.93607E-03 ppm1 1.177 ppm2 0.011 CV 1
ASSI { 2907}
(( segid " " and resid 225 and name HG2 ))
(( segid " " and resid 221 and name HA ))
3.500 1.500 1.500 peak 2907 spectrum 1 weight 0.10000E+01 volume 0.39472E-03 ppm1 2.809 ppm2 3.903 CV 1
ASSI { 2358}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 277 and name HD22))
5.200 3.400 0.800 peak 2358 spectrum 1 weight 0.10000E+01 volume 0.82611E-03 ppm1 2.586 ppm2 6.128 CV 1
OR { 2358}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 277 and name HD22))
ASSI { 3103}
(( segid " " and resid 371 and name HA ))
( segid " " and resid 371 and name HG2%)
2.700 0.900 0.900 peak 3103 spectrum 1 weight 0.10000E+01 volume 0.23345E-02 ppm1 3.713 ppm2 0.961 CV 1
ASSI { 4587}
(( segid " " and resid 282 and name HB2 ))
(( segid " " and resid 282 and name HA ))
2.500 0.800 0.800 peak 4587 spectrum 1 weight 0.10000E+01 volume 0.81991E-02 ppm1 1.856 ppm2 4.017 CV 1
ASSI { 3667}
(( segid " " and resid 253 and name HB ))
( segid " " and resid 255 and name HD2%)
3.700 1.700 1.700 peak 3667 spectrum 1 weight 0.10000E+01 volume 0.94172E-03 ppm1 3.520 ppm2 0.788 CV 1
ASSI { 2911}
(( segid " " and resid 368 and name HA ))
( segid " " and resid 371 and name HG2%)
4.500 2.500 1.500 peak 2911 spectrum 1 weight 0.10000E+01 volume 0.11278E-02 ppm1 5.167 ppm2 0.967 CV 1
ASSI { 4123}
( segid " " and resid 420 and name HG2%)
(( segid " " and resid 420 and name HA ))
2.200 0.600 0.600 peak 4123 spectrum 1 weight 0.10000E+01 volume 0.12572E-01 ppm1 0.805 ppm2 3.979 CV 1
ASSI { 4308}
(( segid " " and resid 267 and name HB2 ))
( segid " " and resid 267 and name HD1%)
3.300 1.300 1.300 peak 4308 spectrum 1 weight 0.10000E+01 volume 0.79227E-03 ppm1 1.550 ppm2 0.918 CV 1
OR { 4308}
(( segid " " and resid 267 and name HB2 ))
( segid " " and resid 267 and name HD2%)
ASSI { 2591}
(( segid " " and resid 348 and name HB2 ))
(( segid " " and resid 348 and name HA ))
3.500 1.500 1.500 peak 2591 spectrum 1 weight 0.10000E+01 volume 0.15958E-02 ppm1 1.889 ppm2 4.516 CV 1
ASSI { 4290}
(( segid " " and resid 296 and name HG2 ))
( segid " " and resid 300 and name HG1%)
3.100 1.200 1.200 peak 4290 spectrum 1 weight 0.10000E+01 volume 0.20498E-02 ppm1 2.411 ppm2 0.074 CV 1
OR { 4290}
(( segid " " and resid 296 and name HG3 ))
( segid " " and resid 300 and name HG1%)
ASSI { 2102}
(( segid " " and resid 226 and name HG2 ))
(( segid " " and resid 226 and name H ))
3.900 1.900 1.900 peak 2102 spectrum 1 weight 0.10000E+01 volume 0.12970E-02 ppm1 1.277 ppm2 7.430 CV 1
ASSI { 4264}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 306 and name HA ))
3.600 1.600 1.600 peak 4264 spectrum 1 weight 0.10000E+01 volume 0.17481E-02 ppm1 -0.358 ppm2 3.646 CV 1
ASSI { 4384}
(( segid " " and resid 373 and name HB2 ))
(( segid " " and resid 373 and name HA ))
4.200 2.200 1.800 peak 4384 spectrum 1 weight 0.10000E+01 volume 0.32424E-03 ppm1 0.411 ppm2 2.352 CV 1
ASSI { 2857}
( segid " " and resid 446 and name HB% )
(( segid " " and resid 399 and name H ))
3.300 3.300 2.700 peak 2857 spectrum 1 weight 0.10000E+01 volume 0.28477E-03 ppm1 1.262 ppm2 8.367 CV 1
ASSI { 3870}
(( segid " " and resid 340 and name HA ))
(( segid " " and resid 341 and name H ))
3.400 1.400 1.400 peak 3870 spectrum 1 weight 0.10000E+01 volume 0.16156E-02 ppm1 4.014 ppm2 8.543 CV 1
ASSI { 2565}
( segid " " and resid 212 and name HG1%)
(( segid " " and resid 213 and name H ))
2.900 1.100 1.100 peak 2565 spectrum 1 weight 0.10000E+01 volume 0.16579E-02 ppm1 -0.344 ppm2 5.879 CV 1
ASSI { 998}
(( segid " " and resid 308 and name HB3 ))
(( segid " " and resid 308 and name HG2 ))
2.500 0.800 0.800 peak 998 spectrum 1 weight 0.10000E+01 volume 0.97327E-02 ppm1 1.851 ppm2 1.554 CV 1
OR { 998}
(( segid " " and resid 308 and name HB3 ))
(( segid " " and resid 308 and name HD2 ))
OR { 998}
(( segid " " and resid 308 and name HB3 ))
(( segid " " and resid 308 and name HD3 ))
ASSI { 3995}
(( segid " " and resid 374 and name HE2 ))
(( segid " " and resid 374 and name H ))
4.800 2.900 1.200 peak 3995 spectrum 1 weight 0.10000E+01 volume 0.32988E-03 ppm1 2.971 ppm2 6.344 CV 1
ASSI { 1536}
( segid " " and resid 246 and name HB% )
(( segid " " and resid 251 and name HG2 ))
3.600 1.700 1.700 peak 1536 spectrum 1 weight 0.10000E+01 volume 0.27293E-02 ppm1 1.175 ppm2 2.164 CV 1
OR { 1536}
( segid " " and resid 246 and name HB% )
(( segid " " and resid 251 and name HG3 ))
ASSI { 1970}
(( segid " " and resid 339 and name HG12))
(( segid " " and resid 339 and name HA ))
3.100 1.200 1.200 peak 1970 spectrum 1 weight 0.10000E+01 volume 0.58080E-03 ppm1 0.571 ppm2 3.027 CV 1
ASSI { 874}
( segid " " and resid 357 and name HD2%)
(( segid " " and resid 347 and name H ))
3.300 1.400 1.400 peak 874 spectrum 1 weight 0.10000E+01 volume 0.15902E-02 ppm1 0.868 ppm2 8.996 CV 1
ASSI { 428}
(( segid " " and resid 309 and name HG3 ))
( segid " " and resid 283 and name HD2%)
3.100 1.200 1.200 peak 428 spectrum 1 weight 0.10000E+01 volume 0.32199E-02 ppm1 2.163 ppm2 0.894 CV 1
ASSI { 3848}
( segid " " and resid 435 and name HD1%)
(( segid " " and resid 438 and name H ))
3.000 3.000 3.000 peak 3848 spectrum 1 weight 0.10000E+01 volume 0.47366E-03 ppm1 0.870 ppm2 7.579 CV 1
ASSI { 4614}
( segid " " and resid 329 and name HD1%)
(( segid " " and resid 329 and name H ))
3.400 1.400 1.400 peak 4614 spectrum 1 weight 0.10000E+01 volume 0.14943E-02 ppm1 0.118 ppm2 7.950 CV 1
ASSI { 1813}
( segid " " and resid 267 and name HD1%)
( segid " " and resid 212 and name HG1%)
3.600 1.600 1.600 peak 1813 spectrum 1 weight 0.10000E+01 volume 0.11757E-02 ppm1 0.915 ppm2 -0.345 CV 1
ASSI { 4408}
( segid " " and resid 236 and name HD1%)
( segid " " and resid 258 and name HE% )
5.600 3.900 0.400 peak 4408 spectrum 1 weight 0.10000E+01 volume 0.51879E-03 ppm1 0.833 ppm2 6.633 CV 1
ASSI { 2445}
( segid " " and resid 329 and name HD1%)
(( segid " " and resid 329 and name HG13))
2.600 0.800 0.800 peak 2445 spectrum 1 weight 0.10000E+01 volume 0.16071E-02 ppm1 0.117 ppm2 0.284 CV 1
ASSI { 3642}
(( segid " " and resid 382 and name HZ3 ))
(( segid " " and resid 382 and name HH2 ))
3.200 1.300 1.300 peak 3642 spectrum 1 weight 0.10000E+01 volume 0.12631E-02 ppm1 6.869 ppm2 7.173 CV 1
OR { 3642}
(( segid " " and resid 382 and name HZ3 ))
(( segid " " and resid 382 and name HE3 ))
ASSI { 2993}
(( segid " " and resid 301 and name HG3 ))
(( segid " " and resid 301 and name H ))
3.400 1.500 1.500 peak 2993 spectrum 1 weight 0.10000E+01 volume 0.39218E-02 ppm1 2.297 ppm2 8.049 CV 1
ASSI { 2554}
( segid " " and resid 337 and name HE% )
( segid " " and resid 231 and name HD% )
3.900 1.900 1.900 peak 2554 spectrum 1 weight 0.10000E+01 volume 0.11926E-02 ppm1 1.803 ppm2 6.764 CV 1
ASSI { 3732}
( segid " " and resid 391 and name HD2%)
(( segid " " and resid 391 and name HB2 ))
3.200 1.300 1.300 peak 3732 spectrum 1 weight 0.10000E+01 volume 0.39444E-02 ppm1 0.531 ppm2 1.103 CV 1
ASSI { 2335}
( segid " " and resid 339 and name HG2%)
(( segid " " and resid 329 and name HG13))
3.500 1.600 1.600 peak 2335 spectrum 1 weight 0.10000E+01 volume 0.93607E-03 ppm1 0.707 ppm2 0.345 CV 1
ASSI { 4191}
(( segid " " and resid 272 and name HG3 ))
(( segid " " and resid 274 and name H ))
4.900 3.000 1.100 peak 4191 spectrum 1 weight 0.10000E+01 volume 0.64285E-03 ppm1 1.802 ppm2 7.037 CV 1
OR { 4191}
(( segid " " and resid 272 and name HG2 ))
(( segid " " and resid 274 and name H ))
ASSI { 2023}
( segid " " and resid 186 and name HD1%)
(( segid " " and resid 186 and name H ))
4.000 2.000 2.000 peak 2023 spectrum 1 weight 0.10000E+01 volume 0.27546E-02 ppm1 0.776 ppm2 8.052 CV 1
ASSI { 4747}
(( segid " " and resid 185 and name HB2 ))
(( segid " " and resid 185 and name HA ))
2.500 0.800 0.800 peak 4747 spectrum 1 weight 0.10000E+01 volume 0.44126E-02 ppm1 2.755 ppm2 4.568 CV 1
ASSI { 4640}
(( segid " " and resid 388 and name HB2 ))
(( segid " " and resid 388 and name HB3 ))
2.000 0.500 0.500 peak 4640 spectrum 1 weight 0.10000E+01 volume 0.32114E-02 ppm1 1.542 ppm2 1.354 CV 1
ASSI { 1028}
( segid " " and resid 367 and name HD2%)
(( segid " " and resid 368 and name HA ))
4.300 2.300 1.700 peak 1028 spectrum 1 weight 0.10000E+01 volume 0.45677E-03 ppm1 0.774 ppm2 5.118 CV 1
ASSI { 4305}
( segid " " and resid 255 and name HD1%)
( segid " " and resid 258 and name HE% )
4.000 2.000 2.000 peak 4305 spectrum 1 weight 0.10000E+01 volume 0.10178E-02 ppm1 0.597 ppm2 6.642 CV 1
ASSI { 3639}
(( segid " " and resid 322 and name HB ))
( segid " " and resid 322 and name HD1%)
3.800 1.800 1.800 peak 3639 spectrum 1 weight 0.10000E+01 volume 0.85714E-03 ppm1 1.334 ppm2 -0.167 CV 1
ASSI { 2354}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 306 and name H ))
2.300 0.600 0.600 peak 2354 spectrum 1 weight 0.10000E+01 volume 0.35414E-02 ppm1 -0.358 ppm2 8.005 CV 1
ASSI { 3333}
( segid " " and resid 328 and name HG2%)
(( segid " " and resid 328 and name HB ))
2.400 0.700 0.700 peak 3333 spectrum 1 weight 0.10000E+01 volume 0.39021E-02 ppm1 0.760 ppm2 2.386 CV 1
OR { 3333}
( segid " " and resid 328 and name HG1%)
(( segid " " and resid 328 and name HB ))
ASSI { 2434}
(( segid " " and resid 430 and name HE3 ))
(( segid " " and resid 430 and name HA ))
6.000 5.200 0.000 peak 2434 spectrum 1 weight 0.10000E+01 volume 0.37498E-03 ppm1 7.557 ppm2 4.417 CV 1
ASSI { 2359}
(( segid " " and resid 295 and name HB ))
(( segid " " and resid 295 and name HA ))
3.900 1.900 1.900 peak 2359 spectrum 1 weight 0.10000E+01 volume 0.32706E-03 ppm1 4.379 ppm2 4.736 CV 1
ASSI { 180}
( segid " " and resid 325 and name HE% )
(( segid " " and resid 322 and name HA ))
3.700 1.700 1.700 peak 180 spectrum 1 weight 0.10000E+01 volume 0.11870E-02 ppm1 0.927 ppm2 3.346 CV 1
ASSI { 542}
(( segid " " and resid 308 and name HD2 ))
(( segid " " and resid 307 and name H ))
3.900 1.900 1.900 peak 542 spectrum 1 weight 0.10000E+01 volume 0.11673E-02 ppm1 1.527 ppm2 8.709 CV 1
OR { 542}
(( segid " " and resid 308 and name HD3 ))
(( segid " " and resid 307 and name H ))
ASSI { 552}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 279 and name H ))
4.900 3.000 1.100 peak 552 spectrum 1 weight 0.10000E+01 volume 0.81765E-03 ppm1 2.588 ppm2 9.022 CV 1
OR { 552}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 279 and name H ))
ASSI { 4042}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 203 and name H ))
4.200 2.200 1.800 peak 4042 spectrum 1 weight 0.10000E+01 volume 0.16015E-02 ppm1 2.221 ppm2 8.232 CV 1
ASSI { 2370}
(( segid " " and resid 394 and name HA ))
( segid " " and resid 394 and name HG2%)
4.300 2.300 1.700 peak 2370 spectrum 1 weight 0.10000E+01 volume 0.45959E-03 ppm1 4.616 ppm2 1.243 CV 1
ASSI { 3482}
( segid " " and resid 373 and name HD1%)
(( segid " " and resid 323 and name HB ))
3.100 1.200 1.200 peak 3482 spectrum 1 weight 0.10000E+01 volume 0.16466E-02 ppm1 -0.195 ppm2 1.735 CV 1
ASSI { 3397}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 376 and name H ))
4.400 2.400 1.600 peak 3397 spectrum 1 weight 0.10000E+01 volume 0.51315E-03 ppm1 2.221 ppm2 9.495 CV 1
ASSI { 2662}
(( segid " " and resid 260 and name HA ))
(( segid " " and resid 260 and name HB2 ))
3.200 1.300 1.300 peak 2662 spectrum 1 weight 0.10000E+01 volume 0.64003E-03 ppm1 4.324 ppm2 2.081 CV 1
OR { 2662}
(( segid " " and resid 260 and name HA ))
(( segid " " and resid 260 and name HB3 ))
ASSI { 1848}
( segid " " and resid 267 and name HD1%)
( segid " " and resid 212 and name HG2%)
3.300 1.400 1.400 peak 1848 spectrum 1 weight 0.10000E+01 volume 0.21597E-02 ppm1 0.910 ppm2 -0.162 CV 1
ASSI { 1012}
(( segid " " and resid 287 and name HB3 ))
( segid " " and resid 356 and name HG1%)
3.600 1.600 1.600 peak 1012 spectrum 1 weight 0.10000E+01 volume 0.40036E-03 ppm1 2.442 ppm2 0.770 CV 1
ASSI { 2531}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 287 and name HA ))
2.800 1.000 1.000 peak 2531 spectrum 1 weight 0.10000E+01 volume 0.21400E-02 ppm1 -0.356 ppm2 3.489 CV 1
ASSI { 3699}
(( segid " " and resid 306 and name HB3 ))
( segid " " and resid 306 and name HD2%)
4.500 2.500 1.500 peak 3699 spectrum 1 weight 0.10000E+01 volume 0.47084E-03 ppm1 0.258 ppm2 -0.366 CV 1
ASSI { 1170}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 344 and name H ))
4.300 2.300 1.700 peak 1170 spectrum 1 weight 0.10000E+01 volume 0.73589E-03 ppm1 0.515 ppm2 7.683 CV 1
ASSI { 2898}
(( segid " " and resid 202 and name HB3 ))
(( segid " " and resid 202 and name HA ))
3.600 1.600 1.600 peak 2898 spectrum 1 weight 0.10000E+01 volume 0.53007E-03 ppm1 2.261 ppm2 4.429 CV 1
ASSI { 3685}
(( segid " " and resid 282 and name HG2 ))
(( segid " " and resid 282 and name H ))
2.400 0.700 0.700 peak 3685 spectrum 1 weight 0.10000E+01 volume 0.31550E-02 ppm1 2.398 ppm2 8.693 CV 1
ASSI { 3866}
( segid " " and resid 217 and name HG2%)
( segid " " and resid 217 and name HD1%)
3.200 1.300 1.300 peak 3866 spectrum 1 weight 0.10000E+01 volume 0.84783E-02 ppm1 0.463 ppm2 -0.045 CV 1
ASSI { 3276}
(( segid " " and resid 321 and name HB3 ))
(( segid " " and resid 321 and name HA ))
4.000 2.000 2.000 peak 3276 spectrum 1 weight 0.10000E+01 volume 0.31860E-03 ppm1 1.599 ppm2 3.976 CV 1
ASSI { 2850}
(( segid " " and resid 220 and name HA ))
( segid " " and resid 220 and name HG2%)
2.700 0.900 0.900 peak 2850 spectrum 1 weight 0.10000E+01 volume 0.27575E-02 ppm1 3.326 ppm2 1.117 CV 1
OR { 2850}
(( segid " " and resid 220 and name HA ))
( segid " " and resid 220 and name HG1%)
ASSI { 2381}
( segid " " and resid 377 and name HE% )
(( segid " " and resid 407 and name H ))
4.900 3.000 1.100 peak 2381 spectrum 1 weight 0.10000E+01 volume 0.34680E-03 ppm1 2.000 ppm2 7.800 CV 1
ASSI { 1143}
( segid " " and resid 263 and name HG2%)
(( segid " " and resid 220 and name H ))
2.700 2.700 3.300 peak 1143 spectrum 1 weight 0.10000E+01 volume 0.92197E-03 ppm1 0.803 ppm2 8.661 CV 1
ASSI { 2116}
( segid " " and resid 372 and name HG1%)
(( segid " " and resid 373 and name HA ))
3.600 1.600 1.600 peak 2116 spectrum 1 weight 0.10000E+01 volume 0.16804E-02 ppm1 0.644 ppm2 2.318 CV 1
ASSI { 2582}
(( segid " " and resid 430 and name HD1 ))
(( segid " " and resid 430 and name HA ))
3.500 1.500 1.500 peak 2582 spectrum 1 weight 0.10000E+01 volume 0.73871E-03 ppm1 7.183 ppm2 4.402 CV 1
ASSI { 3326}
(( segid " " and resid 249 and name HD3 ))
(( segid " " and resid 249 and name HA ))
4.400 2.400 1.600 peak 3326 spectrum 1 weight 0.10000E+01 volume 0.12180E-02 ppm1 3.018 ppm2 4.341 CV 1
ASSI { 4769}
(( segid " " and resid 320 and name HA ))
(( segid " " and resid 320 and name HD1 ))
3.400 1.400 1.400 peak 4769 spectrum 1 weight 0.10000E+01 volume 0.54417E-03 ppm1 3.830 ppm2 7.243 CV 1
ASSI { 1741}
( segid " " and resid 330 and name HB% )
(( segid " " and resid 327 and name HA ))
2.800 1.000 1.000 peak 1741 spectrum 1 weight 0.10000E+01 volume 0.44803E-02 ppm1 1.555 ppm2 4.457 CV 1
ASSI { 1793}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 313 and name HB3 ))
3.300 1.300 1.300 peak 1793 spectrum 1 weight 0.10000E+01 volume 0.13985E-02 ppm1 0.551 ppm2 2.845 CV 1
OR { 1793}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 313 and name HB2 ))
ASSI { 2187}
( segid " " and resid 223 and name HE% )
(( segid " " and resid 223 and name HA ))
2.800 2.800 3.200 peak 2187 spectrum 1 weight 0.10000E+01 volume 0.69923E-03 ppm1 6.642 ppm2 4.667 CV 1
ASSI { 4039}
( segid " " and resid 209 and name HD1%)
( segid " " and resid 209 and name HD2%)
2.700 0.900 0.900 peak 4039 spectrum 1 weight 0.10000E+01 volume 0.38175E-02 ppm1 0.188 ppm2 -0.902 CV 1
ASSI { 289}
(( segid " " and resid 442 and name HE3 ))
( segid " " and resid 398 and name HD1%)
2.400 0.700 0.700 peak 289 spectrum 1 weight 0.10000E+01 volume 0.69500E-02 ppm1 2.885 ppm2 0.561 CV 1
OR { 289}
(( segid " " and resid 442 and name HE2 ))
( segid " " and resid 398 and name HD1%)
OR { 289}
(( segid " " and resid 442 and name HE3 ))
(( segid " " and resid 398 and name HG12))
ASSI { 286}
( segid " " and resid 212 and name HG1%)
( segid " " and resid 247 and name HD% )
4.400 2.500 1.600 peak 286 spectrum 1 weight 0.10000E+01 volume 0.66538E-03 ppm1 -0.344 ppm2 7.314 CV 1
ASSI { 459}
( segid " " and resid 357 and name HD1%)
(( segid " " and resid 354 and name HA ))
4.400 2.400 1.600 peak 459 spectrum 1 weight 0.10000E+01 volume 0.16861E-02 ppm1 0.673 ppm2 4.166 CV 1
ASSI { 3962}
(( segid " " and resid 186 and name HB3 ))
( segid " " and resid 186 and name HD2%)
2.100 0.500 0.500 peak 3962 spectrum 1 weight 0.10000E+01 volume 0.36747E-01 ppm1 1.529 ppm2 0.801 CV 1
OR { 3962}
(( segid " " and resid 186 and name HB2 ))
( segid " " and resid 186 and name HD1%)
OR { 3962}
(( segid " " and resid 186 and name HB2 ))
( segid " " and resid 186 and name HD2%)
OR { 3962}
(( segid " " and resid 186 and name HB3 ))
( segid " " and resid 186 and name HD1%)
ASSI { 3894}
(( segid " " and resid 333 and name HB3 ))
(( segid " " and resid 333 and name HA ))
2.600 0.800 0.800 peak 3894 spectrum 1 weight 0.10000E+01 volume 0.51738E-02 ppm1 1.505 ppm2 4.000 CV 1
ASSI { 506}
(( segid " " and resid 287 and name HB2 ))
( segid " " and resid 356 and name HG1%)
4.700 2.700 1.300 peak 506 spectrum 1 weight 0.10000E+01 volume 0.36370E-03 ppm1 3.034 ppm2 0.790 CV 1
ASSI { 2355}
( segid " " and resid 245 and name HB% )
(( segid " " and resid 243 and name H ))
4.100 2.100 1.900 peak 2355 spectrum 1 weight 0.10000E+01 volume 0.10122E-02 ppm1 1.330 ppm2 7.868 CV 1
ASSI { 2463}
(( segid " " and resid 433 and name HG2 ))
(( segid " " and resid 433 and name H ))
3.100 1.200 1.200 peak 2463 spectrum 1 weight 0.10000E+01 volume 0.14436E-02 ppm1 2.232 ppm2 8.315 CV 1
ASSI { 1485}
(( segid " " and resid 185 and name HB3 ))
(( segid " " and resid 185 and name H ))
3.900 1.900 1.900 peak 1485 spectrum 1 weight 0.10000E+01 volume 0.53571E-03 ppm1 2.664 ppm2 8.514 CV 1
ASSI { 1946}
(( segid " " and resid 308 and name HD3 ))
(( segid " " and resid 308 and name HE2 ))
1.700 0.400 0.500 peak 1946 spectrum 1 weight 0.10000E+01 volume 0.37724E-01 ppm1 1.530 ppm2 2.851 CV 1
OR { 1946}
(( segid " " and resid 308 and name HD2 ))
(( segid " " and resid 308 and name HE3 ))
OR { 1946}
(( segid " " and resid 308 and name HD2 ))
(( segid " " and resid 308 and name HE2 ))
OR { 1946}
(( segid " " and resid 308 and name HD3 ))
(( segid " " and resid 308 and name HE3 ))
ASSI { 698}
( segid " " and resid 373 and name HD1%)
(( segid " " and resid 324 and name H ))
3.300 1.400 1.400 peak 698 spectrum 1 weight 0.10000E+01 volume 0.13703E-02 ppm1 -0.196 ppm2 8.477 CV 1
ASSI { 4599}
(( segid " " and resid 331 and name HD3 ))
(( segid " " and resid 331 and name HA ))
2.400 2.400 3.600 peak 4599 spectrum 1 weight 0.10000E+01 volume 0.33439E-02 ppm1 1.640 ppm2 4.535 CV 1
ASSI { 3098}
(( segid " " and resid 228 and name HB2 ))
(( segid " " and resid 229 and name H ))
5.000 3.100 1.000 peak 3098 spectrum 1 weight 0.10000E+01 volume 0.49340E-03 ppm1 1.797 ppm2 9.611 CV 1
ASSI { 4576}
(( segid " " and resid 187 and name HB3 ))
(( segid " " and resid 187 and name H ))
3.700 1.700 1.700 peak 4576 spectrum 1 weight 0.10000E+01 volume 0.23402E-02 ppm1 1.673 ppm2 8.515 CV 1
ASSI { 3297}
(( segid " " and resid 413 and name HB3 ))
(( segid " " and resid 414 and name H ))
3.100 1.200 1.200 peak 3297 spectrum 1 weight 0.10000E+01 volume 0.85996E-03 ppm1 2.989 ppm2 7.672 CV 1
ASSI { 2161}
(( segid " " and resid 217 and name HG12))
(( segid " " and resid 218 and name H ))
5.200 3.400 0.800 peak 2161 spectrum 1 weight 0.10000E+01 volume 0.45677E-03 ppm1 0.528 ppm2 7.961 CV 1
ASSI { 2821}
( segid " " and resid 300 and name HG2%)
(( segid " " and resid 300 and name H ))
2.300 0.700 0.700 peak 2821 spectrum 1 weight 0.10000E+01 volume 0.42744E-02 ppm1 0.538 ppm2 7.917 CV 1
ASSI { 2497}
(( segid " " and resid 257 and name HA ))
( segid " " and resid 258 and name HD% )
5.500 3.700 0.500 peak 2497 spectrum 1 weight 0.10000E+01 volume 0.52725E-03 ppm1 4.408 ppm2 7.036 CV 1
ASSI { 3806}
(( segid " " and resid 283 and name HB2 ))
( segid " " and resid 283 and name HD2%)
2.800 0.900 0.900 peak 3806 spectrum 1 weight 0.10000E+01 volume 0.10770E-02 ppm1 2.336 ppm2 0.896 CV 1
ASSI { 1981}
(( segid " " and resid 257 and name HA ))
(( segid " " and resid 257 and name HB2 ))
3.100 1.200 1.200 peak 1981 spectrum 1 weight 0.10000E+01 volume 0.21795E-02 ppm1 4.401 ppm2 2.407 CV 1
OR { 1981}
(( segid " " and resid 257 and name HA ))
(( segid " " and resid 257 and name HB3 ))
ASSI { 3709}
(( segid " " and resid 400 and name HG3 ))
(( segid " " and resid 401 and name H ))
3.400 1.400 1.400 peak 3709 spectrum 1 weight 0.10000E+01 volume 0.32537E-02 ppm1 2.191 ppm2 7.840 CV 1
ASSI { 174}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 351 and name HE21))
4.700 2.800 1.300 peak 174 spectrum 1 weight 0.10000E+01 volume 0.60337E-03 ppm1 2.150 ppm2 6.778 CV 1
ASSI { 2090}
( segid " " and resid 247 and name HE% )
( segid " " and resid 255 and name HD2%)
3.600 1.600 1.600 peak 2090 spectrum 1 weight 0.10000E+01 volume 0.18468E-02 ppm1 6.474 ppm2 0.794 CV 1
ASSI { 3141}
( segid " " and resid 283 and name HD1%)
(( segid " " and resid 283 and name HG ))
1.800 0.400 0.400 peak 3141 spectrum 1 weight 0.10000E+01 volume 0.12583E-01 ppm1 0.719 ppm2 1.555 CV 1
ASSI { 3372}
(( segid " " and resid 256 and name HG3 ))
(( segid " " and resid 254 and name HD22))
4.000 2.000 2.000 peak 3372 spectrum 1 weight 0.10000E+01 volume 0.10939E-02 ppm1 2.388 ppm2 6.853 CV 1
ASSI { 2473}
(( segid " " and resid 375 and name HB2 ))
(( segid " " and resid 375 and name H ))
3.600 1.600 1.600 peak 2473 spectrum 1 weight 0.10000E+01 volume 0.23656E-02 ppm1 1.876 ppm2 8.469 CV 1
ASSI { 2064}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 360 and name HB3 ))
4.300 2.400 1.700 peak 2064 spectrum 1 weight 0.10000E+01 volume 0.91069E-03 ppm1 0.378 ppm2 3.098 CV 1
ASSI { 1908}
( segid " " and resid 306 and name HD2%)
( segid " " and resid 290 and name HB% )
2.700 0.900 0.900 peak 1908 spectrum 1 weight 0.10000E+01 volume 0.39613E-02 ppm1 -0.358 ppm2 1.532 CV 1
ASSI { 3150}
(( segid " " and resid 282 and name HG2 ))
(( segid " " and resid 282 and name HA ))
2.600 0.800 0.800 peak 3150 spectrum 1 weight 0.10000E+01 volume 0.63693E-02 ppm1 2.397 ppm2 3.993 CV 1
ASSI { 3572}
(( segid " " and resid 421 and name HG3 ))
(( segid " " and resid 422 and name H ))
4.500 2.600 1.500 peak 3572 spectrum 1 weight 0.10000E+01 volume 0.93607E-03 ppm1 1.343 ppm2 8.201 CV 1
ASSI { 1704}
( segid " " and resid 339 and name HG2%)
(( segid " " and resid 339 and name HB ))
2.100 0.500 0.500 peak 1704 spectrum 1 weight 0.10000E+01 volume 0.12186E-01 ppm1 0.706 ppm2 1.540 CV 1
OR { 1704}
( segid " " and resid 339 and name HG2%)
(( segid " " and resid 339 and name HG13))
ASSI { 4444}
(( segid " " and resid 193 and name HA ))
(( segid " " and resid 193 and name HB2 ))
4.000 2.000 2.000 peak 4444 spectrum 1 weight 0.10000E+01 volume 0.43703E-03 ppm1 4.106 ppm2 2.319 CV 1
ASSI { 1562}
(( segid " " and resid 336 and name HD2 ))
(( segid " " and resid 335 and name H ))
6.000 5.000 0.000 peak 1562 spectrum 1 weight 0.10000E+01 volume 0.34680E-03 ppm1 1.456 ppm2 8.869 CV 1
ASSI { 4579}
( segid " " and resid 436 and name HD1%)
(( segid " " and resid 402 and name HA ))
2.500 0.800 0.800 peak 4579 spectrum 1 weight 0.10000E+01 volume 0.26503E-02 ppm1 1.017 ppm2 3.365 CV 1
ASSI { 4238}
(( segid " " and resid 368 and name HZ ))
( segid " " and resid 368 and name HE% )
3.200 1.300 1.300 peak 4238 spectrum 1 weight 0.10000E+01 volume 0.65131E-03 ppm1 6.289 ppm2 6.744 CV 1
ASSI { 4088}
(( segid " " and resid 398 and name HB ))
(( segid " " and resid 398 and name HA ))
4.000 2.000 2.000 peak 4088 spectrum 1 weight 0.10000E+01 volume 0.32706E-03 ppm1 1.777 ppm2 3.434 CV 1
ASSI { 4014}
(( segid " " and resid 426 and name HG3 ))
(( segid " " and resid 426 and name HA ))
3.200 1.300 1.300 peak 4014 spectrum 1 weight 0.10000E+01 volume 0.22302E-02 ppm1 1.992 ppm2 3.686 CV 1
ASSI { 2623}
(( segid " " and resid 344 and name HA ))
(( segid " " and resid 347 and name H ))
3.800 1.800 1.800 peak 2623 spectrum 1 weight 0.10000E+01 volume 0.41447E-03 ppm1 3.875 ppm2 9.001 CV 1
ASSI { 4591}
(( segid " " and resid 406 and name HG3 ))
(( segid " " and resid 406 and name HB2 ))
2.800 1.000 1.000 peak 4591 spectrum 1 weight 0.10000E+01 volume 0.21541E-02 ppm1 2.095 ppm2 1.921 CV 1
OR { 4591}
(( segid " " and resid 406 and name HG3 ))
(( segid " " and resid 406 and name HB3 ))
ASSI { 2454}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 375 and name HA ))
4.600 2.600 1.400 peak 2454 spectrum 1 weight 0.10000E+01 volume 0.50469E-03 ppm1 2.220 ppm2 4.690 CV 1
ASSI { 642}
(( segid " " and resid 415 and name HB2 ))
(( segid " " and resid 415 and name HB3 ))
2.400 0.700 0.700 peak 642 spectrum 1 weight 0.10000E+01 volume 0.14915E-02 ppm1 2.760 ppm2 2.584 CV 1
ASSI { 2942}
(( segid " " and resid 379 and name HB3 ))
(( segid " " and resid 379 and name HD2 ))
4.800 2.900 1.200 peak 2942 spectrum 1 weight 0.10000E+01 volume 0.66538E-03 ppm1 1.620 ppm2 3.634 CV 1
ASSI { 4387}
(( segid " " and resid 382 and name HE3 ))
(( segid " " and resid 435 and name HA ))
5.600 3.900 0.400 peak 4387 spectrum 1 weight 0.10000E+01 volume 0.26785E-03 ppm1 7.168 ppm2 3.855 CV 1
ASSI { 3889}
(( segid " " and resid 299 and name HB2 ))
( segid " " and resid 300 and name HG1%)
4.000 2.000 2.000 peak 3889 spectrum 1 weight 0.10000E+01 volume 0.37498E-03 ppm1 1.468 ppm2 0.075 CV 1
ASSI { 1929}
(( segid " " and resid 293 and name HD2 ))
( segid " " and resid 294 and name HG2%)
4.400 2.400 1.600 peak 1929 spectrum 1 weight 0.10000E+01 volume 0.70487E-03 ppm1 3.072 ppm2 1.217 CV 1
ASSI { 3312}
(( segid " " and resid 326 and name HB3 ))
(( segid " " and resid 326 and name HA ))
4.000 2.000 2.000 peak 3312 spectrum 1 weight 0.10000E+01 volume 0.34398E-03 ppm1 2.678 ppm2 4.409 CV 1
ASSI { 1665}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 209 and name HA ))
4.600 2.600 1.400 peak 1665 spectrum 1 weight 0.10000E+01 volume 0.41729E-03 ppm1 -0.903 ppm2 4.375 CV 1
ASSI { 3869}
(( segid " " and resid 285 and name HB3 ))
(( segid " " and resid 285 and name HD2 ))
4.100 2.100 1.900 peak 3869 spectrum 1 weight 0.10000E+01 volume 0.13082E-02 ppm1 1.763 ppm2 3.567 CV 1
ASSI { 3249}
(( segid " " and resid 299 and name HB2 ))
(( segid " " and resid 299 and name H ))
3.000 1.200 1.200 peak 3249 spectrum 1 weight 0.10000E+01 volume 0.61747E-03 ppm1 1.464 ppm2 7.494 CV 1
ASSI { 4299}
(( segid " " and resid 334 and name HG3 ))
(( segid " " and resid 335 and name H ))
3.200 1.300 1.300 peak 4299 spectrum 1 weight 0.10000E+01 volume 0.95018E-03 ppm1 2.146 ppm2 8.867 CV 1
ASSI { 1635}
(( segid " " and resid 441 and name HD3 ))
(( segid " " and resid 441 and name H ))
3.300 1.400 1.400 peak 1635 spectrum 1 weight 0.10000E+01 volume 0.48579E-02 ppm1 3.125 ppm2 7.626 CV 1
OR { 1635}
(( segid " " and resid 441 and name HD2 ))
(( segid " " and resid 441 and name H ))
ASSI { 3758}
(( segid " " and resid 285 and name HD2 ))
(( segid " " and resid 284 and name HB3 ))
3.200 1.200 1.200 peak 3758 spectrum 1 weight 0.10000E+01 volume 0.21738E-02 ppm1 3.568 ppm2 2.228 CV 1
OR { 3758}
(( segid " " and resid 285 and name HD2 ))
(( segid " " and resid 284 and name HB2 ))
ASSI { 3142}
( segid " " and resid 391 and name HD1%)
(( segid " " and resid 439 and name H ))
4.000 2.000 2.000 peak 3142 spectrum 1 weight 0.10000E+01 volume 0.68512E-03 ppm1 0.708 ppm2 8.742 CV 1
ASSI { 4297}
(( segid " " and resid 306 and name HB3 ))
( segid " " and resid 306 and name HD1%)
3.600 1.600 1.600 peak 4297 spectrum 1 weight 0.10000E+01 volume 0.58362E-03 ppm1 0.251 ppm2 0.384 CV 1
ASSI { 4209}
(( segid " " and resid 219 and name HA ))
( segid " " and resid 219 and name HD% )
3.500 1.600 1.600 peak 4209 spectrum 1 weight 0.10000E+01 volume 0.54699E-03 ppm1 4.134 ppm2 6.894 CV 1
ASSI { 3677}
(( segid " " and resid 411 and name HA ))
(( segid " " and resid 411 and name HB2 ))
3.500 1.500 1.500 peak 3677 spectrum 1 weight 0.10000E+01 volume 0.93325E-03 ppm1 3.830 ppm2 2.805 CV 1
ASSI { 4633}
( segid " " and resid 416 and name HD1%)
(( segid " " and resid 416 and name HA ))
2.200 0.600 0.600 peak 4633 spectrum 1 weight 0.10000E+01 volume 0.10951E-01 ppm1 0.854 ppm2 4.270 CV 1
ASSI { 4422}
( segid " " and resid 359 and name HG2%)
(( segid " " and resid 359 and name H ))
3.900 1.900 1.900 peak 4422 spectrum 1 weight 0.10000E+01 volume 0.30309E-02 ppm1 -0.459 ppm2 7.208 CV 1
ASSI { 4489}
(( segid " " and resid 212 and name HA ))
( segid " " and resid 247 and name HD% )
5.000 3.100 1.000 peak 4489 spectrum 1 weight 0.10000E+01 volume 0.32706E-03 ppm1 3.235 ppm2 7.307 CV 1
ASSI { 2360}
(( segid " " and resid 297 and name HA ))
(( segid " " and resid 300 and name H ))
3.700 1.700 1.700 peak 2360 spectrum 1 weight 0.10000E+01 volume 0.63721E-03 ppm1 3.726 ppm2 7.924 CV 1
ASSI { 2088}
( segid " " and resid 290 and name HB% )
(( segid " " and resid 303 and name HA ))
3.300 1.400 1.400 peak 2088 spectrum 1 weight 0.10000E+01 volume 0.21851E-02 ppm1 1.536 ppm2 3.850 CV 1
ASSI { 841}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 342 and name HA ))
2.000 0.500 0.500 peak 841 spectrum 1 weight 0.10000E+01 volume 0.70712E-02 ppm1 0.658 ppm2 3.908 CV 1
ASSI { 1064}
(( segid " " and resid 318 and name HG13))
(( segid " " and resid 360 and name HZ ))
4.700 2.800 1.300 peak 1064 spectrum 1 weight 0.10000E+01 volume 0.49622E-03 ppm1 0.614 ppm2 6.602 CV 1
ASSI { 1709}
( segid " " and resid 358 and name HE% )
(( segid " " and resid 340 and name H ))
3.100 3.100 2.900 peak 1709 spectrum 1 weight 0.10000E+01 volume 0.40883E-03 ppm1 6.705 ppm2 8.150 CV 1
ASSI { 270}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 302 and name HG3 ))
2.700 0.900 0.900 peak 270 spectrum 1 weight 0.10000E+01 volume 0.26757E-02 ppm1 -0.357 ppm2 2.078 CV 1
OR { 270}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 302 and name HB3 ))
ASSI { 3970}
(( segid " " and resid 336 and name HD3 ))
(( segid " " and resid 336 and name H ))
2.700 2.700 3.300 peak 3970 spectrum 1 weight 0.10000E+01 volume 0.16015E-02 ppm1 1.574 ppm2 9.113 CV 1
ASSI { 2349}
(( segid " " and resid 435 and name HA ))
(( segid " " and resid 435 and name H ))
3.700 1.700 1.700 peak 2349 spectrum 1 weight 0.10000E+01 volume 0.40036E-03 ppm1 3.859 ppm2 8.201 CV 1
ASSI { 2279}
(( segid " " and resid 305 and name HD2 ))
(( segid " " and resid 305 and name HA ))
3.600 1.600 1.600 peak 2279 spectrum 1 weight 0.10000E+01 volume 0.24445E-02 ppm1 3.132 ppm2 3.829 CV 1
ASSI { 4116}
( segid " " and resid 391 and name HD2%)
(( segid " " and resid 392 and name HD3 ))
4.000 2.000 2.000 peak 4116 spectrum 1 weight 0.10000E+01 volume 0.20244E-02 ppm1 0.531 ppm2 3.558 CV 1
ASSI { 829}
( segid " " and resid 253 and name HG2%)
(( segid " " and resid 254 and name HB2 ))
4.900 3.100 1.100 peak 829 spectrum 1 weight 0.10000E+01 volume 0.10291E-02 ppm1 0.613 ppm2 2.617 CV 1
ASSI { 64}
( segid " " and resid 376 and name HG1%)
(( segid " " and resid 377 and name H ))
3.500 1.600 1.600 peak 64 spectrum 1 weight 0.10000E+01 volume 0.21879E-02 ppm1 0.960 ppm2 8.218 CV 1
ASSI { 1713}
(( segid " " and resid 198 and name HB ))
( segid " " and resid 198 and name HG2%)
2.700 0.900 0.900 peak 1713 spectrum 1 weight 0.10000E+01 volume 0.22133E-02 ppm1 2.052 ppm2 0.613 CV 1
OR { 1713}
(( segid " " and resid 198 and name HB ))
( segid " " and resid 198 and name HG1%)
ASSI { 3300}
(( segid " " and resid 445 and name HB2 ))
( segid " " and resid 446 and name HB% )
5.500 3.800 0.500 peak 3300 spectrum 1 weight 0.10000E+01 volume 0.92761E-03 ppm1 2.048 ppm2 1.265 CV 1
ASSI { 4145}
(( segid " " and resid 284 and name HG3 ))
( segid " " and resid 279 and name HD2%)
3.100 1.200 1.200 peak 4145 spectrum 1 weight 0.10000E+01 volume 0.61578E-02 ppm1 2.587 ppm2 0.373 CV 1
OR { 4145}
(( segid " " and resid 284 and name HG2 ))
( segid " " and resid 279 and name HD2%)
ASSI { 2839}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 409 and name HG ))
2.000 0.500 0.500 peak 2839 spectrum 1 weight 0.10000E+01 volume 0.13305E-01 ppm1 0.782 ppm2 1.411 CV 1
ASSI { 2627}
(( segid " " and resid 222 and name HD3 ))
(( segid " " and resid 223 and name H ))
5.000 3.100 1.000 peak 2627 spectrum 1 weight 0.10000E+01 volume 0.44549E-03 ppm1 1.283 ppm2 8.417 CV 1
ASSI { 3073}
(( segid " " and resid 444 and name HD3 ))
(( segid " " and resid 444 and name H ))
3.500 1.500 1.500 peak 3073 spectrum 1 weight 0.10000E+01 volume 0.29182E-02 ppm1 3.152 ppm2 7.756 CV 1
OR { 3073}
(( segid " " and resid 444 and name HD2 ))
(( segid " " and resid 444 and name H ))
ASSI { 4075}
(( segid " " and resid 327 and name HD2 ))
(( segid " " and resid 327 and name HA ))
3.700 1.700 1.700 peak 4075 spectrum 1 weight 0.10000E+01 volume 0.76692E-03 ppm1 7.214 ppm2 4.459 CV 1
ASSI { 3190}
( segid " " and resid 183 and name HE% )
(( segid " " and resid 184 and name HD3 ))
2.200 2.200 3.800 peak 3190 spectrum 1 weight 0.10000E+01 volume 0.27490E-02 ppm1 2.041 ppm2 3.608 CV 1
ASSI { 3154}
(( segid " " and resid 198 and name HA ))
(( segid " " and resid 198 and name HB ))
3.300 1.300 1.300 peak 3154 spectrum 1 weight 0.10000E+01 volume 0.10883E-02 ppm1 2.893 ppm2 2.059 CV 1
ASSI { 4733}
(( segid " " and resid 297 and name HB ))
( segid " " and resid 300 and name HG1%)
5.200 3.300 0.800 peak 4733 spectrum 1 weight 0.10000E+01 volume 0.76128E-03 ppm1 3.945 ppm2 0.072 CV 1
ASSI { 4327}
( segid " " and resid 255 and name HD1%)
( segid " " and resid 243 and name HD2%)
2.300 0.700 0.700 peak 4327 spectrum 1 weight 0.10000E+01 volume 0.87713E-02 ppm1 0.600 ppm2 0.157 CV 1
ASSI { 21}
(( segid " " and resid 393 and name HA ))
(( segid " " and resid 442 and name HE3 ))
3.300 1.400 1.400 peak 21 spectrum 1 weight 0.10000E+01 volume 0.11306E-02 ppm1 4.294 ppm2 2.872 CV 1
OR { 21}
(( segid " " and resid 393 and name HA ))
(( segid " " and resid 442 and name HE2 ))
ASSI { 2525}
( segid " " and resid 246 and name HB% )
(( segid " " and resid 251 and name HB3 ))
3.200 1.200 1.200 peak 2525 spectrum 1 weight 0.10000E+01 volume 0.28702E-02 ppm1 1.178 ppm2 1.571 CV 1
ASSI { 976}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 322 and name HB ))
3.600 1.600 1.600 peak 976 spectrum 1 weight 0.10000E+01 volume 0.12039E-02 ppm1 0.437 ppm2 1.340 CV 1
OR { 976}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 322 and name HG12))
ASSI { 4548}
(( segid " " and resid 301 and name HA ))
(( segid " " and resid 301 and name H ))
2.700 0.900 0.900 peak 4548 spectrum 1 weight 0.10000E+01 volume 0.26080E-02 ppm1 4.021 ppm2 8.035 CV 1
ASSI { 2937}
(( segid " " and resid 380 and name HB2 ))
(( segid " " and resid 380 and name HA ))
3.400 1.500 1.500 peak 2937 spectrum 1 weight 0.10000E+01 volume 0.89941E-03 ppm1 1.199 ppm2 4.062 CV 1
ASSI { 3216}
(( segid " " and resid 304 and name HB2 ))
(( segid " " and resid 304 and name HE22))
4.900 3.000 1.100 peak 3216 spectrum 1 weight 0.10000E+01 volume 0.50187E-03 ppm1 2.236 ppm2 7.027 CV 1
ASSI { 1986}
( segid " " and resid 255 and name HD1%)
( segid " " and resid 219 and name HD% )
4.700 2.800 1.300 peak 1986 spectrum 1 weight 0.10000E+01 volume 0.10770E-02 ppm1 0.601 ppm2 6.866 CV 1
ASSI { 3769}
( segid " " and resid 325 and name HE% )
(( segid " " and resid 325 and name H ))
2.600 0.900 0.900 peak 3769 spectrum 1 weight 0.10000E+01 volume 0.31860E-02 ppm1 0.928 ppm2 8.498 CV 1
ASSI { 1803}
(( segid " " and resid 426 and name HA ))
( segid " " and resid 429 and name HD2%)
3.200 1.300 1.300 peak 1803 spectrum 1 weight 0.10000E+01 volume 0.23571E-02 ppm1 3.693 ppm2 0.669 CV 1
ASSI { 2908}
(( segid " " and resid 351 and name HG3 ))
(( segid " " and resid 351 and name HE21))
2.700 0.900 0.900 peak 2908 spectrum 1 weight 0.10000E+01 volume 0.13618E-02 ppm1 2.064 ppm2 6.753 CV 1
ASSI { 4316}
(( segid " " and resid 430 and name HD1 ))
(( segid " " and resid 430 and name HB3 ))
4.000 2.000 2.000 peak 4316 spectrum 1 weight 0.10000E+01 volume 0.66538E-03 ppm1 7.178 ppm2 3.299 CV 1
OR { 4316}
(( segid " " and resid 430 and name HD1 ))
(( segid " " and resid 430 and name HB2 ))
ASSI { 4434}
(( segid " " and resid 285 and name HB2 ))
(( segid " " and resid 286 and name H ))
3.600 1.600 1.600 peak 4434 spectrum 1 weight 0.10000E+01 volume 0.82611E-03 ppm1 2.308 ppm2 7.440 CV 1
ASSI { 4283}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 410 and name H ))
4.000 2.000 2.000 peak 4283 spectrum 1 weight 0.10000E+01 volume 0.23148E-02 ppm1 0.784 ppm2 7.887 CV 1
ASSI { 3021}
(( segid " " and resid 184 and name HB2 ))
(( segid " " and resid 184 and name HD3 ))
3.400 1.500 1.500 peak 3021 spectrum 1 weight 0.10000E+01 volume 0.59406E-02 ppm1 2.210 ppm2 3.643 CV 1
OR { 3021}
(( segid " " and resid 184 and name HB2 ))
(( segid " " and resid 184 and name HD2 ))
ASSI { 1861}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 409 and name H ))
3.800 1.800 1.800 peak 1861 spectrum 1 weight 0.10000E+01 volume 0.30394E-02 ppm1 0.781 ppm2 8.728 CV 1
ASSI { 1355}
( segid " " and resid 339 and name HD1%)
(( segid " " and resid 361 and name HB3 ))
3.400 1.400 1.400 peak 1355 spectrum 1 weight 0.10000E+01 volume 0.20328E-02 ppm1 0.646 ppm2 2.537 CV 1
ASSI { 1253}
( segid " " and resid 263 and name HG1%)
(( segid " " and resid 260 and name HA ))
4.000 2.000 2.000 peak 1253 spectrum 1 weight 0.10000E+01 volume 0.68794E-03 ppm1 0.065 ppm2 4.343 CV 1
ASSI { 1476}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 341 and name H ))
4.600 2.600 1.400 peak 1476 spectrum 1 weight 0.10000E+01 volume 0.10545E-02 ppm1 0.658 ppm2 8.509 CV 1
ASSI { 545}
( segid " " and resid 263 and name HG1%)
( segid " " and resid 219 and name HD% )
4.100 2.100 1.900 peak 545 spectrum 1 weight 0.10000E+01 volume 0.66538E-03 ppm1 0.071 ppm2 6.849 CV 1
ASSI { 3304}
(( segid " " and resid 290 and name HA ))
( segid " " and resid 306 and name HD2%)
5.000 3.100 1.000 peak 3304 spectrum 1 weight 0.10000E+01 volume 0.38062E-03 ppm1 4.064 ppm2 -0.346 CV 1
ASSI { 1319}
(( segid " " and resid 430 and name HH2 ))
(( segid " " and resid 427 and name HB3 ))
5.100 3.200 0.900 peak 1319 spectrum 1 weight 0.10000E+01 volume 0.39190E-03 ppm1 6.995 ppm2 1.976 CV 1
ASSI { 865}
(( segid " " and resid 272 and name HG3 ))
(( segid " " and resid 269 and name HE21))
4.900 3.000 1.100 peak 865 spectrum 1 weight 0.10000E+01 volume 0.79227E-03 ppm1 1.800 ppm2 8.102 CV 1
OR { 865}
(( segid " " and resid 272 and name HG2 ))
(( segid " " and resid 269 and name HE21))
ASSI { 2486}
(( segid " " and resid 199 and name HG3 ))
(( segid " " and resid 200 and name H ))
3.600 1.600 1.600 peak 2486 spectrum 1 weight 0.10000E+01 volume 0.43731E-02 ppm1 2.281 ppm2 7.577 CV 1
OR { 2486}
(( segid " " and resid 199 and name HG2 ))
(( segid " " and resid 200 and name H ))
ASSI { 3173}
(( segid " " and resid 183 and name HB2 ))
(( segid " " and resid 183 and name HA ))
2.700 0.900 0.900 peak 3173 spectrum 1 weight 0.10000E+01 volume 0.42180E-02 ppm1 1.996 ppm2 4.707 CV 1
ASSI { 4794}
(( segid " " and resid 192 and name HG13))
( segid " " and resid 192 and name HG2%)
4.700 2.700 1.300 peak 4794 spectrum 1 weight 0.10000E+01 volume 0.59208E-03 ppm1 1.589 ppm2 0.690 CV 1
ASSI { 3135}
( segid " " and resid 372 and name HG2%)
(( segid " " and resid 372 and name HA ))
2.200 0.600 0.600 peak 3135 spectrum 1 weight 0.10000E+01 volume 0.14261E-01 ppm1 0.745 ppm2 3.802 CV 1
ASSI { 155}
(( segid " " and resid 210 and name HG3 ))
( segid " " and resid 212 and name HG2%)
5.900 4.400 0.100 peak 155 spectrum 1 weight 0.10000E+01 volume 0.36370E-03 ppm1 1.534 ppm2 -0.170 CV 1
ASSI { 4618}
(( segid " " and resid 198 and name HB ))
(( segid " " and resid 199 and name H ))
3.200 1.300 1.300 peak 4618 spectrum 1 weight 0.10000E+01 volume 0.64567E-03 ppm1 2.051 ppm2 7.762 CV 1
ASSI { 3454}
( segid " " and resid 364 and name HG1%)
(( segid " " and resid 365 and name HG2 ))
2.300 0.600 0.600 peak 3454 spectrum 1 weight 0.10000E+01 volume 0.51033E-02 ppm1 1.068 ppm2 2.350 CV 1
OR { 3454}
( segid " " and resid 364 and name HG1%)
(( segid " " and resid 365 and name HG3 ))
ASSI { 847}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 440 and name HG2 ))
4.000 2.000 2.000 peak 847 spectrum 1 weight 0.10000E+01 volume 0.17368E-02 ppm1 0.767 ppm2 1.347 CV 1
OR { 847}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 440 and name HG3 ))
ASSI { 1534}
( segid " " and resid 337 and name HE% )
( segid " " and resid 342 and name HG2%)
4.300 2.300 1.700 peak 1534 spectrum 1 weight 0.10000E+01 volume 0.24163E-02 ppm1 1.803 ppm2 0.517 CV 1
ASSI { 800}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 209 and name HA ))
4.500 2.500 1.500 peak 800 spectrum 1 weight 0.10000E+01 volume 0.53571E-03 ppm1 0.170 ppm2 4.375 CV 1
ASSI { 1621}
( segid " " and resid 321 and name HD2%)
( segid " " and resid 217 and name HD1%)
4.900 3.100 1.100 peak 1621 spectrum 1 weight 0.10000E+01 volume 0.85432E-03 ppm1 0.667 ppm2 -0.038 CV 1
ASSI { 1142}
(( segid " " and resid 256 and name HG3 ))
(( segid " " and resid 254 and name HB3 ))
4.500 2.500 1.500 peak 1142 spectrum 1 weight 0.10000E+01 volume 0.63721E-03 ppm1 2.394 ppm2 2.961 CV 1
ASSI { 1887}
(( segid " " and resid 421 and name HD2 ))
(( segid " " and resid 422 and name H ))
3.600 1.600 1.600 peak 1887 spectrum 1 weight 0.10000E+01 volume 0.17142E-02 ppm1 1.596 ppm2 8.198 CV 1
ASSI { 4331}
(( segid " " and resid 283 and name HB2 ))
(( segid " " and resid 283 and name H ))
3.100 1.200 1.200 peak 4331 spectrum 1 weight 0.10000E+01 volume 0.34680E-03 ppm1 2.328 ppm2 7.318 CV 1
ASSI { 3983}
(( segid " " and resid 415 and name HB3 ))
(( segid " " and resid 415 and name HA ))
3.500 1.500 1.500 peak 3983 spectrum 1 weight 0.10000E+01 volume 0.13026E-02 ppm1 2.587 ppm2 4.407 CV 1
ASSI { 3317}
( segid " " and resid 283 and name HD1%)
(( segid " " and resid 283 and name HA ))
2.100 0.500 0.500 peak 3317 spectrum 1 weight 0.10000E+01 volume 0.67920E-02 ppm1 0.717 ppm2 4.482 CV 1
ASSI { 4761}
(( segid " " and resid 382 and name HZ3 ))
(( segid " " and resid 382 and name HZ2 ))
5.300 3.500 0.700 peak 4761 spectrum 1 weight 0.10000E+01 volume 0.50187E-03 ppm1 6.868 ppm2 7.473 CV 1
ASSI { 4413}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 323 and name H ))
3.400 1.500 1.500 peak 4413 spectrum 1 weight 0.10000E+01 volume 0.13675E-02 ppm1 0.393 ppm2 7.786 CV 1
ASSI { 1949}
(( segid " " and resid 344 and name HG12))
(( segid " " and resid 344 and name HA ))
2.400 0.700 0.700 peak 1949 spectrum 1 weight 0.10000E+01 volume 0.32339E-02 ppm1 1.663 ppm2 3.896 CV 1
ASSI { 2373}
(( segid " " and resid 383 and name HB3 ))
( segid " " and resid 386 and name HB% )
3.900 1.900 1.900 peak 2373 spectrum 1 weight 0.10000E+01 volume 0.12885E-02 ppm1 3.774 ppm2 1.449 CV 1
ASSI { 4697}
(( segid " " and resid 313 and name HB2 ))
(( segid " " and resid 313 and name HA ))
3.600 1.600 1.600 peak 4697 spectrum 1 weight 0.10000E+01 volume 0.75564E-03 ppm1 2.818 ppm2 4.381 CV 1
ASSI { 1010}
( segid " " and resid 409 and name HD1%)
( segid " " and resid 432 and name HG2%)
2.400 0.700 0.700 peak 1010 spectrum 1 weight 0.10000E+01 volume 0.89743E-02 ppm1 0.783 ppm2 1.085 CV 1
OR { 1010}
( segid " " and resid 409 and name HD1%)
( segid " " and resid 432 and name HG1%)
ASSI { 3194}
( segid " " and resid 223 and name HE% )
( segid " " and resid 223 and name HD% )
2.300 0.700 0.700 peak 3194 spectrum 1 weight 0.10000E+01 volume 0.86193E-02 ppm1 6.644 ppm2 6.431 CV 1
ASSI { 2811}
( segid " " and resid 446 and name HB% )
(( segid " " and resid 398 and name H ))
2.900 2.900 3.100 peak 2811 spectrum 1 weight 0.10000E+01 volume 0.53007E-03 ppm1 1.267 ppm2 8.686 CV 1
ASSI { 4455}
(( segid " " and resid 399 and name HE3 ))
(( segid " " and resid 399 and name H ))
4.200 2.300 1.800 peak 4455 spectrum 1 weight 0.10000E+01 volume 0.11813E-02 ppm1 2.851 ppm2 8.332 CV 1
OR { 4455}
(( segid " " and resid 399 and name HE2 ))
(( segid " " and resid 399 and name H ))
ASSI { 1065}
( segid " " and resid 367 and name HD2%)
(( segid " " and resid 303 and name HB2 ))
3.900 1.900 1.900 peak 1065 spectrum 1 weight 0.10000E+01 volume 0.67948E-03 ppm1 0.782 ppm2 3.452 CV 1
ASSI { 4330}
( segid " " and resid 189 and name HD1%)
(( segid " " and resid 189 and name H ))
4.600 2.600 1.400 peak 4330 spectrum 1 weight 0.10000E+01 volume 0.71897E-03 ppm1 0.734 ppm2 8.870 CV 1
ASSI { 3832}
( segid " " and resid 212 and name HG1%)
( segid " " and resid 247 and name HE% )
5.100 3.200 0.900 peak 3832 spectrum 1 weight 0.10000E+01 volume 0.42575E-03 ppm1 -0.341 ppm2 6.481 CV 1
ASSI { 2797}
(( segid " " and resid 344 and name HA ))
(( segid " " and resid 344 and name H ))
2.900 1.000 1.000 peak 2797 spectrum 1 weight 0.10000E+01 volume 0.16466E-02 ppm1 3.885 ppm2 7.684 CV 1
ASSI { 3519}
( segid " " and resid 220 and name HG2%)
(( segid " " and resid 220 and name HB ))
2.300 0.600 0.600 peak 3519 spectrum 1 weight 0.10000E+01 volume 0.59575E-02 ppm1 1.121 ppm2 2.224 CV 1
OR { 3519}
( segid " " and resid 220 and name HG1%)
(( segid " " and resid 220 and name HB ))
ASSI { 1640}
(( segid " " and resid 331 and name HD2 ))
(( segid " " and resid 331 and name HB2 ))
3.100 1.200 1.200 peak 1640 spectrum 1 weight 0.10000E+01 volume 0.19765E-02 ppm1 1.631 ppm2 2.533 CV 1
OR { 1640}
(( segid " " and resid 331 and name HD3 ))
(( segid " " and resid 331 and name HB2 ))
OR { 1640}
(( segid " " and resid 331 and name HD2 ))
(( segid " " and resid 331 and name HB3 ))
OR { 1640}
(( segid " " and resid 331 and name HD3 ))
(( segid " " and resid 331 and name HB3 ))
ASSI { 2844}
(( segid " " and resid 411 and name HB2 ))
(( segid " " and resid 411 and name H ))
3.300 1.400 1.400 peak 2844 spectrum 1 weight 0.10000E+01 volume 0.54417E-03 ppm1 2.808 ppm2 7.721 CV 1
ASSI { 2542}
( segid " " and resid 328 and name HG2%)
( segid " " and resid 225 and name HE% )
2.100 0.600 0.600 peak 2542 spectrum 1 weight 0.10000E+01 volume 0.77760E-02 ppm1 0.758 ppm2 1.909 CV 1
ASSI { 3646}
( segid " " and resid 279 and name HD2%)
(( segid " " and resid 279 and name HG ))
2.300 0.700 0.700 peak 3646 spectrum 1 weight 0.10000E+01 volume 0.43985E-02 ppm1 0.369 ppm2 1.403 CV 1
OR { 3646}
( segid " " and resid 279 and name HD2%)
(( segid " " and resid 279 and name HB3 ))
ASSI { 1856}
(( segid " " and resid 344 and name HG13))
(( segid " " and resid 341 and name HA ))
3.600 1.700 1.700 peak 1856 spectrum 1 weight 0.10000E+01 volume 0.71333E-03 ppm1 1.213 ppm2 4.401 CV 1
ASSI { 4699}
(( segid " " and resid 342 and name HB ))
(( segid " " and resid 342 and name HG12))
2.800 1.000 1.000 peak 4699 spectrum 1 weight 0.10000E+01 volume 0.93325E-03 ppm1 1.709 ppm2 1.044 CV 1
ASSI { 3728}
(( segid " " and resid 281 and name HB3 ))
(( segid " " and resid 282 and name H ))
3.300 1.400 1.400 peak 3728 spectrum 1 weight 0.10000E+01 volume 0.27575E-02 ppm1 1.906 ppm2 8.696 CV 1
ASSI { 3967}
(( segid " " and resid 278 and name HB3 ))
(( segid " " and resid 278 and name HA ))
2.900 1.100 1.100 peak 3967 spectrum 1 weight 0.10000E+01 volume 0.60055E-03 ppm1 1.522 ppm2 3.812 CV 1
ASSI { 974}
( segid " " and resid 330 and name HB% )
(( segid " " and resid 331 and name HE3 ))
3.500 1.500 1.500 peak 974 spectrum 1 weight 0.10000E+01 volume 0.19144E-02 ppm1 1.554 ppm2 2.871 CV 1
OR { 974}
( segid " " and resid 330 and name HB% )
(( segid " " and resid 331 and name HE2 ))
ASSI { 2635}
(( segid " " and resid 369 and name HA2 ))
(( segid " " and resid 365 and name HB3 ))
3.500 1.500 1.500 peak 2635 spectrum 1 weight 0.10000E+01 volume 0.47084E-03 ppm1 3.832 ppm2 1.990 CV 1
ASSI { 3014}
(( segid " " and resid 318 and name HG12))
(( segid " " and resid 322 and name HG13))
3.500 1.600 1.600 peak 3014 spectrum 1 weight 0.10000E+01 volume 0.18552E-02 ppm1 0.988 ppm2 0.176 CV 1
ASSI { 2442}
(( segid " " and resid 322 and name HB ))
(( segid " " and resid 322 and name H ))
2.900 1.100 1.100 peak 2442 spectrum 1 weight 0.10000E+01 volume 0.58362E-03 ppm1 1.331 ppm2 8.209 CV 1
ASSI { 4723}
( segid " " and resid 321 and name HD2%)
( segid " " and resid 322 and name HD1%)
3.000 1.100 1.100 peak 4723 spectrum 1 weight 0.10000E+01 volume 0.23684E-02 ppm1 0.667 ppm2 -0.165 CV 1
ASSI { 2147}
(( segid " " and resid 219 and name HA ))
(( segid " " and resid 220 and name H ))
4.100 2.100 1.900 peak 2147 spectrum 1 weight 0.10000E+01 volume 0.42575E-03 ppm1 4.134 ppm2 8.715 CV 1
ASSI { 4767}
(( segid " " and resid 309 and name HG3 ))
(( segid " " and resid 306 and name HA ))
3.200 1.300 1.300 peak 4767 spectrum 1 weight 0.10000E+01 volume 0.16240E-02 ppm1 2.167 ppm2 3.647 CV 1
ASSI { 1087}
(( segid " " and resid 352 and name HG13))
( segid " " and resid 279 and name HD1%)
5.500 3.800 0.500 peak 1087 spectrum 1 weight 0.10000E+01 volume 0.54417E-03 ppm1 1.619 ppm2 0.189 CV 1
ASSI { 2881}
(( segid " " and resid 349 and name HA ))
(( segid " " and resid 349 and name H ))
3.400 1.400 1.400 peak 2881 spectrum 1 weight 0.10000E+01 volume 0.84303E-03 ppm1 3.942 ppm2 7.085 CV 1
ASSI { 1740}
(( segid " " and resid 214 and name HA ))
(( segid " " and resid 214 and name H ))
3.700 1.700 1.700 peak 1740 spectrum 1 weight 0.10000E+01 volume 0.32142E-03 ppm1 3.554 ppm2 7.151 CV 1
ASSI { 1789}
(( segid " " and resid 444 and name HG2 ))
(( segid " " and resid 444 and name H ))
2.200 0.600 0.600 peak 1789 spectrum 1 weight 0.10000E+01 volume 0.44098E-02 ppm1 1.599 ppm2 7.758 CV 1
ASSI { 2877}
( segid " " and resid 437 and name HG2%)
(( segid " " and resid 437 and name HB ))
2.300 0.700 0.700 peak 2877 spectrum 1 weight 0.10000E+01 volume 0.73364E-02 ppm1 1.187 ppm2 4.242 CV 1
ASSI { 3720}
(( segid " " and resid 348 and name HG2 ))
(( segid " " and resid 348 and name HD2 ))
2.700 0.900 0.900 peak 3720 spectrum 1 weight 0.10000E+01 volume 0.13421E-02 ppm1 2.048 ppm2 3.560 CV 1
ASSI { 2084}
( segid " " and resid 359 and name HG1%)
(( segid " " and resid 359 and name HA ))
3.300 1.400 1.400 peak 2084 spectrum 1 weight 0.10000E+01 volume 0.35302E-02 ppm1 0.893 ppm2 3.324 CV 1
ASSI { 4121}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 402 and name HA ))
2.700 0.900 0.900 peak 4121 spectrum 1 weight 0.10000E+01 volume 0.27998E-02 ppm1 0.768 ppm2 3.377 CV 1
ASSI { 1661}
(( segid " " and resid 225 and name HG2 ))
(( segid " " and resid 225 and name HA ))
3.400 1.400 1.400 peak 1661 spectrum 1 weight 0.10000E+01 volume 0.60055E-03 ppm1 2.809 ppm2 4.362 CV 1
ASSI { 3143}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 319 and name HB3 ))
3.500 1.500 1.500 peak 3143 spectrum 1 weight 0.10000E+01 volume 0.59208E-03 ppm1 0.362 ppm2 3.093 CV 1
ASSI { 3391}
(( segid " " and resid 392 and name HD2 ))
(( segid " " and resid 392 and name HB2 ))
4.200 2.200 1.800 peak 3391 spectrum 1 weight 0.10000E+01 volume 0.71897E-03 ppm1 3.157 ppm2 1.946 CV 1
ASSI { 3502}
( segid " " and resid 439 and name HD1%)
(( segid " " and resid 439 and name H ))
3.900 1.900 1.900 peak 3502 spectrum 1 weight 0.10000E+01 volume 0.13449E-02 ppm1 0.815 ppm2 8.738 CV 1
ASSI { 3392}
( segid " " and resid 278 and name HD2%)
(( segid " " and resid 278 and name H ))
3.500 1.500 1.500 peak 3392 spectrum 1 weight 0.10000E+01 volume 0.16156E-02 ppm1 0.746 ppm2 10.069 CV 1
ASSI { 1945}
(( segid " " and resid 281 and name HA ))
(( segid " " and resid 281 and name H ))
3.000 1.100 1.100 peak 1945 spectrum 1 weight 0.10000E+01 volume 0.12208E-02 ppm1 3.979 ppm2 9.160 CV 1
ASSI { 332}
(( segid " " and resid 315 and name HA ))
( segid " " and resid 318 and name HG2%)
2.700 0.900 0.900 peak 332 spectrum 1 weight 0.10000E+01 volume 0.19398E-02 ppm1 3.785 ppm2 0.356 CV 1
OR { 332}
(( segid " " and resid 315 and name HA ))
( segid " " and resid 318 and name HD1%)
ASSI { 3789}
(( segid " " and resid 232 and name HG3 ))
(( segid " " and resid 232 and name HA ))
3.400 1.500 1.500 peak 3789 spectrum 1 weight 0.10000E+01 volume 0.11363E-02 ppm1 1.479 ppm2 4.428 CV 1
OR { 3789}
(( segid " " and resid 232 and name HG2 ))
(( segid " " and resid 232 and name HA ))
ASSI { 2509}
(( segid " " and resid 311 and name HB3 ))
(( segid " " and resid 311 and name HA ))
2.900 1.100 1.100 peak 2509 spectrum 1 weight 0.10000E+01 volume 0.10573E-02 ppm1 2.473 ppm2 4.475 CV 1
ASSI { 4241}
(( segid " " and resid 425 and name HG2 ))
(( segid " " and resid 425 and name HA ))
2.900 1.000 1.000 peak 4241 spectrum 1 weight 0.10000E+01 volume 0.27321E-02 ppm1 1.455 ppm2 3.968 CV 1
ASSI { 2218}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 230 and name H ))
3.700 1.800 1.800 peak 2218 spectrum 1 weight 0.10000E+01 volume 0.64567E-03 ppm1 1.805 ppm2 7.124 CV 1
ASSI { 1846}
(( segid " " and resid 299 and name HA ))
(( segid " " and resid 299 and name H ))
2.900 1.100 1.100 peak 1846 spectrum 1 weight 0.10000E+01 volume 0.11504E-02 ppm1 3.780 ppm2 7.499 CV 1
ASSI { 2739}
(( segid " " and resid 275 and name HA ))
(( segid " " and resid 275 and name HB2 ))
3.300 1.400 1.400 peak 2739 spectrum 1 weight 0.10000E+01 volume 0.20441E-02 ppm1 4.329 ppm2 2.022 CV 1
ASSI { 2855}
(( segid " " and resid 425 and name HG3 ))
(( segid " " and resid 425 and name HA ))
4.200 2.200 1.800 peak 2855 spectrum 1 weight 0.10000E+01 volume 0.11137E-02 ppm1 1.237 ppm2 3.987 CV 1
ASSI { 2953}
( segid " " and resid 361 and name HD% )
(( segid " " and resid 361 and name HB3 ))
3.700 1.700 1.700 peak 2953 spectrum 1 weight 0.10000E+01 volume 0.52161E-03 ppm1 7.142 ppm2 2.500 CV 1
ASSI { 2211}
(( segid " " and resid 222 and name HD3 ))
(( segid " " and resid 222 and name HA ))
4.500 2.500 1.500 peak 2211 spectrum 1 weight 0.10000E+01 volume 0.19821E-02 ppm1 1.288 ppm2 3.781 CV 1
OR { 2211}
(( segid " " and resid 222 and name HD2 ))
(( segid " " and resid 222 and name HA ))
ASSI { 4695}
(( segid " " and resid 256 and name HB3 ))
( segid " " and resid 219 and name HE% )
5.100 3.300 0.900 peak 4695 spectrum 1 weight 0.10000E+01 volume 0.40883E-03 ppm1 1.934 ppm2 6.403 CV 1
ASSI { 3422}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 331 and name HB2 ))
3.600 1.700 1.700 peak 3422 spectrum 1 weight 0.10000E+01 volume 0.17058E-02 ppm1 1.914 ppm2 2.499 CV 1
ASSI { 2567}
(( segid " " and resid 308 and name HD3 ))
(( segid " " and resid 305 and name HA ))
3.200 1.300 1.300 peak 2567 spectrum 1 weight 0.10000E+01 volume 0.53204E-02 ppm1 1.530 ppm2 3.824 CV 1
OR { 2567}
(( segid " " and resid 308 and name HD2 ))
(( segid " " and resid 305 and name HA ))
ASSI { 3067}
(( segid " " and resid 342 and name HB ))
( segid " " and resid 329 and name HD1%)
3.200 1.300 1.300 peak 3067 spectrum 1 weight 0.10000E+01 volume 0.78098E-03 ppm1 1.711 ppm2 0.117 CV 1
ASSI { 1515}
(( segid " " and resid 252 and name HB2 ))
( segid " " and resid 253 and name HG2%)
4.500 2.500 1.500 peak 1515 spectrum 1 weight 0.10000E+01 volume 0.91633E-03 ppm1 3.734 ppm2 0.632 CV 1
ASSI { 350}
(( segid " " and resid 360 and name HB2 ))
( segid " " and resid 360 and name HD% )
3.300 1.400 1.400 peak 350 spectrum 1 weight 0.10000E+01 volume 0.44549E-03 ppm1 2.754 ppm2 7.052 CV 1
OR { 350}
(( segid " " and resid 360 and name HB2 ))
( segid " " and resid 360 and name HE% )
ASSI { 3041}
( segid " " and resid 253 and name HG2%)
( segid " " and resid 246 and name HB% )
2.100 0.600 0.600 peak 3041 spectrum 1 weight 0.10000E+01 volume 0.14808E-01 ppm1 0.616 ppm2 1.172 CV 1
ASSI { 1708}
(( segid " " and resid 377 and name HG3 ))
( segid " " and resid 408 and name HD2%)
3.300 1.300 1.300 peak 1708 spectrum 1 weight 0.10000E+01 volume 0.15197E-02 ppm1 2.419 ppm2 0.899 CV 1
ASSI { 1883}
( segid " " and resid 318 and name HD1%)
( segid " " and resid 360 and name HE% )
2.500 0.800 0.800 peak 1883 spectrum 1 weight 0.10000E+01 volume 0.53148E-02 ppm1 0.379 ppm2 7.072 CV 1
OR { 1883}
( segid " " and resid 318 and name HD1%)
( segid " " and resid 360 and name HD% )
ASSI { 3641}
(( segid " " and resid 231 and name HA ))
( segid " " and resid 231 and name HD% )
3.500 1.500 1.500 peak 3641 spectrum 1 weight 0.10000E+01 volume 0.65696E-03 ppm1 3.541 ppm2 6.766 CV 1
ASSI { 902}
( segid " " and resid 429 and name HD2%)
(( segid " " and resid 413 and name HB2 ))
3.300 1.400 1.400 peak 902 spectrum 1 weight 0.10000E+01 volume 0.16889E-02 ppm1 0.645 ppm2 3.078 CV 1
ASSI { 2649}
(( segid " " and resid 293 and name HD3 ))
(( segid " " and resid 293 and name HA ))
3.000 1.100 1.100 peak 2649 spectrum 1 weight 0.10000E+01 volume 0.23740E-02 ppm1 3.165 ppm2 4.284 CV 1
ASSI { 2433}
( segid " " and resid 344 and name HG2%)
(( segid " " and resid 344 and name HB ))
2.000 0.500 0.500 peak 2433 spectrum 1 weight 0.10000E+01 volume 0.16731E-01 ppm1 0.895 ppm2 1.898 CV 1
ASSI { 2055}
(( segid " " and resid 413 and name HB2 ))
(( segid " " and resid 410 and name HA ))
3.800 1.800 1.800 peak 2055 spectrum 1 weight 0.10000E+01 volume 0.67948E-03 ppm1 3.088 ppm2 4.338 CV 1
ASSI { 1663}
(( segid " " and resid 202 and name HB3 ))
( segid " " and resid 198 and name HG1%)
4.500 2.600 1.500 peak 1663 spectrum 1 weight 0.10000E+01 volume 0.12067E-02 ppm1 2.259 ppm2 0.608 CV 1
OR { 1663}
(( segid " " and resid 202 and name HB3 ))
( segid " " and resid 198 and name HG2%)
ASSI { 184}
( segid " " and resid 360 and name HE% )
( segid " " and resid 307 and name HD1%)
2.700 2.700 3.300 peak 184 spectrum 1 weight 0.10000E+01 volume 0.14069E-02 ppm1 7.080 ppm2 1.211 CV 1
OR { 184}
( segid " " and resid 360 and name HD% )
( segid " " and resid 307 and name HD1%)
ASSI { 2415}
(( segid " " and resid 187 and name HG2 ))
(( segid " " and resid 187 and name H ))
3.200 1.300 1.300 peak 2415 spectrum 1 weight 0.10000E+01 volume 0.21767E-02 ppm1 1.422 ppm2 8.517 CV 1
ASSI { 3792}
( segid " " and resid 373 and name HD1%)
(( segid " " and resid 320 and name HA ))
2.400 0.700 0.700 peak 3792 spectrum 1 weight 0.10000E+01 volume 0.36370E-02 ppm1 -0.196 ppm2 3.826 CV 1
ASSI { 310}
(( segid " " and resid 321 and name H ))
( segid " " and resid 373 and name HD1%)
5.100 3.200 0.900 peak 310 spectrum 1 weight 0.10000E+01 volume 0.51593E-03 ppm1 8.587 ppm2 -0.155 CV 1
OR { 310}
(( segid " " and resid 321 and name H ))
( segid " " and resid 322 and name HD1%)
ASSI { 151}
(( segid " " and resid 395 and name HE21))
(( segid " " and resid 443 and name HG ))
4.100 2.100 1.900 peak 151 spectrum 1 weight 0.10000E+01 volume 0.14997E-02 ppm1 7.773 ppm2 1.643 CV 1
OR { 151}
(( segid " " and resid 395 and name HE21))
(( segid " " and resid 398 and name HG13))
OR { 151}
(( segid " " and resid 395 and name HE21))
(( segid " " and resid 443 and name HB3 ))
OR { 151}
(( segid " " and resid 395 and name HE21))
(( segid " " and resid 443 and name HB2 ))
OR { 151}
(( segid " " and resid 395 and name HE21))
(( segid " " and resid 399 and name HD3 ))
OR { 151}
(( segid " " and resid 395 and name HE21))
(( segid " " and resid 399 and name HG3 ))
OR { 151}
(( segid " " and resid 395 and name HE21))
(( segid " " and resid 399 and name HD2 ))
OR { 151}
(( segid " " and resid 395 and name HE21))
(( segid " " and resid 444 and name HG2 ))
ASSI { 928}
(( segid " " and resid 256 and name H ))
(( segid " " and resid 254 and name HD22))
3.400 1.500 1.500 peak 928 spectrum 1 weight 0.10000E+01 volume 0.80855E-03 ppm1 8.259 ppm2 6.865 CV 1
OR { 928}
(( segid " " and resid 256 and name H ))
( segid " " and resid 219 and name HD% )
ASSI { 1771}
(( segid " " and resid 407 and name H ))
(( segid " " and resid 406 and name HB2 ))
2.500 0.800 0.800 peak 1771 spectrum 1 weight 0.10000E+01 volume 0.48533E-02 ppm1 7.793 ppm2 1.940 CV 1
OR { 1771}
(( segid " " and resid 401 and name H ))
(( segid " " and resid 400 and name HB3 ))
OR { 1771}
(( segid " " and resid 407 and name H ))
(( segid " " and resid 406 and name HB3 ))
OR { 1771}
(( segid " " and resid 401 and name H ))
(( segid " " and resid 400 and name HB2 ))
ASSI { 1890}
(( segid " " and resid 241 and name H ))
(( segid " " and resid 241 and name HA ))
2.700 0.900 0.900 peak 1890 spectrum 1 weight 0.10000E+01 volume 0.41274E-02 ppm1 8.375 ppm2 4.150 CV 1
OR { 1890}
(( segid " " and resid 241 and name H ))
(( segid " " and resid 238 and name HA ))
ASSI { 1221}
(( segid " " and resid 430 and name H ))
(( segid " " and resid 431 and name H ))
2.400 0.700 0.700 peak 1221 spectrum 1 weight 0.10000E+01 volume 0.34229E-02 ppm1 7.759 ppm2 7.943 CV 1
OR { 1221}
(( segid " " and resid 417 and name H ))
(( segid " " and resid 416 and name H ))
ASSI { 134}
(( segid " " and resid 293 and name HE ))
(( segid " " and resid 302 and name HG2 ))
4.900 3.000 1.100 peak 134 spectrum 1 weight 0.10000E+01 volume 0.30995E-03 ppm1 7.811 ppm2 2.291 CV 1
OR { 134}
(( segid " " and resid 293 and name HE ))
(( segid " " and resid 301 and name HG3 ))
ASSI { 187}
(( segid " " and resid 213 and name H ))
(( segid " " and resid 210 and name HB2 ))
3.700 1.700 1.700 peak 187 spectrum 1 weight 0.10000E+01 volume 0.30802E-03 ppm1 5.886 ppm2 1.609 CV 1
OR { 187}
(( segid " " and resid 213 and name H ))
(( segid " " and resid 214 and name HB2 ))
OR { 187}
(( segid " " and resid 213 and name H ))
(( segid " " and resid 210 and name HG2 ))
ASSI { 470}
(( segid " " and resid 356 and name H ))
(( segid " " and resid 354 and name H ))
4.600 2.700 1.400 peak 470 spectrum 1 weight 0.10000E+01 volume 0.38697E-03 ppm1 7.362 ppm2 8.941 CV 1
OR { 470}
(( segid " " and resid 356 and name H ))
(( segid " " and resid 353 and name H ))
ASSI { 142}
(( segid " " and resid 326 and name H ))
(( segid " " and resid 325 and name HA ))
3.500 1.600 1.600 peak 142 spectrum 1 weight 0.10000E+01 volume 0.79703E-03 ppm1 8.929 ppm2 3.909 CV 1
OR { 142}
(( segid " " and resid 326 and name H ))
(( segid " " and resid 324 and name HA ))
OR { 142}
(( segid " " and resid 326 and name H ))
(( segid " " and resid 329 and name HA ))
ASSI { 197}
(( segid " " and resid 279 and name H ))
( segid " " and resid 284 and name HE% )
3.800 1.800 1.800 peak 197 spectrum 1 weight 0.10000E+01 volume 0.59871E-03 ppm1 9.037 ppm2 2.184 CV 1
OR { 197}
(( segid " " and resid 279 and name H ))
(( segid " " and resid 284 and name HB2 ))
OR { 197}
(( segid " " and resid 279 and name H ))
(( segid " " and resid 284 and name HB3 ))
OR { 197}
(( segid " " and resid 279 and name H ))
(( segid " " and resid 310 and name HG ))
ASSI { 278}
(( segid " " and resid 340 and name HE21))
(( segid " " and resid 339 and name HB ))
4.900 3.000 1.100 peak 278 spectrum 1 weight 0.10000E+01 volume 0.80087E-03 ppm1 6.787 ppm2 1.563 CV 1
OR { 278}
(( segid " " and resid 340 and name HE21))
(( segid " " and resid 337 and name HB3 ))
ASSI { 985}
(( segid " " and resid 310 and name H ))
(( segid " " and resid 283 and name HG ))
4.400 2.500 1.600 peak 985 spectrum 1 weight 0.10000E+01 volume 0.55443E-03 ppm1 7.066 ppm2 1.567 CV 1
OR { 985}
(( segid " " and resid 310 and name H ))
(( segid " " and resid 307 and name HB2 ))
OR { 985}
(( segid " " and resid 310 and name H ))
(( segid " " and resid 308 and name HD2 ))
OR { 985}
(( segid " " and resid 310 and name H ))
(( segid " " and resid 278 and name HB3 ))
ASSI { 821}
(( segid " " and resid 367 and name H ))
( segid " " and resid 368 and name HD% )
4.700 2.800 1.300 peak 821 spectrum 1 weight 0.10000E+01 volume 0.60643E-03 ppm1 7.860 ppm2 7.129 CV 1
OR { 821}
(( segid " " and resid 367 and name H ))
( segid " " and resid 303 and name HD% )
ASSI { 2641}
(( segid " " and resid 262 and name H ))
(( segid " " and resid 262 and name HB ))
2.900 1.100 1.100 peak 2641 spectrum 1 weight 0.10000E+01 volume 0.16960E-02 ppm1 7.888 ppm2 4.519 CV 1
OR { 2641}
(( segid " " and resid 262 and name H ))
(( segid " " and resid 261 and name HA ))
ASSI { 86}
(( segid " " and resid 270 and name H ))
( segid " " and resid 266 and name HD2%)
4.000 2.000 2.000 peak 86 spectrum 1 weight 0.10000E+01 volume 0.88171E-03 ppm1 8.540 ppm2 0.787 CV 1
OR { 86}
(( segid " " and resid 270 and name H ))
( segid " " and resid 271 and name HD1%)
OR { 86}
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( segid " " and resid 271 and name HD2%)
OR { 86}
(( segid " " and resid 270 and name H ))
( segid " " and resid 274 and name HD2%)
ASSI { 2899}
(( segid " " and resid 356 and name H ))
(( segid " " and resid 357 and name H ))
2.700 0.900 0.900 peak 2899 spectrum 1 weight 0.10000E+01 volume 0.13399E-02 ppm1 7.364 ppm2 8.124 CV 1
OR { 2899}
(( segid " " and resid 356 and name H ))
(( segid " " and resid 355 and name H ))
ASSI { 1973}
(( segid " " and resid 357 and name H ))
(( segid " " and resid 356 and name HB ))
2.600 0.800 0.800 peak 1973 spectrum 1 weight 0.10000E+01 volume 0.14092E-02 ppm1 8.145 ppm2 1.984 CV 1
OR { 1973}
(( segid " " and resid 357 and name H ))
(( segid " " and resid 357 and name HB2 ))
ASSI { 660}
(( segid " " and resid 328 and name H ))
( segid " " and resid 231 and name HE% )
5.500 3.800 0.500 peak 660 spectrum 1 weight 0.10000E+01 volume 0.72193E-03 ppm1 7.194 ppm2 6.798 CV 1
OR { 660}
(( segid " " and resid 359 and name H ))
( segid " " and resid 303 and name HE% )
OR { 660}
(( segid " " and resid 328 and name H ))
( segid " " and resid 231 and name HD% )
ASSI { 1377}
(( segid " " and resid 426 and name H ))
(( segid " " and resid 426 and name HG2 ))
3.100 1.200 1.200 peak 1377 spectrum 1 weight 0.10000E+01 volume 0.68266E-02 ppm1 7.994 ppm2 2.271 CV 1
OR { 1377}
(( segid " " and resid 302 and name H ))
(( segid " " and resid 302 and name HG2 ))
OR { 1377}
(( segid " " and resid 302 and name H ))
(( segid " " and resid 301 and name HG3 ))
ASSI { 176}
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(( segid " " and resid 256 and name HA ))
4.600 2.700 1.400 peak 176 spectrum 1 weight 0.10000E+01 volume 0.87981E-03 ppm1 6.861 ppm2 4.136 CV 1
OR { 176}
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(( segid " " and resid 253 and name HA ))
ASSI { 727}
(( segid " " and resid 274 and name H ))
(( segid " " and resid 191 and name HA2 ))
5.100 3.300 0.900 peak 727 spectrum 1 weight 0.10000E+01 volume 0.36962E-03 ppm1 7.022 ppm2 4.139 CV 1
OR { 727}
(( segid " " and resid 274 and name H ))
(( segid " " and resid 193 and name HA ))
ASSI { 256}
(( segid " " and resid 276 and name H ))
(( segid " " and resid 194 and name HA ))
3.900 1.900 1.900 peak 256 spectrum 1 weight 0.10000E+01 volume 0.51978E-03 ppm1 6.947 ppm2 3.823 CV 1
OR { 256}
(( segid " " and resid 276 and name H ))
(( segid " " and resid 193 and name HD2 ))
OR { 256}
(( segid " " and resid 276 and name H ))
(( segid " " and resid 278 and name HA ))
OR { 256}
(( segid " " and resid 276 and name H ))
(( segid " " and resid 314 and name HA ))
ASSI { 287}
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(( segid " " and resid 211 and name HA ))
3.800 1.800 1.800 peak 287 spectrum 1 weight 0.10000E+01 volume 0.43125E-03 ppm1 7.189 ppm2 3.843 CV 1
OR { 287}
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(( segid " " and resid 216 and name HA ))
ASSI { 35}
(( segid " " and resid 318 and name H ))
( segid " " and resid 278 and name HD2%)
3.700 1.700 1.700 peak 35 spectrum 1 weight 0.10000E+01 volume 0.13110E-02 ppm1 8.049 ppm2 0.737 CV 1
OR { 35}
(( segid " " and resid 318 and name H ))
( segid " " and resid 316 and name HD2%)
OR { 35}
(( segid " " and resid 318 and name H ))
( segid " " and resid 271 and name HD2%)
OR { 35}
(( segid " " and resid 318 and name H ))
( segid " " and resid 350 and name HG1%)
OR { 35}
(( segid " " and resid 318 and name H ))
( segid " " and resid 367 and name HD2%)
ASSI { 138}
(( segid " " and resid 298 and name H ))
(( segid " " and resid 293 and name HG2 ))
5.100 3.300 0.900 peak 138 spectrum 1 weight 0.10000E+01 volume 0.94718E-03 ppm1 7.340 ppm2 1.533 CV 1
OR { 138}
(( segid " " and resid 298 and name H ))
( segid " " and resid 290 and name HB% )
ASSI { 677}
(( segid " " and resid 242 and name H ))
(( segid " " and resid 243 and name H ))
2.900 1.000 1.000 peak 677 spectrum 1 weight 0.10000E+01 volume 0.16036E-02 ppm1 7.549 ppm2 7.855 CV 1
OR { 677}
(( segid " " and resid 364 and name H ))
(( segid " " and resid 362 and name H ))
OR { 677}
(( segid " " and resid 364 and name H ))
(( segid " " and resid 367 and name H ))
ASSI { 565}
(( segid " " and resid 279 and name H ))
(( segid " " and resid 278 and name HB2 ))
2.800 1.000 1.000 peak 565 spectrum 1 weight 0.10000E+01 volume 0.92021E-03 ppm1 9.035 ppm2 1.148 CV 1
OR { 565}
(( segid " " and resid 279 and name H ))
( segid " " and resid 280 and name HG2%)
ASSI { 744}
(( segid " " and resid 314 and name H ))
(( segid " " and resid 313 and name HB3 ))
2.500 0.800 0.800 peak 744 spectrum 1 weight 0.10000E+01 volume 0.27183E-02 ppm1 7.343 ppm2 2.833 CV 1
OR { 744}
(( segid " " and resid 314 and name H ))
(( segid " " and resid 313 and name HB2 ))
OR { 744}
(( segid " " and resid 314 and name H ))
(( segid " " and resid 314 and name HB2 ))
ASSI { 1701}
(( segid " " and resid 347 and name H ))
(( segid " " and resid 346 and name HA ))
2.800 1.000 1.000 peak 1701 spectrum 1 weight 0.10000E+01 volume 0.36944E-02 ppm1 9.033 ppm2 4.053 CV 1
OR { 1701}
(( segid " " and resid 347 and name H ))
(( segid " " and resid 343 and name HA ))
ASSI { 973}
(( segid " " and resid 202 and name H ))
( segid " " and resid 211 and name HB% )
4.600 2.600 1.400 peak 973 spectrum 1 weight 0.10000E+01 volume 0.46203E-03 ppm1 8.207 ppm2 1.675 CV 1
OR { 973}
(( segid " " and resid 202 and name H ))
(( segid " " and resid 210 and name HG2 ))
OR { 973}
(( segid " " and resid 202 and name H ))
(( segid " " and resid 205 and name HB3 ))
OR { 973}
(( segid " " and resid 202 and name H ))
(( segid " " and resid 208 and name HB3 ))
ASSI { 493}
(( segid " " and resid 372 and name H ))
(( segid " " and resid 319 and name HB2 ))
4.300 2.300 1.700 peak 493 spectrum 1 weight 0.10000E+01 volume 0.27722E-03 ppm1 7.931 ppm2 3.298 CV 1
OR { 493}
(( segid " " and resid 372 and name H ))
(( segid " " and resid 320 and name HB3 ))
OR { 493}
(( segid " " and resid 372 and name H ))
(( segid " " and resid 324 and name HB3 ))
ASSI { 2591}
(( segid " " and resid 298 and name H ))
( segid " " and resid 295 and name HG2%)
3.500 1.500 1.500 peak 2591 spectrum 1 weight 0.10000E+01 volume 0.22524E-02 ppm1 7.338 ppm2 1.148 CV 1
OR { 2591}
(( segid " " and resid 298 and name H ))
( segid " " and resid 297 and name HG2%)
ASSI { 841}
(( segid " " and resid 440 and name H ))
( segid " " and resid 398 and name HG2%)
3.600 1.600 1.600 peak 841 spectrum 1 weight 0.10000E+01 volume 0.15767E-02 ppm1 8.444 ppm2 0.830 CV 1
OR { 841}
(( segid " " and resid 247 and name H ))
( segid " " and resid 266 and name HD1%)
OR { 841}
(( segid " " and resid 440 and name H ))
( segid " " and resid 443 and name HD2%)
OR { 841}
(( segid " " and resid 440 and name H ))
( segid " " and resid 436 and name HD2%)
OR { 841}
(( segid " " and resid 247 and name H ))
( segid " " and resid 266 and name HD2%)
OR { 841}
(( segid " " and resid 440 and name H ))
( segid " " and resid 443 and name HD1%)
ASSI { 338}
(( segid " " and resid 334 and name H ))
(( segid " " and resid 331 and name HB2 ))
5.200 3.400 0.800 peak 338 spectrum 1 weight 0.10000E+01 volume 0.39659E-03 ppm1 8.131 ppm2 2.573 CV 1
OR { 338}
(( segid " " and resid 334 and name H ))
(( segid " " and resid 331 and name HB3 ))
OR { 338}
(( segid " " and resid 334 and name H ))
(( segid " " and resid 332 and name HB3 ))
ASSI { 581}
(( segid " " and resid 218 and name H ))
(( segid " " and resid 215 and name HA ))
3.700 1.700 1.700 peak 581 spectrum 1 weight 0.10000E+01 volume 0.89906E-03 ppm1 7.982 ppm2 3.904 CV 1
OR { 581}
(( segid " " and resid 218 and name H ))
(( segid " " and resid 216 and name HA ))
OR { 581}
(( segid " " and resid 218 and name H ))
(( segid " " and resid 376 and name HA ))
ASSI { 957}
(( segid " " and resid 269 and name H ))
(( segid " " and resid 270 and name HB3 ))
4.700 2.700 1.300 peak 957 spectrum 1 weight 0.10000E+01 volume 0.57368E-03 ppm1 8.201 ppm2 2.619 CV 1
OR { 957}
(( segid " " and resid 269 and name H ))
(( segid " " and resid 273 and name HB2 ))
ASSI { 1121}
(( segid " " and resid 205 and name H ))
( segid " " and resid 204 and name HD% )
3.600 1.700 1.700 peak 1121 spectrum 1 weight 0.10000E+01 volume 0.16864E-02 ppm1 6.380 ppm2 6.886 CV 1
OR { 1121}
(( segid " " and resid 205 and name H ))
(( segid " " and resid 207 and name H ))
ASSI { 252}
(( segid " " and resid 238 and name H ))
(( segid " " and resid 239 and name HG3 ))
6.000 4.600 0.000 peak 252 spectrum 1 weight 0.10000E+01 volume 0.50246E-03 ppm1 8.664 ppm2 1.567 CV 1
OR { 252}
(( segid " " and resid 238 and name H ))
(( segid " " and resid 236 and name HG13))
ASSI { 908}
(( segid " " and resid 185 and name HD22))
(( segid " " and resid 186 and name HB3 ))
4.500 2.500 1.500 peak 908 spectrum 1 weight 0.10000E+01 volume 0.77199E-03 ppm1 7.564 ppm2 1.541 CV 1
OR { 908}
(( segid " " and resid 185 and name HD22))
(( segid " " and resid 186 and name HB2 ))
OR { 908}
(( segid " " and resid 185 and name HD22))
(( segid " " and resid 187 and name HD3 ))
OR { 908}
(( segid " " and resid 185 and name HD22))
(( segid " " and resid 186 and name HG ))
OR { 908}
(( segid " " and resid 185 and name HD22))
(( segid " " and resid 200 and name HG3 ))
ASSI { 210}
(( segid " " and resid 394 and name H ))
( segid " " and resid 398 and name HG2%)
5.000 3.200 1.000 peak 210 spectrum 1 weight 0.10000E+01 volume 0.57562E-03 ppm1 7.543 ppm2 0.831 CV 1
OR { 210}
(( segid " " and resid 394 and name H ))
( segid " " and resid 439 and name HD2%)
OR { 210}
(( segid " " and resid 394 and name H ))
( segid " " and resid 439 and name HD1%)
ASSI { 837}
(( segid " " and resid 189 and name H ))
(( segid " " and resid 189 and name HG13))
3.300 1.400 1.400 peak 837 spectrum 1 weight 0.10000E+01 volume 0.60256E-03 ppm1 8.884 ppm2 1.714 CV 1
OR { 837}
(( segid " " and resid 215 and name H ))
(( segid " " and resid 214 and name HB2 ))
OR { 837}
(( segid " " and resid 189 and name H ))
(( segid " " and resid 189 and name HG12))
OR { 837}
(( segid " " and resid 215 and name H ))
( segid " " and resid 211 and name HB% )
ASSI { 270}
(( segid " " and resid 277 and name HD21))
(( segid " " and resid 277 and name HA ))
4.200 2.200 1.800 peak 270 spectrum 1 weight 0.10000E+01 volume 0.85477E-03 ppm1 7.675 ppm2 4.519 CV 1
OR { 270}
(( segid " " and resid 277 and name HD21))
(( segid " " and resid 350 and name HA ))
OR { 270}
(( segid " " and resid 277 and name HD21))
(( segid " " and resid 280 and name HB ))
ASSI { 517}
(( segid " " and resid 222 and name H ))
(( segid " " and resid 219 and name HA ))
3.500 1.500 1.500 peak 517 spectrum 1 weight 0.10000E+01 volume 0.94718E-03 ppm1 7.250 ppm2 4.121 CV 1
OR { 517}
(( segid " " and resid 222 and name H ))
(( segid " " and resid 218 and name HA ))
ASSI { 215}
(( segid " " and resid 395 and name HE21))
( segid " " and resid 443 and name HD1%)
3.900 1.900 1.900 peak 215 spectrum 1 weight 0.10000E+01 volume 0.15613E-02 ppm1 7.773 ppm2 0.823 CV 1
OR { 215}
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( segid " " and resid 443 and name HD2%)
OR { 215}
(( segid " " and resid 395 and name HE21))
( segid " " and resid 398 and name HG2%)
ASSI { 330}
(( segid " " and resid 219 and name H ))
(( segid " " and resid 216 and name HA ))
3.600 1.700 1.700 peak 330 spectrum 1 weight 0.10000E+01 volume 0.85284E-03 ppm1 7.695 ppm2 3.888 CV 1
OR { 330}
(( segid " " and resid 219 and name H ))
(( segid " " and resid 215 and name HA ))
OR { 330}
(( segid " " and resid 219 and name H ))
(( segid " " and resid 221 and name HA ))
ASSI { 10}
(( segid " " and resid 359 and name H ))
(( segid " " and resid 360 and name HA ))
5.000 3.100 1.000 peak 10 spectrum 1 weight 0.10000E+01 volume 0.56984E-03 ppm1 7.197 ppm2 4.257 CV 1
OR { 10}
(( segid " " and resid 359 and name H ))
(( segid " " and resid 361 and name HA ))
ASSI { 2192}
(( segid " " and resid 361 and name H ))
(( segid " " and resid 361 and name HB2 ))
2.600 0.900 0.900 peak 2192 spectrum 1 weight 0.10000E+01 volume 0.19925E-02 ppm1 8.405 ppm2 3.095 CV 1
OR { 2192}
(( segid " " and resid 361 and name H ))
(( segid " " and resid 360 and name HB3 ))
ASSI { 119}
(( segid " " and resid 309 and name H ))
( segid " " and resid 310 and name HD2%)
3.900 1.900 1.900 peak 119 spectrum 1 weight 0.10000E+01 volume 0.14054E-02 ppm1 7.491 ppm2 1.080 CV 1
OR { 119}
(( segid " " and resid 309 and name H ))
( segid " " and resid 310 and name HD1%)
OR { 119}
(( segid " " and resid 309 and name H ))
( segid " " and resid 307 and name HD2%)
ASSI { 886}
(( segid " " and resid 431 and name H ))
( segid " " and resid 432 and name HG1%)
4.700 2.700 1.300 peak 886 spectrum 1 weight 0.10000E+01 volume 0.81240E-03 ppm1 7.965 ppm2 1.098 CV 1
OR { 886}
(( segid " " and resid 329 and name H ))
(( segid " " and resid 342 and name HG12))
OR { 886}
(( segid " " and resid 431 and name H ))
( segid " " and resid 432 and name HG2%)
OR { 886}
(( segid " " and resid 386 and name H ))
( segid " " and resid 387 and name HG2%)
ASSI { 550}
(( segid " " and resid 240 and name H ))
(( segid " " and resid 242 and name HA ))
4.700 2.800 1.300 peak 550 spectrum 1 weight 0.10000E+01 volume 0.57946E-03 ppm1 8.016 ppm2 3.985 CV 1
OR { 550}
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(( segid " " and resid 265 and name HB3 ))
OR { 550}
(( segid " " and resid 240 and name H ))
(( segid " " and resid 265 and name HB2 ))
OR { 550}
(( segid " " and resid 240 and name H ))
(( segid " " and resid 266 and name HA ))
OR { 550}
(( segid " " and resid 240 and name H ))
(( segid " " and resid 255 and name HA ))
ASSI { 905}
(( segid " " and resid 426 and name H ))
(( segid " " and resid 425 and name HG3 ))
4.100 2.100 1.900 peak 905 spectrum 1 weight 0.10000E+01 volume 0.15421E-02 ppm1 7.994 ppm2 1.251 CV 1
OR { 905}
(( segid " " and resid 306 and name H ))
( segid " " and resid 307 and name HD1%)
ASSI { 883}
(( segid " " and resid 202 and name H ))
(( segid " " and resid 198 and name HA ))
4.200 2.200 1.800 peak 883 spectrum 1 weight 0.10000E+01 volume 0.68343E-03 ppm1 8.207 ppm2 2.904 CV 1
OR { 883}
(( segid " " and resid 202 and name H ))
(( segid " " and resid 208 and name HD3 ))
ASSI { 121}
(( segid " " and resid 276 and name H ))
(( segid " " and resid 194 and name H ))
4.300 2.300 1.700 peak 121 spectrum 1 weight 0.10000E+01 volume 0.48706E-03 ppm1 6.943 ppm2 9.120 CV 1
OR { 121}
(( segid " " and resid 276 and name H ))
(( segid " " and resid 281 and name H ))
ASSI { 485}
(( segid " " and resid 320 and name H ))
(( segid " " and resid 321 and name HB3 ))
4.400 2.400 1.600 peak 485 spectrum 1 weight 0.10000E+01 volume 0.49478E-03 ppm1 8.420 ppm2 1.596 CV 1
OR { 485}
(( segid " " and resid 320 and name H ))
(( segid " " and resid 316 and name HG ))
OR { 485}
(( segid " " and resid 320 and name H ))
(( segid " " and resid 217 and name HB ))
OR { 485}
(( segid " " and resid 320 and name H ))
(( segid " " and resid 374 and name HB2 ))
ASSI { 76}
(( segid " " and resid 356 and name H ))
(( segid " " and resid 357 and name HA ))
5.100 3.200 0.900 peak 76 spectrum 1 weight 0.10000E+01 volume 0.33883E-03 ppm1 7.365 ppm2 3.860 CV 1
OR { 76}
(( segid " " and resid 356 and name H ))
(( segid " " and resid 343 and name HB3 ))
OR { 76}
(( segid " " and resid 356 and name H ))
(( segid " " and resid 288 and name HA ))
OR { 76}
(( segid " " and resid 356 and name H ))
(( segid " " and resid 343 and name HB2 ))
OR { 76}
(( segid " " and resid 356 and name H ))
(( segid " " and resid 347 and name HB2 ))
ASSI { 472}
(( segid " " and resid 268 and name H ))
(( segid " " and resid 267 and name HA ))
3.400 1.400 1.400 peak 472 spectrum 1 weight 0.10000E+01 volume 0.15478E-02 ppm1 7.869 ppm2 3.976 CV 1
OR { 472}
(( segid " " and resid 268 and name H ))
(( segid " " and resid 266 and name HA ))
OR { 472}
(( segid " " and resid 268 and name H ))
(( segid " " and resid 265 and name HB2 ))
ASSI { 980}
(( segid " " and resid 250 and name H ))
(( segid " " and resid 249 and name HB3 ))
3.800 1.800 1.800 peak 980 spectrum 1 weight 0.10000E+01 volume 0.15690E-02 ppm1 8.055 ppm2 1.708 CV 1
OR { 980}
(( segid " " and resid 250 and name H ))
(( segid " " and resid 249 and name HG3 ))
OR { 980}
(( segid " " and resid 250 and name H ))
(( segid " " and resid 251 and name HB2 ))
ASSI { 567}
(( segid " " and resid 265 and name H ))
(( segid " " and resid 266 and name HB3 ))
4.900 3.000 1.100 peak 567 spectrum 1 weight 0.10000E+01 volume 0.66418E-03 ppm1 7.756 ppm2 1.568 CV 1
OR { 567}
(( segid " " and resid 265 and name H ))
(( segid " " and resid 266 and name HB2 ))
OR { 567}
(( segid " " and resid 265 and name H ))
(( segid " " and resid 263 and name HB ))
OR { 567}
(( segid " " and resid 265 and name H ))
(( segid " " and resid 266 and name HG ))
ASSI { 1270}
(( segid " " and resid 352 and name H ))
( segid " " and resid 279 and name HD2%)
5.400 3.700 0.600 peak 1270 spectrum 1 weight 0.10000E+01 volume 0.61990E-03 ppm1 7.050 ppm2 0.387 CV 1
OR { 1270}
(( segid " " and resid 352 and name H ))
( segid " " and resid 356 and name HG2%)
ASSI { 859}
(( segid " " and resid 369 and name H ))
(( segid " " and resid 371 and name H ))
3.100 1.200 1.200 peak 859 spectrum 1 weight 0.10000E+01 volume 0.75465E-03 ppm1 7.753 ppm2 7.549 CV 1
OR { 859}
(( segid " " and resid 369 and name H ))
(( segid " " and resid 370 and name HD22))
ASSI { 614}
(( segid " " and resid 203 and name H ))
(( segid " " and resid 203 and name HB3 ))
4.200 2.200 1.800 peak 614 spectrum 1 weight 0.10000E+01 volume 0.66609E-03 ppm1 8.266 ppm2 1.878 CV 1
OR { 614}
(( segid " " and resid 203 and name H ))
( segid " " and resid 202 and name HE% )
ASSI { 394}
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(( segid " " and resid 232 and name HD3 ))
5.400 3.600 0.600 peak 394 spectrum 1 weight 0.10000E+01 volume 0.36384E-03 ppm1 7.420 ppm2 2.961 CV 1
OR { 394}
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(( segid " " and resid 339 and name HA ))
ASSI { 1017}
(( segid " " and resid 226 and name H ))
(( segid " " and resid 226 and name HA ))
3.000 1.100 1.100 peak 1017 spectrum 1 weight 0.10000E+01 volume 0.22794E-02 ppm1 7.438 ppm2 4.384 CV 1
OR { 1017}
(( segid " " and resid 226 and name H ))
(( segid " " and resid 225 and name HA ))
ASSI { 65}
(( segid " " and resid 304 and name HE22))
(( segid " " and resid 304 and name HG2 ))
3.600 1.600 1.600 peak 65 spectrum 1 weight 0.10000E+01 volume 0.28049E-02 ppm1 7.012 ppm2 2.464 CV 1
OR { 65}
(( segid " " and resid 304 and name HE22))
(( segid " " and resid 301 and name HG2 ))
ASSI { 977}
(( segid " " and resid 242 and name H ))
(( segid " " and resid 239 and name HB3 ))
4.400 2.400 1.600 peak 977 spectrum 1 weight 0.10000E+01 volume 0.78546E-03 ppm1 7.546 ppm2 1.774 CV 1
OR { 977}
(( segid " " and resid 242 and name H ))
(( segid " " and resid 239 and name HD2 ))
OR { 977}
(( segid " " and resid 242 and name H ))
(( segid " " and resid 243 and name HB2 ))
ASSI { 110}
(( segid " " and resid 291 and name H ))
( segid " " and resid 356 and name HG1%)
4.200 2.200 1.800 peak 110 spectrum 1 weight 0.10000E+01 volume 0.10916E-02 ppm1 7.363 ppm2 0.828 CV 1
OR { 110}
(( segid " " and resid 291 and name H ))
( segid " " and resid 367 and name HD2%)
ASSI { 671}
(( segid " " and resid 424 and name H ))
(( segid " " and resid 427 and name HG2 ))
6.000 4.700 0.000 peak 671 spectrum 1 weight 0.10000E+01 volume 0.33498E-03 ppm1 8.283 ppm2 2.260 CV 1
OR { 671}
(( segid " " and resid 424 and name H ))
(( segid " " and resid 426 and name HG2 ))
ASSI { 579}
(( segid " " and resid 202 and name H ))
(( segid " " and resid 199 and name HA ))
4.400 2.400 1.600 peak 579 spectrum 1 weight 0.10000E+01 volume 0.52171E-03 ppm1 8.205 ppm2 3.856 CV 1
OR { 579}
(( segid " " and resid 202 and name H ))
(( segid " " and resid 211 and name HA ))
OR { 579}
(( segid " " and resid 202 and name H ))
(( segid " " and resid 197 and name HA ))
OR { 579}
(( segid " " and resid 202 and name H ))
(( segid " " and resid 206 and name HA3 ))
ASSI { 503}
(( segid " " and resid 343 and name H ))
(( segid " " and resid 339 and name HA ))
4.200 2.200 1.800 peak 503 spectrum 1 weight 0.10000E+01 volume 0.66803E-03 ppm1 8.202 ppm2 2.990 CV 1
OR { 503}
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(( segid " " and resid 381 and name HD3 ))
ASSI { 1908}
(( segid " " and resid 291 and name H ))
(( segid " " and resid 290 and name H ))
2.400 0.700 0.700 peak 1908 spectrum 1 weight 0.10000E+01 volume 0.46742E-02 ppm1 7.364 ppm2 7.811 CV 1
OR { 1908}
(( segid " " and resid 291 and name H ))
(( segid " " and resid 292 and name H ))
ASSI { 823}
(( segid " " and resid 219 and name H ))
( segid " " and resid 219 and name HE% )
5.900 4.300 0.100 peak 823 spectrum 1 weight 0.10000E+01 volume 0.45434E-03 ppm1 7.704 ppm2 6.426 CV 1
OR { 823}
(( segid " " and resid 219 and name H ))
( segid " " and resid 223 and name HD% )
ASSI { 543}
(( segid " " and resid 351 and name HE21))
(( segid " " and resid 272 and name HB2 ))
2.600 2.600 3.400 peak 543 spectrum 1 weight 0.10000E+01 volume 0.12051E-02 ppm1 6.759 ppm2 1.876 CV 1
OR { 543}
(( segid " " and resid 351 and name HE21))
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OR { 543}
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OR { 839}
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4.200 2.200 1.800 peak 812 spectrum 1 weight 0.10000E+01 volume 0.10415E-02 ppm1 8.079 ppm2 1.638 CV 1
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3.000 1.100 1.100 peak 1062 spectrum 1 weight 0.10000E+01 volume 0.10839E-02 ppm1 7.310 ppm2 1.992 CV 1
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ASSI { 2275}
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2.600 0.800 0.800 peak 2275 spectrum 1 weight 0.10000E+01 volume 0.35559E-02 ppm1 7.704 ppm2 3.898 CV 1
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2.300 0.700 0.700 peak 2567 spectrum 1 weight 0.10000E+01 volume 0.38196E-02 ppm1 8.071 ppm2 1.148 CV 1
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ASSI { 175}
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4.800 2.800 1.200 peak 175 spectrum 1 weight 0.10000E+01 volume 0.64684E-03 ppm1 7.497 ppm2 1.711 CV 1
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ASSI { 353}
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3.900 1.900 1.900 peak 353 spectrum 1 weight 0.10000E+01 volume 0.12071E-02 ppm1 7.003 ppm2 3.957 CV 1
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ASSI { 3041}
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2.800 1.000 1.000 peak 3041 spectrum 1 weight 0.10000E+01 volume 0.26933E-02 ppm1 8.202 ppm2 3.891 CV 1
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4.500 2.600 1.500 peak 560 spectrum 1 weight 0.10000E+01 volume 0.41006E-03 ppm1 8.445 ppm2 1.190 CV 1
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ASSI { 499}
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4.900 3.100 1.100 peak 499 spectrum 1 weight 0.10000E+01 volume 0.65071E-03 ppm1 7.550 ppm2 1.354 CV 1
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4.300 2.300 1.700 peak 234 spectrum 1 weight 0.10000E+01 volume 0.53902E-03 ppm1 8.337 ppm2 7.563 CV 1
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(( segid " " and resid 364 and name H ))
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ASSI { 509}
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4.700 2.800 1.300 peak 509 spectrum 1 weight 0.10000E+01 volume 0.91058E-03 ppm1 7.639 ppm2 2.212 CV 1
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ASSI { 2251}
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3.200 1.300 1.300 peak 2251 spectrum 1 weight 0.10000E+01 volume 0.18828E-02 ppm1 8.616 ppm2 3.897 CV 1
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ASSI { 396}
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4.300 2.300 1.700 peak 396 spectrum 1 weight 0.10000E+01 volume 0.64299E-03 ppm1 7.381 ppm2 0.743 CV 1
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ASSI { 416}
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4.400 2.400 1.600 peak 416 spectrum 1 weight 0.10000E+01 volume 0.68728E-03 ppm1 8.238 ppm2 8.545 CV 1
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(( segid " " and resid 378 and name H ))
OR { 416}
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ASSI { 54}
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5.200 3.300 0.800 peak 54 spectrum 1 weight 0.10000E+01 volume 0.33690E-03 ppm1 7.023 ppm2 2.169 CV 1
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ASSI { 422}
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4.600 2.700 1.400 peak 422 spectrum 1 weight 0.10000E+01 volume 0.54096E-03 ppm1 6.856 ppm2 4.431 CV 1
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ASSI { 731}
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(( segid " " and resid 385 and name HA ))
2.900 1.000 1.000 peak 731 spectrum 1 weight 0.10000E+01 volume 0.23198E-02 ppm1 7.963 ppm2 4.182 CV 1
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ASSI { 832}
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4.700 2.800 1.300 peak 832 spectrum 1 weight 0.10000E+01 volume 0.76815E-03 ppm1 9.033 ppm2 4.551 CV 1
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(( segid " " and resid 350 and name HA ))
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ASSI { 619}
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4.200 2.300 1.800 peak 619 spectrum 1 weight 0.10000E+01 volume 0.11647E-02 ppm1 7.862 ppm2 0.796 CV 1
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ASSI { 2004}
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(( segid " " and resid 363 and name H ))
2.900 1.100 1.100 peak 2004 spectrum 1 weight 0.10000E+01 volume 0.13476E-02 ppm1 7.796 ppm2 7.260 CV 1
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(( segid " " and resid 360 and name H ))
ASSI { 599}
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5.300 3.500 0.700 peak 599 spectrum 1 weight 0.10000E+01 volume 0.65646E-03 ppm1 7.418 ppm2 1.533 CV 1
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(( segid " " and resid 232 and name HG2 ))
OR { 599}
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(( segid " " and resid 339 and name HB ))
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3.600 1.600 1.600 peak 208 spectrum 1 weight 0.10000E+01 volume 0.10858E-02 ppm1 8.793 ppm2 3.881 CV 1
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ASSI { 1412}
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(( segid " " and resid 206 and name HA3 ))
2.900 1.100 1.100 peak 1412 spectrum 1 weight 0.10000E+01 volume 0.38485E-02 ppm1 7.661 ppm2 3.829 CV 1
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ASSI { 166}
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3.500 1.500 1.500 peak 166 spectrum 1 weight 0.10000E+01 volume 0.15363E-02 ppm1 7.810 ppm2 1.545 CV 1
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( segid " " and resid 290 and name HB% )
OR { 166}
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ASSI { 1314}
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( segid " " and resid 318 and name HG2%)
2.400 0.700 0.700 peak 1314 spectrum 1 weight 0.10000E+01 volume 0.41700E-02 ppm1 8.049 ppm2 0.372 CV 1
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ASSI { 624}
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4.500 2.500 1.500 peak 624 spectrum 1 weight 0.10000E+01 volume 0.64684E-03 ppm1 8.201 ppm2 1.051 CV 1
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ASSI { 984}
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4.600 2.600 1.400 peak 984 spectrum 1 weight 0.10000E+01 volume 0.69884E-03 ppm1 7.799 ppm2 7.107 CV 1
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ASSI { 873}
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(( segid " " and resid 213 and name HB2 ))
4.200 2.200 1.800 peak 873 spectrum 1 weight 0.10000E+01 volume 0.78352E-03 ppm1 7.187 ppm2 2.252 CV 1
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ASSI { 575}
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6.000 4.700 0.000 peak 575 spectrum 1 weight 0.10000E+01 volume 0.37346E-03 ppm1 7.342 ppm2 7.056 CV 1
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(( segid " " and resid 310 and name H ))
ASSI { 22}
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(( segid " " and resid 359 and name H ))
3.100 1.200 1.200 peak 22 spectrum 1 weight 0.10000E+01 volume 0.16056E-02 ppm1 8.564 ppm2 7.191 CV 1
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ASSI { 930}
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3.200 1.300 1.300 peak 930 spectrum 1 weight 0.10000E+01 volume 0.30032E-03 ppm1 6.760 ppm2 1.197 CV 1
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ASSI { 364}
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3.300 1.400 1.400 peak 364 spectrum 1 weight 0.10000E+01 volume 0.13553E-02 ppm1 7.992 ppm2 3.088 CV 1
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ASSI { 697}
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3.800 1.800 1.800 peak 697 spectrum 1 weight 0.10000E+01 volume 0.18539E-02 ppm1 7.437 ppm2 1.562 CV 1
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OR { 697}
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ASSI { 477}
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5.100 3.200 0.900 peak 477 spectrum 1 weight 0.10000E+01 volume 0.92215E-03 ppm1 8.702 ppm2 1.593 CV 1
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ASSI { 346}
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4.800 2.900 1.200 peak 346 spectrum 1 weight 0.10000E+01 volume 0.44662E-03 ppm1 7.192 ppm2 2.705 CV 1
OR { 346}
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OR { 346}
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ASSI { 635}
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4.400 2.500 1.600 peak 635 spectrum 1 weight 0.10000E+01 volume 0.12879E-02 ppm1 8.333 ppm2 0.569 CV 1
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OR { 635}
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ASSI { 491}
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5.800 4.200 0.200 peak 491 spectrum 1 weight 0.10000E+01 volume 0.51593E-03 ppm1 7.760 ppm2 2.258 CV 1
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ASSI { 777}
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(( segid " " and resid 304 and name HG2 ))
2.800 1.000 1.000 peak 777 spectrum 1 weight 0.10000E+01 volume 0.29609E-02 ppm1 6.656 ppm2 2.465 CV 1
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(( segid " " and resid 301 and name HG2 ))
ASSI { 2916}
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3.200 1.300 1.300 peak 2916 spectrum 1 weight 0.10000E+01 volume 0.12879E-02 ppm1 8.267 ppm2 3.781 CV 1
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ASSI { 224}
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2.600 0.900 0.900 peak 224 spectrum 1 weight 0.10000E+01 volume 0.49284E-02 ppm1 7.993 ppm2 1.612 CV 1
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ASSI { 443}
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4.700 2.800 1.300 peak 443 spectrum 1 weight 0.10000E+01 volume 0.52171E-03 ppm1 7.439 ppm2 1.251 CV 1
OR { 443}
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ASSI { 331}
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5.500 3.800 0.500 peak 331 spectrum 1 weight 0.10000E+01 volume 0.37925E-03 ppm1 7.343 ppm2 0.372 CV 1
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OR { 331}
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OR { 331}
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3.300 1.400 1.400 peak 656 spectrum 1 weight 0.10000E+01 volume 0.11532E-02 ppm1 9.622 ppm2 1.993 CV 1
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OR { 656}
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ASSI { 768}
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3.700 1.800 1.800 peak 768 spectrum 1 weight 0.10000E+01 volume 0.23083E-02 ppm1 8.793 ppm2 0.953 CV 1
OR { 768}
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( segid " " and resid 345 and name HG1%)
OR { 768}
(( segid " " and resid 232 and name H ))
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3.800 1.800 1.800 peak 1059 spectrum 1 weight 0.10000E+01 volume 0.87593E-03 ppm1 8.279 ppm2 8.003 CV 1
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(( segid " " and resid 427 and name H ))
ASSI { 3}
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3.500 3.500 2.500 peak 3 spectrum 1 weight 0.10000E+01 volume 0.42931E-03 ppm1 7.475 ppm2 2.587 CV 1
OR { 3}
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ASSI { 950}
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4.500 2.500 1.500 peak 950 spectrum 1 weight 0.10000E+01 volume 0.40428E-03 ppm1 8.325 ppm2 7.531 CV 1
OR { 950}
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(( segid " " and resid 364 and name H ))
OR { 950}
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2.500 0.800 0.800 peak 1800 spectrum 1 weight 0.10000E+01 volume 0.19097E-02 ppm1 6.995 ppm2 8.995 CV 1
OR { 1800}
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(( segid " " and resid 347 and name H ))
ASSI { 800}
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5.300 3.500 0.700 peak 800 spectrum 1 weight 0.10000E+01 volume 0.31380E-03 ppm1 5.885 ppm2 0.747 CV 1
OR { 800}
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OR { 800}
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OR { 800}
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OR { 800}
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ASSI { 3100}
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(( segid " " and resid 194 and name HG ))
4.600 2.700 1.400 peak 3100 spectrum 1 weight 0.10000E+01 volume 0.80855E-03 ppm1 9.118 ppm2 1.360 CV 1
OR { 3100}
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ASSI { 535}
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4.200 2.200 1.800 peak 535 spectrum 1 weight 0.10000E+01 volume 0.46397E-03 ppm1 8.203 ppm2 1.065 CV 1
OR { 535}
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ASSI { 1226}
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2.400 0.700 0.700 peak 1226 spectrum 1 weight 0.10000E+01 volume 0.43798E-02 ppm1 8.072 ppm2 3.745 CV 1
OR { 1226}
(( segid " " and resid 297 and name H ))
(( segid " " and resid 296 and name HA ))
ASSI { 447}
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(( segid " " and resid 401 and name HA ))
3.200 1.300 1.300 peak 447 spectrum 1 weight 0.10000E+01 volume 0.14766E-02 ppm1 7.793 ppm2 3.893 CV 1
OR { 447}
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(( segid " " and resid 400 and name HA ))
OR { 447}
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ASSI { 1584}
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(( segid " " and resid 214 and name HA ))
3.200 1.300 1.300 peak 1584 spectrum 1 weight 0.10000E+01 volume 0.93562E-03 ppm1 7.188 ppm2 3.571 CV 1
OR { 1584}
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ASSI { 1186}
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(( segid " " and resid 290 and name H ))
2.400 0.700 0.700 peak 1186 spectrum 1 weight 0.10000E+01 volume 0.45279E-02 ppm1 7.987 ppm2 7.796 CV 1
OR { 1186}
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(( segid " " and resid 425 and name H ))
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ASSI { 852}
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(( segid " " and resid 298 and name HB2 ))
3.200 1.300 1.300 peak 852 spectrum 1 weight 0.10000E+01 volume 0.18308E-02 ppm1 8.529 ppm2 1.919 CV 1
OR { 852}
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ASSI { 459}
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( segid " " and resid 323 and name HG2%)
3.100 1.200 1.200 peak 459 spectrum 1 weight 0.10000E+01 volume 0.52940E-03 ppm1 6.882 ppm2 0.427 CV 1
OR { 459}
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( segid " " and resid 371 and name HG1%)
ASSI { 516}
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4.500 2.600 1.500 peak 516 spectrum 1 weight 0.10000E+01 volume 0.75849E-03 ppm1 8.893 ppm2 2.738 CV 1
OR { 516}
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OR { 516}
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ASSI { 552}
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4.400 2.500 1.600 peak 552 spectrum 1 weight 0.10000E+01 volume 0.83165E-03 ppm1 8.202 ppm2 2.840 CV 1
OR { 552}
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(( segid " " and resid 382 and name HB3 ))
OR { 552}
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ASSI { 122}
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5.700 4.100 0.300 peak 122 spectrum 1 weight 0.10000E+01 volume 0.27530E-03 ppm1 8.213 ppm2 7.262 CV 1
OR { 122}
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(( segid " " and resid 360 and name H ))
OR { 122}
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ASSI { 339}
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5.400 3.700 0.600 peak 339 spectrum 1 weight 0.10000E+01 volume 0.25412E-03 ppm1 7.471 ppm2 2.819 CV 1
OR { 339}
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ASSI { 922}
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5.700 4.000 0.300 peak 922 spectrum 1 weight 0.10000E+01 volume 0.44278E-03 ppm1 9.177 ppm2 2.050 CV 1
OR { 922}
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(( segid " " and resid 351 and name HB2 ))
ASSI { 3006}
(( segid " " and resid 411 and name H ))
(( segid " " and resid 411 and name HB2 ))
2.700 0.900 0.900 peak 3006 spectrum 1 weight 0.10000E+01 volume 0.26548E-02 ppm1 7.729 ppm2 2.818 CV 1
OR { 3006}
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ASSI { 505}
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3.700 1.700 1.700 peak 505 spectrum 1 weight 0.10000E+01 volume 0.56215E-03 ppm1 7.827 ppm2 2.293 CV 1
OR { 505}
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OR { 505}
(( segid " " and resid 209 and name H ))
(( segid " " and resid 213 and name HB2 ))
OR { 505}
(( segid " " and resid 209 and name H ))
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ASSI { 445}
(( segid " " and resid 343 and name H ))
(( segid " " and resid 345 and name H ))
4.100 2.100 1.900 peak 445 spectrum 1 weight 0.10000E+01 volume 0.57368E-03 ppm1 8.199 ppm2 7.015 CV 1
OR { 445}
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( segid " " and resid 361 and name HE% )
OR { 445}
(( segid " " and resid 343 and name H ))
( segid " " and resid 358 and name HD% )
ASSI { 2582}
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(( segid " " and resid 409 and name HB2 ))
2.800 1.000 1.000 peak 2582 spectrum 1 weight 0.10000E+01 volume 0.12206E-02 ppm1 8.729 ppm2 1.629 CV 1
OR { 2582}
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ASSI { 965}
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(( segid " " and resid 327 and name H ))
5.300 3.500 0.700 peak 965 spectrum 1 weight 0.10000E+01 volume 0.28300E-03 ppm1 8.502 ppm2 7.569 CV 1
OR { 965}
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(( segid " " and resid 365 and name HE22))
OR { 965}
(( segid " " and resid 324 and name H ))
(( segid " " and resid 364 and name H ))
ASSI { 2743}
(( segid " " and resid 358 and name H ))
(( segid " " and resid 358 and name HA ))
2.500 0.800 0.800 peak 2743 spectrum 1 weight 0.10000E+01 volume 0.40449E-02 ppm1 8.558 ppm2 4.018 CV 1
OR { 2743}
(( segid " " and resid 358 and name H ))
(( segid " " and resid 355 and name HA ))
ASSI { 589}
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( segid " " and resid 310 and name HD1%)
3.700 1.700 1.700 peak 589 spectrum 1 weight 0.10000E+01 volume 0.16922E-02 ppm1 8.320 ppm2 1.084 CV 1
OR { 589}
(( segid " " and resid 315 and name H ))
( segid " " and resid 307 and name HD2%)
ASSI { 178}
(( segid " " and resid 328 and name H ))
(( segid " " and resid 329 and name HB ))
4.500 2.500 1.500 peak 178 spectrum 1 weight 0.10000E+01 volume 0.75659E-03 ppm1 7.197 ppm2 1.755 CV 1
OR { 178}
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(( segid " " and resid 325 and name HB2 ))
OR { 178}
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(( segid " " and resid 357 and name HB3 ))
OR { 178}
(( segid " " and resid 328 and name H ))
(( segid " " and resid 342 and name HB ))
OR { 178}
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(( segid " " and resid 299 and name HB3 ))
OR { 178}
(( segid " " and resid 328 and name H ))
( segid " " and resid 337 and name HE% )
ASSI { 808}
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(( segid " " and resid 335 and name HB ))
4.100 2.100 1.900 peak 808 spectrum 1 weight 0.10000E+01 volume 0.13341E-02 ppm1 7.112 ppm2 4.202 CV 1
OR { 808}
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(( segid " " and resid 227 and name HA ))
OR { 808}
(( segid " " and resid 230 and name H ))
(( segid " " and resid 332 and name HA ))
OR { 808}
(( segid " " and resid 230 and name H ))
(( segid " " and resid 335 and name HA ))
ASSI { 719}
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(( segid " " and resid 367 and name HB2 ))
6.000 5.100 0.000 peak 719 spectrum 1 weight 0.10000E+01 volume 0.42162E-03 ppm1 7.002 ppm2 1.033 CV 1
OR { 719}
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( segid " " and resid 307 and name HD2%)
ASSI { 899}
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(( segid " " and resid 435 and name HB ))
2.700 0.900 0.900 peak 899 spectrum 1 weight 0.10000E+01 volume 0.15151E-02 ppm1 8.926 ppm2 2.006 CV 1
OR { 899}
(( segid " " and resid 436 and name H ))
(( segid " " and resid 436 and name HB3 ))
ASSI { 2914}
(( segid " " and resid 358 and name H ))
(( segid " " and resid 358 and name HB2 ))
2.400 0.700 0.700 peak 2914 spectrum 1 weight 0.10000E+01 volume 0.32901E-02 ppm1 8.561 ppm2 3.290 CV 1
OR { 2914}
(( segid " " and resid 321 and name H ))
(( segid " " and resid 320 and name HB3 ))
ASSI { 633}
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(( segid " " and resid 220 and name HB ))
4.100 2.100 1.900 peak 633 spectrum 1 weight 0.10000E+01 volume 0.10415E-02 ppm1 7.251 ppm2 2.260 CV 1
OR { 633}
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(( segid " " and resid 375 and name HG2 ))
OR { 633}
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(( segid " " and resid 256 and name HG2 ))
ASSI { 297}
(( segid " " and resid 284 and name H ))
(( segid " " and resid 285 and name HB3 ))
4.900 3.000 1.100 peak 297 spectrum 1 weight 0.10000E+01 volume 0.74312E-03 ppm1 8.116 ppm2 1.770 CV 1
OR { 297}
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(( segid " " and resid 352 and name HG12))
ASSI { 634}
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( segid " " and resid 280 and name HG2%)
3.400 1.500 1.500 peak 634 spectrum 1 weight 0.10000E+01 volume 0.75274E-03 ppm1 8.322 ppm2 1.122 CV 1
OR { 634}
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ASSI { 1857}
(( segid " " and resid 425 and name H ))
(( segid " " and resid 426 and name H ))
2.700 0.900 0.900 peak 1857 spectrum 1 weight 0.10000E+01 volume 0.16133E-02 ppm1 7.761 ppm2 8.005 CV 1
OR { 1857}
(( segid " " and resid 425 and name H ))
(( segid " " and resid 427 and name H ))
ASSI { 1356}
(( segid " " and resid 329 and name H ))
( segid " " and resid 328 and name HG2%)
3.900 1.900 1.900 peak 1356 spectrum 1 weight 0.10000E+01 volume 0.16980E-02 ppm1 7.953 ppm2 0.763 CV 1
OR { 1356}
(( segid " " and resid 329 and name H ))
( segid " " and resid 328 and name HG1%)
OR { 1356}
(( segid " " and resid 329 and name H ))
( segid " " and resid 329 and name HG2%)
ASSI { 2930}
(( segid " " and resid 317 and name H ))
( segid " " and resid 209 and name HD1%)
3.500 1.500 1.500 peak 2930 spectrum 1 weight 0.10000E+01 volume 0.24931E-02 ppm1 7.529 ppm2 0.187 CV 1
OR { 2930}
(( segid " " and resid 317 and name H ))
( segid " " and resid 317 and name HD1%)
ASSI { 1888}
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(( segid " " and resid 194 and name HA ))
3.300 1.400 1.400 peak 1888 spectrum 1 weight 0.10000E+01 volume 0.92793E-03 ppm1 9.118 ppm2 3.802 CV 1
OR { 1888}
(( segid " " and resid 194 and name H ))
(( segid " " and resid 193 and name HD2 ))
ASSI { 799}
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( segid " " and resid 398 and name HG2%)
4.300 2.300 1.700 peak 799 spectrum 1 weight 0.10000E+01 volume 0.15055E-02 ppm1 8.689 ppm2 0.816 CV 1
OR { 799}
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( segid " " and resid 439 and name HD1%)
OR { 799}
(( segid " " and resid 398 and name H ))
( segid " " and resid 443 and name HD1%)
ASSI { 240}
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4.200 2.300 1.800 peak 240 spectrum 1 weight 0.10000E+01 volume 0.95871E-03 ppm1 7.066 ppm2 3.133 CV 1
OR { 240}
(( segid " " and resid 310 and name H ))
(( segid " " and resid 315 and name HB2 ))
ASSI { 1394}
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(( segid " " and resid 267 and name HA ))
2.900 1.000 1.000 peak 1394 spectrum 1 weight 0.10000E+01 volume 0.19790E-02 ppm1 8.067 ppm2 3.988 CV 1
OR { 1394}
(( segid " " and resid 267 and name H ))
(( segid " " and resid 266 and name HA ))
ASSI { 174}
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(( segid " " and resid 443 and name HB3 ))
2.300 2.300 3.700 peak 174 spectrum 1 weight 0.10000E+01 volume 0.22698E-02 ppm1 7.643 ppm2 1.653 CV 1
OR { 174}
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(( segid " " and resid 443 and name HB2 ))
OR { 174}
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(( segid " " and resid 443 and name HG ))
OR { 174}
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OR { 174}
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(( segid " " and resid 442 and name HG2 ))
OR { 174}
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(( segid " " and resid 398 and name HG13))
ASSI { 37}
(( segid " " and resid 361 and name H ))
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4.400 2.400 1.600 peak 37 spectrum 1 weight 0.10000E+01 volume 0.36962E-03 ppm1 8.405 ppm2 3.323 CV 1
OR { 37}
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(( segid " " and resid 322 and name HA ))
OR { 37}
(( segid " " and resid 361 and name H ))
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ASSI { 379}
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(( segid " " and resid 365 and name H ))
3.700 1.700 1.700 peak 379 spectrum 1 weight 0.10000E+01 volume 0.63337E-03 ppm1 6.881 ppm2 8.347 CV 1
OR { 379}
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(( segid " " and resid 366 and name H ))
ASSI { 773}
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(( segid " " and resid 423 and name HA ))
3.800 1.800 1.800 peak 773 spectrum 1 weight 0.10000E+01 volume 0.10088E-02 ppm1 8.205 ppm2 4.008 CV 1
OR { 773}
(( segid " " and resid 422 and name H ))
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ASSI { 104}
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(( segid " " and resid 227 and name HB3 ))
4.200 2.200 1.800 peak 104 spectrum 1 weight 0.10000E+01 volume 0.97605E-03 ppm1 7.111 ppm2 2.829 CV 1
OR { 104}
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OR { 104}
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ASSI { 756}
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( segid " " and resid 364 and name HG1%)
4.200 2.200 1.800 peak 756 spectrum 1 weight 0.10000E+01 volume 0.10376E-02 ppm1 8.924 ppm2 1.061 CV 1
OR { 756}
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OR { 756}
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ASSI { 415}
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3.000 1.100 1.100 peak 415 spectrum 1 weight 0.10000E+01 volume 0.67959E-02 ppm1 7.396 ppm2 4.313 CV 1
OR { 415}
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ASSI { 627}
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(( segid " " and resid 282 and name HB2 ))
3.300 1.400 1.400 peak 627 spectrum 1 weight 0.10000E+01 volume 0.10511E-02 ppm1 7.314 ppm2 1.876 CV 1
OR { 627}
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(( segid " " and resid 283 and name HB3 ))
OR { 627}
(( segid " " and resid 283 and name H ))
(( segid " " and resid 309 and name HB2 ))
OR { 627}
(( segid " " and resid 283 and name H ))
(( segid " " and resid 309 and name HB3 ))
ASSI { 584}
(( segid " " and resid 307 and name H ))
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4.000 2.000 2.000 peak 584 spectrum 1 weight 0.10000E+01 volume 0.10242E-02 ppm1 8.735 ppm2 2.176 CV 1
OR { 584}
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(( segid " " and resid 309 and name HG3 ))
ASSI { 729}
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3.100 1.200 1.200 peak 729 spectrum 1 weight 0.10000E+01 volume 0.84131E-03 ppm1 8.919 ppm2 4.141 CV 1
OR { 729}
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(( segid " " and resid 354 and name HA ))
ASSI { 59}
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5.100 3.200 0.900 peak 59 spectrum 1 weight 0.10000E+01 volume 0.10993E-02 ppm1 8.416 ppm2 7.141 CV 1
OR { 59}
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ASSI { 605}
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(( segid " " and resid 218 and name HB2 ))
4.100 2.100 1.900 peak 605 spectrum 1 weight 0.10000E+01 volume 0.82396E-03 ppm1 6.675 ppm2 2.704 CV 1
OR { 605}
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(( segid " " and resid 222 and name HE3 ))
ASSI { 2398}
(( segid " " and resid 425 and name H ))
(( segid " " and resid 425 and name HA ))
2.900 1.000 1.000 peak 2398 spectrum 1 weight 0.10000E+01 volume 0.19675E-02 ppm1 7.759 ppm2 4.005 CV 1
OR { 2398}
(( segid " " and resid 425 and name H ))
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ASSI { 786}
(( segid " " and resid 310 and name H ))
(( segid " " and resid 315 and name H ))
5.800 4.200 0.200 peak 786 spectrum 1 weight 0.10000E+01 volume 0.30032E-03 ppm1 7.071 ppm2 8.312 CV 1
OR { 786}
(( segid " " and resid 310 and name H ))
(( segid " " and resid 314 and name HD22))
ASSI { 260}
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(( segid " " and resid 209 and name HG ))
4.100 2.100 1.900 peak 260 spectrum 1 weight 0.10000E+01 volume 0.14612E-02 ppm1 7.833 ppm2 0.742 CV 1
OR { 260}
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OR { 260}
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(( segid " " and resid 208 and name HG3 ))
OR { 260}
(( segid " " and resid 209 and name H ))
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ASSI { 255}
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5.100 3.300 0.900 peak 255 spectrum 1 weight 0.10000E+01 volume 0.39271E-03 ppm1 8.139 ppm2 3.304 CV 1
OR { 255}
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(( segid " " and resid 359 and name HA ))
ASSI { 1217}
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(( segid " " and resid 319 and name HB2 ))
4.400 2.400 1.600 peak 1217 spectrum 1 weight 0.10000E+01 volume 0.75081E-03 ppm1 10.126 ppm2 3.310 CV 1
OR { 1217}
(( segid " " and resid 320 and name HE1 ))
(( segid " " and resid 320 and name HB3 ))
ASSI { 31}
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4.700 2.800 1.300 peak 31 spectrum 1 weight 0.10000E+01 volume 0.66803E-03 ppm1 8.991 ppm2 2.082 CV 1
OR { 31}
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(( segid " " and resid 198 and name HB ))
OR { 31}
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ASSI { 651}
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(( segid " " and resid 242 and name HG2 ))
4.500 2.500 1.500 peak 651 spectrum 1 weight 0.10000E+01 volume 0.58909E-03 ppm1 7.451 ppm2 2.224 CV 1
OR { 651}
(( segid " " and resid 246 and name H ))
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OR { 651}
(( segid " " and resid 246 and name H ))
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OR { 651}
(( segid " " and resid 246 and name H ))
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ASSI { 72}
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( segid " " and resid 263 and name HG2%)
4.400 2.400 1.600 peak 72 spectrum 1 weight 0.10000E+01 volume 0.38309E-03 ppm1 9.051 ppm2 0.817 CV 1
OR { 72}
(( segid " " and resid 224 and name H ))
( segid " " and resid 328 and name HG2%)
OR { 72}
(( segid " " and resid 224 and name H ))
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OR { 72}
(( segid " " and resid 224 and name H ))
( segid " " and resid 328 and name HG1%)
ASSI { 391}
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(( segid " " and resid 223 and name H ))
5.000 3.100 1.000 peak 391 spectrum 1 weight 0.10000E+01 volume 0.33113E-03 ppm1 8.745 ppm2 8.445 CV 1
OR { 391}
(( segid " " and resid 221 and name H ))
(( segid " " and resid 375 and name H ))
ASSI { 64}
(( segid " " and resid 351 and name H ))
(( segid " " and resid 351 and name HG3 ))
2.900 1.000 1.000 peak 64 spectrum 1 weight 0.10000E+01 volume 0.43527E-02 ppm1 7.886 ppm2 2.111 CV 1
OR { 64}
(( segid " " and resid 351 and name H ))
(( segid " " and resid 351 and name HB3 ))
OR { 64}
(( segid " " and resid 251 and name H ))
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ASSI { 261}
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3.100 3.100 2.900 peak 261 spectrum 1 weight 0.10000E+01 volume 0.42931E-03 ppm1 6.741 ppm2 3.077 CV 1
OR { 261}
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(( segid " " and resid 414 and name HD3 ))
ASSI { 2589}
(( segid " " and resid 312 and name H ))
(( segid " " and resid 312 and name HB2 ))
2.700 0.900 0.900 peak 2589 spectrum 1 weight 0.10000E+01 volume 0.45857E-02 ppm1 8.788 ppm2 2.110 CV 1
OR { 2589}
(( segid " " and resid 312 and name H ))
(( segid " " and resid 311 and name HB2 ))
OR { 2589}
(( segid " " and resid 312 and name H ))
(( segid " " and resid 312 and name HG3 ))
ASSI { 1825}
(( segid " " and resid 202 and name H ))
(( segid " " and resid 202 and name HA ))
3.000 1.100 1.100 peak 1825 spectrum 1 weight 0.10000E+01 volume 0.20811E-02 ppm1 8.209 ppm2 4.448 CV 1
OR { 1825}
(( segid " " and resid 202 and name H ))
(( segid " " and resid 201 and name HB ))
OR { 1825}
(( segid " " and resid 202 and name H ))
(( segid " " and resid 201 and name HG1 ))
ASSI { 390}
(( segid " " and resid 331 and name H ))
( segid " " and resid 328 and name HG1%)
4.200 2.200 1.800 peak 390 spectrum 1 weight 0.10000E+01 volume 0.83165E-03 ppm1 7.179 ppm2 0.767 CV 1
OR { 390}
(( segid " " and resid 331 and name H ))
( segid " " and resid 329 and name HG2%)
ASSI { 597}
(( segid " " and resid 242 and name H ))
(( segid " " and resid 243 and name HA ))
4.500 2.600 1.500 peak 597 spectrum 1 weight 0.10000E+01 volume 0.73156E-03 ppm1 7.552 ppm2 3.855 CV 1
OR { 597}
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(( segid " " and resid 365 and name HA ))
OR { 597}
(( segid " " and resid 364 and name H ))
(( segid " " and resid 369 and name HA2 ))
ASSI { 576}
(( segid " " and resid 359 and name H ))
( segid " " and resid 356 and name HG2%)
4.300 2.300 1.700 peak 576 spectrum 1 weight 0.10000E+01 volume 0.64684E-03 ppm1 7.196 ppm2 0.398 CV 1
OR { 576}
(( segid " " and resid 359 and name H ))
( segid " " and resid 322 and name HG2%)
OR { 576}
(( segid " " and resid 328 and name H ))
( segid " " and resid 322 and name HG2%)
OR { 576}
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( segid " " and resid 318 and name HD1%)
OR { 576}
(( segid " " and resid 359 and name H ))
( segid " " and resid 323 and name HG2%)
ASSI { 80}
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( segid " " and resid 345 and name HG2%)
3.200 3.200 2.800 peak 80 spectrum 1 weight 0.10000E+01 volume 0.33690E-03 ppm1 7.001 ppm2 0.940 CV 1
OR { 80}
(( segid " " and resid 341 and name HD21))
( segid " " and resid 230 and name HG2%)
OR { 80}
(( segid " " and resid 341 and name HD21))
( segid " " and resid 344 and name HG2%)
OR { 80}
(( segid " " and resid 341 and name HD21))
( segid " " and resid 233 and name HG2%)
ASSI { 637}
(( segid " " and resid 443 and name H ))
( segid " " and resid 398 and name HG2%)
3.200 1.200 1.200 peak 637 spectrum 1 weight 0.10000E+01 volume 0.49996E-02 ppm1 7.650 ppm2 0.821 CV 1
OR { 637}
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( segid " " and resid 443 and name HD2%)
OR { 637}
(( segid " " and resid 443 and name H ))
( segid " " and resid 443 and name HD1%)
ASSI { 694}
(( segid " " and resid 315 and name H ))
( segid " " and resid 318 and name HG2%)
4.900 3.000 1.100 peak 694 spectrum 1 weight 0.10000E+01 volume 0.45818E-03 ppm1 8.322 ppm2 0.371 CV 1
OR { 694}
(( segid " " and resid 315 and name H ))
( segid " " and resid 317 and name HD2%)
OR { 694}
(( segid " " and resid 315 and name H ))
( segid " " and resid 318 and name HD1%)
ASSI { 1481}
(( segid " " and resid 399 and name H ))
(( segid " " and resid 399 and name HA ))
2.800 1.000 1.000 peak 1481 spectrum 1 weight 0.10000E+01 volume 0.22197E-02 ppm1 8.325 ppm2 3.799 CV 1
OR { 1481}
(( segid " " and resid 315 and name H ))
(( segid " " and resid 315 and name HA ))
ASSI { 232}
(( segid " " and resid 214 and name H ))
(( segid " " and resid 214 and name HB2 ))
3.000 1.200 1.200 peak 232 spectrum 1 weight 0.10000E+01 volume 0.78162E-03 ppm1 7.188 ppm2 1.676 CV 1
OR { 232}
(( segid " " and resid 214 and name H ))
(( segid " " and resid 217 and name HB ))
OR { 232}
(( segid " " and resid 214 and name H ))
( segid " " and resid 211 and name HB% )
ASSI { 157}
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(( segid " " and resid 406 and name HA ))
3.400 1.400 1.400 peak 157 spectrum 1 weight 0.10000E+01 volume 0.14535E-02 ppm1 7.794 ppm2 4.071 CV 1
OR { 157}
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(( segid " " and resid 403 and name HA ))
ASSI { 1922}
(( segid " " and resid 425 and name H ))
( segid " " and resid 423 and name HD1%)
4.200 2.200 1.800 peak 1922 spectrum 1 weight 0.10000E+01 volume 0.15690E-02 ppm1 7.760 ppm2 0.858 CV 1
OR { 1922}
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( segid " " and resid 416 and name HD1%)
OR { 1922}
(( segid " " and resid 425 and name H ))
( segid " " and resid 423 and name HD2%)
ASSI { 367}
(( segid " " and resid 297 and name H ))
(( segid " " and resid 293 and name HB2 ))
5.300 3.500 0.700 peak 367 spectrum 1 weight 0.10000E+01 volume 0.58331E-03 ppm1 8.071 ppm2 1.738 CV 1
OR { 367}
(( segid " " and resid 297 and name H ))
(( segid " " and resid 293 and name HB3 ))
OR { 367}
(( segid " " and resid 297 and name H ))
(( segid " " and resid 299 and name HB3 ))
OR { 367}
(( segid " " and resid 297 and name H ))
(( segid " " and resid 300 and name HB ))
ASSI { 937}
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(( segid " " and resid 309 and name HB2 ))
3.900 1.900 1.900 peak 937 spectrum 1 weight 0.10000E+01 volume 0.58524E-03 ppm1 7.069 ppm2 1.868 CV 1
OR { 937}
(( segid " " and resid 310 and name H ))
(( segid " " and resid 309 and name HB3 ))
OR { 937}
(( segid " " and resid 310 and name H ))
(( segid " " and resid 308 and name HB2 ))
ASSI { 248}
(( segid " " and resid 299 and name H ))
(( segid " " and resid 293 and name HG2 ))
3.500 1.500 1.500 peak 248 spectrum 1 weight 0.10000E+01 volume 0.39871E-02 ppm1 7.503 ppm2 1.530 CV 1
OR { 248}
(( segid " " and resid 299 and name H ))
( segid " " and resid 290 and name HB% )
ASSI { 742}
(( segid " " and resid 261 and name HD21))
(( segid " " and resid 260 and name HD3 ))
3.800 1.800 1.800 peak 742 spectrum 1 weight 0.10000E+01 volume 0.34460E-03 ppm1 7.531 ppm2 3.850 CV 1
OR { 742}
(( segid " " and resid 261 and name HD21))
(( segid " " and resid 233 and name HA ))
OR { 742}
(( segid " " and resid 261 and name HD21))
(( segid " " and resid 230 and name HA ))
OR { 742}
(( segid " " and resid 261 and name HD21))
(( segid " " and resid 264 and name HA ))
OR { 742}
(( segid " " and resid 261 and name HD21))
(( segid " " and resid 216 and name HA ))
ASSI { 1332}
(( segid " " and resid 200 and name H ))
(( segid " " and resid 199 and name HA ))
3.700 1.700 1.700 peak 1332 spectrum 1 weight 0.10000E+01 volume 0.64299E-03 ppm1 7.612 ppm2 3.839 CV 1
OR { 1332}
(( segid " " and resid 200 and name H ))
(( segid " " and resid 197 and name HA ))
ASSI { 68}
(( segid " " and resid 319 and name H ))
( segid " " and resid 321 and name HD2%)
4.800 2.900 1.200 peak 68 spectrum 1 weight 0.10000E+01 volume 0.66034E-03 ppm1 7.858 ppm2 0.674 CV 1
OR { 68}
(( segid " " and resid 319 and name H ))
( segid " " and resid 278 and name HD1%)
OR { 68}
(( segid " " and resid 319 and name H ))
( segid " " and resid 350 and name HG1%)
OR { 68}
(( segid " " and resid 319 and name H ))
( segid " " and resid 271 and name HD2%)
OR { 68}
(( segid " " and resid 319 and name H ))
( segid " " and resid 372 and name HG1%)
ASSI { 1077}
(( segid " " and resid 230 and name H ))
(( segid " " and resid 231 and name H ))
4.700 2.700 1.300 peak 1077 spectrum 1 weight 0.10000E+01 volume 0.59293E-03 ppm1 7.108 ppm2 8.457 CV 1
OR { 1077}
(( segid " " and resid 230 and name H ))
(( segid " " and resid 228 and name H ))
ASSI { 1461}
(( segid " " and resid 361 and name H ))
(( segid " " and resid 361 and name HA ))
2.800 1.000 1.000 peak 1461 spectrum 1 weight 0.10000E+01 volume 0.20079E-02 ppm1 8.405 ppm2 4.240 CV 1
OR { 1461}
(( segid " " and resid 361 and name H ))
(( segid " " and resid 360 and name HA ))
ASSI { 917}
(( segid " " and resid 304 and name H ))
(( segid " " and resid 302 and name H ))
3.600 1.600 1.600 peak 917 spectrum 1 weight 0.10000E+01 volume 0.99146E-03 ppm1 8.676 ppm2 8.006 CV 1
OR { 917}
(( segid " " and resid 304 and name H ))
(( segid " " and resid 306 and name H ))
OR { 917}
(( segid " " and resid 304 and name H ))
(( segid " " and resid 301 and name H ))
ASSI { 341}
(( segid " " and resid 214 and name H ))
( segid " " and resid 217 and name HG2%)
5.900 4.300 0.100 peak 341 spectrum 1 weight 0.10000E+01 volume 0.23872E-03 ppm1 7.186 ppm2 0.451 CV 1
OR { 341}
(( segid " " and resid 214 and name H ))
(( segid " " and resid 217 and name HG12))
OR { 341}
(( segid " " and resid 214 and name H ))
(( segid " " and resid 217 and name HG13))
OR { 341}
(( segid " " and resid 214 and name H ))
(( segid " " and resid 317 and name HG ))
ASSI { 332}
(( segid " " and resid 235 and name H ))
( segid " " and resid 262 and name HG2%)
4.600 2.600 1.400 peak 332 spectrum 1 weight 0.10000E+01 volume 0.61990E-03 ppm1 7.891 ppm2 1.045 CV 1
OR { 332}
(( segid " " and resid 235 and name H ))
( segid " " and resid 240 and name HG1%)
ASSI { 3057}
(( segid " " and resid 353 and name H ))
(( segid " " and resid 352 and name HA ))
2.300 0.700 0.700 peak 3057 spectrum 1 weight 0.10000E+01 volume 0.43298E-02 ppm1 8.950 ppm2 4.169 CV 1
OR { 3057}
(( segid " " and resid 353 and name H ))
(( segid " " and resid 353 and name HA ))
ASSI { 664}
(( segid " " and resid 345 and name H ))
(( segid " " and resid 231 and name HB2 ))
5.600 3.900 0.400 peak 664 spectrum 1 weight 0.10000E+01 volume 0.27337E-03 ppm1 6.995 ppm2 2.800 CV 1
OR { 664}
(( segid " " and resid 345 and name H ))
(( segid " " and resid 341 and name HB3 ))
OR { 664}
(( segid " " and resid 345 and name H ))
(( segid " " and resid 231 and name HB3 ))
ASSI { 337}
(( segid " " and resid 327 and name H ))
( segid " " and resid 328 and name HG2%)
3.800 1.800 1.800 peak 337 spectrum 1 weight 0.10000E+01 volume 0.21023E-02 ppm1 7.617 ppm2 0.774 CV 1
OR { 337}
(( segid " " and resid 327 and name H ))
( segid " " and resid 323 and name HG1%)
OR { 337}
(( segid " " and resid 327 and name H ))
( segid " " and resid 328 and name HG1%)
OR { 337}
(( segid " " and resid 327 and name H ))
( segid " " and resid 329 and name HG2%)
ASSI { 181}
(( segid " " and resid 341 and name HD21))
( segid " " and resid 344 and name HD1%)
3.300 3.300 2.700 peak 181 spectrum 1 weight 0.10000E+01 volume 0.28300E-03 ppm1 6.995 ppm2 0.854 CV 1
OR { 181}
(( segid " " and resid 341 and name HD21))
( segid " " and resid 344 and name HG2%)
OR { 181}
(( segid " " and resid 341 and name HD21))
( segid " " and resid 233 and name HG1%)
OR { 181}
(( segid " " and resid 341 and name HD21))
( segid " " and resid 333 and name HD1%)
ASSI { 690}
(( segid " " and resid 349 and name H ))
( segid " " and resid 357 and name HD2%)
3.900 1.900 1.900 peak 690 spectrum 1 weight 0.10000E+01 volume 0.98952E-03 ppm1 7.103 ppm2 0.917 CV 1
OR { 690}
(( segid " " and resid 308 and name H ))
( segid " " and resid 283 and name HD2%)
OR { 690}
(( segid " " and resid 349 and name H ))
( segid " " and resid 321 and name HD1%)
OR { 690}
(( segid " " and resid 349 and name H ))
( segid " " and resid 352 and name HG2%)
ASSI { 1815}
(( segid " " and resid 241 and name H ))
(( segid " " and resid 242 and name H ))
2.400 0.700 0.700 peak 1815 spectrum 1 weight 0.10000E+01 volume 0.40139E-02 ppm1 8.372 ppm2 7.556 CV 1
OR { 1815}
(( segid " " and resid 365 and name H ))
(( segid " " and resid 364 and name H ))
ASSI { 2481}
(( segid " " and resid 428 and name H ))
(( segid " " and resid 425 and name HA ))
3.200 1.300 1.300 peak 2481 spectrum 1 weight 0.10000E+01 volume 0.14727E-02 ppm1 7.734 ppm2 3.986 CV 1
OR { 2481}
(( segid " " and resid 428 and name H ))
(( segid " " and resid 427 and name HA ))
ASSI { 404}
(( segid " " and resid 307 and name H ))
(( segid " " and resid 305 and name HB2 ))
4.600 2.600 1.400 peak 404 spectrum 1 weight 0.10000E+01 volume 0.78931E-03 ppm1 8.737 ppm2 1.853 CV 1
OR { 404}
(( segid " " and resid 307 and name H ))
(( segid " " and resid 304 and name HB3 ))
OR { 404}
(( segid " " and resid 307 and name H ))
(( segid " " and resid 308 and name HB3 ))
OR { 404}
(( segid " " and resid 307 and name H ))
(( segid " " and resid 309 and name HB2 ))
OR { 404}
(( segid " " and resid 307 and name H ))
(( segid " " and resid 305 and name HB3 ))
OR { 404}
(( segid " " and resid 307 and name H ))
(( segid " " and resid 308 and name HB2 ))
ASSI { 149}
(( segid " " and resid 327 and name H ))
( segid " " and resid 373 and name HD2%)
4.300 2.300 1.700 peak 149 spectrum 1 weight 0.10000E+01 volume 0.92983E-03 ppm1 7.618 ppm2 0.473 CV 1
OR { 149}
(( segid " " and resid 327 and name H ))
( segid " " and resid 342 and name HG2%)
OR { 149}
(( segid " " and resid 327 and name H ))
( segid " " and resid 217 and name HG2%)
OR { 149}
(( segid " " and resid 327 and name H ))
(( segid " " and resid 373 and name HB2 ))
ASSI { 211}
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(( segid " " and resid 311 and name HD2 ))
3.700 1.700 1.700 peak 211 spectrum 1 weight 0.10000E+01 volume 0.10126E-02 ppm1 7.343 ppm2 4.062 CV 1
OR { 211}
(( segid " " and resid 314 and name H ))
(( segid " " and resid 312 and name HA ))
ASSI { 385}
(( segid " " and resid 422 and name H ))
(( segid " " and resid 425 and name HB3 ))
4.800 2.800 1.200 peak 385 spectrum 1 weight 0.10000E+01 volume 0.59487E-03 ppm1 8.210 ppm2 1.850 CV 1
OR { 385}
(( segid " " and resid 422 and name H ))
(( segid " " and resid 426 and name HB2 ))
OR { 385}
(( segid " " and resid 422 and name H ))
(( segid " " and resid 426 and name HB3 ))
ASSI { 549}
(( segid " " and resid 267 and name H ))
(( segid " " and resid 270 and name H ))
4.400 2.400 1.600 peak 549 spectrum 1 weight 0.10000E+01 volume 0.34653E-03 ppm1 8.074 ppm2 8.532 CV 1
OR { 549}
(( segid " " and resid 267 and name H ))
(( segid " " and resid 264 and name H ))
ASSI { 137}
(( segid " " and resid 238 and name H ))
(( segid " " and resid 240 and name HB ))
4.800 2.900 1.200 peak 137 spectrum 1 weight 0.10000E+01 volume 0.44087E-03 ppm1 8.666 ppm2 2.187 CV 1
OR { 137}
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(( segid " " and resid 242 and name HB3 ))
OR { 137}
(( segid " " and resid 238 and name H ))
(( segid " " and resid 242 and name HB2 ))
ASSI { 2732}
(( segid " " and resid 288 and name H ))
(( segid " " and resid 289 and name H ))
2.500 0.800 0.800 peak 2732 spectrum 1 weight 0.10000E+01 volume 0.32824E-02 ppm1 7.475 ppm2 8.002 CV 1
OR { 2732}
(( segid " " and resid 288 and name H ))
(( segid " " and resid 287 and name H ))
ASSI { 866}
(( segid " " and resid 381 and name H ))
(( segid " " and resid 381 and name HD2 ))
4.900 3.000 1.100 peak 866 spectrum 1 weight 0.10000E+01 volume 0.42162E-03 ppm1 8.199 ppm2 3.136 CV 1
OR { 866}
(( segid " " and resid 381 and name H ))
(( segid " " and resid 382 and name HB2 ))
ASSI { 1440}
(( segid " " and resid 393 and name H ))
(( segid " " and resid 392 and name HA ))
2.300 0.700 0.700 peak 1440 spectrum 1 weight 0.10000E+01 volume 0.60605E-02 ppm1 8.269 ppm2 4.302 CV 1
OR { 1440}
(( segid " " and resid 393 and name H ))
(( segid " " and resid 393 and name HA ))
ASSI { 2434}
(( segid " " and resid 445 and name H ))
(( segid " " and resid 445 and name HB3 ))
2.000 0.500 0.500 peak 2434 spectrum 1 weight 0.10000E+01 volume 0.10556E-01 ppm1 7.906 ppm2 1.883 CV 1
OR { 2434}
(( segid " " and resid 445 and name H ))
(( segid " " and resid 444 and name HB2 ))
ASSI { 986}
(( segid " " and resid 226 and name H ))
(( segid " " and resid 224 and name HA3 ))
5.000 3.200 1.000 peak 986 spectrum 1 weight 0.10000E+01 volume 0.29455E-03 ppm1 7.432 ppm2 3.603 CV 1
OR { 986}
(( segid " " and resid 226 and name H ))
(( segid " " and resid 335 and name HG1 ))
ASSI { 763}
(( segid " " and resid 360 and name H ))
( segid " " and resid 357 and name HD1%)
4.800 2.900 1.200 peak 763 spectrum 1 weight 0.10000E+01 volume 0.94334E-03 ppm1 7.281 ppm2 0.694 CV 1
OR { 763}
(( segid " " and resid 360 and name H ))
( segid " " and resid 339 and name HG2%)
OR { 763}
(( segid " " and resid 360 and name H ))
( segid " " and resid 346 and name HD2%)
ASSI { 536}
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4.000 2.000 2.000 peak 536 spectrum 1 weight 0.10000E+01 volume 0.69112E-03 ppm1 8.687 ppm2 1.359 CV 1
OR { 536}
(( segid " " and resid 398 and name H ))
(( segid " " and resid 399 and name HG2 ))
ASSI { 616}
(( segid " " and resid 292 and name H ))
(( segid " " and resid 291 and name HA ))
3.300 1.300 1.300 peak 616 spectrum 1 weight 0.10000E+01 volume 0.17018E-02 ppm1 7.809 ppm2 3.934 CV 1
OR { 616}
(( segid " " and resid 292 and name H ))
(( segid " " and resid 289 and name HA ))
ASSI { 1378}
(( segid " " and resid 191 and name H ))
(( segid " " and resid 273 and name HB2 ))
5.300 3.500 0.700 peak 1378 spectrum 1 weight 0.10000E+01 volume 0.25412E-03 ppm1 9.245 ppm2 2.590 CV 1
OR { 1378}
(( segid " " and resid 191 and name H ))
(( segid " " and resid 190 and name HB2 ))
ASSI { 916}
(( segid " " and resid 222 and name H ))
(( segid " " and resid 225 and name HG3 ))
5.200 3.300 0.800 peak 916 spectrum 1 weight 0.10000E+01 volume 0.77968E-03 ppm1 7.249 ppm2 2.701 CV 1
OR { 916}
(( segid " " and resid 222 and name H ))
(( segid " " and resid 222 and name HE2 ))
OR { 916}
(( segid " " and resid 222 and name H ))
(( segid " " and resid 222 and name HE3 ))
ASSI { 1678}
(( segid " " and resid 219 and name H ))
(( segid " " and resid 219 and name HA ))
3.000 1.100 1.100 peak 1678 spectrum 1 weight 0.10000E+01 volume 0.19560E-02 ppm1 7.701 ppm2 4.120 CV 1
OR { 1678}
(( segid " " and resid 219 and name H ))
(( segid " " and resid 218 and name HA ))
ASSI { 653}
(( segid " " and resid 225 and name H ))
(( segid " " and resid 226 and name HB2 ))
4.900 3.000 1.100 peak 653 spectrum 1 weight 0.10000E+01 volume 0.69306E-03 ppm1 7.795 ppm2 1.532 CV 1
OR { 653}
(( segid " " and resid 225 and name H ))
(( segid " " and resid 331 and name HG2 ))
ASSI { 1714}
(( segid " " and resid 290 and name H ))
(( segid " " and resid 289 and name HA ))
3.200 1.300 1.300 peak 1714 spectrum 1 weight 0.10000E+01 volume 0.29878E-02 ppm1 7.820 ppm2 3.902 CV 1
OR { 1714}
(( segid " " and resid 290 and name H ))
(( segid " " and resid 288 and name HA ))
ASSI { 362}
(( segid " " and resid 253 and name H ))
( segid " " and resid 246 and name HB% )
4.800 2.900 1.200 peak 362 spectrum 1 weight 0.10000E+01 volume 0.45434E-03 ppm1 8.259 ppm2 1.170 CV 1
OR { 362}
(( segid " " and resid 253 and name H ))
(( segid " " and resid 243 and name HB3 ))
ASSI { 2167}
(( segid " " and resid 330 and name H ))
( segid " " and resid 329 and name HD1%)
5.100 3.200 0.900 peak 2167 spectrum 1 weight 0.10000E+01 volume 0.65262E-03 ppm1 8.619 ppm2 0.127 CV 1
OR { 2167}
(( segid " " and resid 255 and name H ))
( segid " " and resid 243 and name HD2%)
ASSI { 2473}
(( segid " " and resid 398 and name H ))
(( segid " " and resid 397 and name HA2 ))
3.200 1.300 1.300 peak 2473 spectrum 1 weight 0.10000E+01 volume 0.12899E-02 ppm1 8.686 ppm2 3.776 CV 1
OR { 2473}
(( segid " " and resid 398 and name H ))
(( segid " " and resid 397 and name HA3 ))
OR { 2473}
(( segid " " and resid 398 and name H ))
(( segid " " and resid 395 and name HA ))
ASSI { 807}
(( segid " " and resid 313 and name H ))
( segid " " and resid 209 and name HD1%)
5.700 4.100 0.300 peak 807 spectrum 1 weight 0.10000E+01 volume 0.22909E-03 ppm1 8.628 ppm2 0.198 CV 1
OR { 807}
(( segid " " and resid 313 and name H ))
( segid " " and resid 317 and name HD1%)
OR { 807}
(( segid " " and resid 313 and name H ))
( segid " " and resid 279 and name HD1%)
ASSI { 722}
(( segid " " and resid 229 and name H ))
(( segid " " and resid 337 and name HB3 ))
5.100 3.200 0.900 peak 722 spectrum 1 weight 0.10000E+01 volume 0.45050E-03 ppm1 9.618 ppm2 1.485 CV 1
OR { 722}
(( segid " " and resid 229 and name H ))
(( segid " " and resid 232 and name HB2 ))
OR { 722}
(( segid " " and resid 229 and name H ))
(( segid " " and resid 232 and name HG2 ))
OR { 722}
(( segid " " and resid 229 and name H ))
(( segid " " and resid 232 and name HG3 ))
ASSI { 409}
(( segid " " and resid 245 and name H ))
( segid " " and resid 246 and name HB% )
4.000 2.000 2.000 peak 409 spectrum 1 weight 0.10000E+01 volume 0.19251E-02 ppm1 7.533 ppm2 1.192 CV 1
OR { 409}
(( segid " " and resid 245 and name H ))
(( segid " " and resid 243 and name HB3 ))
ASSI { 780}
(( segid " " and resid 230 and name H ))
(( segid " " and resid 337 and name HG3 ))
4.300 2.300 1.700 peak 780 spectrum 1 weight 0.10000E+01 volume 0.79703E-03 ppm1 7.108 ppm2 1.991 CV 1
OR { 780}
(( segid " " and resid 230 and name H ))
(( segid " " and resid 232 and name HB3 ))
OR { 780}
(( segid " " and resid 230 and name H ))
(( segid " " and resid 228 and name HB3 ))
OR { 780}
(( segid " " and resid 230 and name H ))
(( segid " " and resid 228 and name HG3 ))
ASSI { 585}
(( segid " " and resid 277 and name HD22))
(( segid " " and resid 352 and name HG12))
6.000 4.700 0.000 peak 585 spectrum 1 weight 0.10000E+01 volume 0.29840E-03 ppm1 6.128 ppm2 1.751 CV 1
OR { 585}
(( segid " " and resid 277 and name HD22))
(( segid " " and resid 272 and name HG2 ))
OR { 585}
(( segid " " and resid 277 and name HD22))
(( segid " " and resid 281 and name HB2 ))
OR { 585}
(( segid " " and resid 277 and name HD22))
(( segid " " and resid 278 and name HG ))
ASSI { 34}
(( segid " " and resid 327 and name H ))
(( segid " " and resid 323 and name HA ))
4.200 2.200 1.800 peak 34 spectrum 1 weight 0.10000E+01 volume 0.81818E-03 ppm1 7.607 ppm2 3.280 CV 1
OR { 34}
(( segid " " and resid 327 and name H ))
(( segid " " and resid 324 and name HB3 ))
ASSI { 393}
(( segid " " and resid 292 and name H ))
(( segid " " and resid 293 and name HG3 ))
4.100 2.100 1.900 peak 393 spectrum 1 weight 0.10000E+01 volume 0.11936E-02 ppm1 7.810 ppm2 2.021 CV 1
OR { 393}
(( segid " " and resid 292 and name H ))
(( segid " " and resid 289 and name HB3 ))
OR { 393}
(( segid " " and resid 292 and name H ))
(( segid " " and resid 298 and name HB3 ))
OR { 393}
(( segid " " and resid 292 and name H ))
(( segid " " and resid 302 and name HG3 ))
ASSI { 781}
(( segid " " and resid 407 and name H ))
(( segid " " and resid 411 and name HB2 ))
5.100 3.300 0.900 peak 781 spectrum 1 weight 0.10000E+01 volume 0.71809E-03 ppm1 7.790 ppm2 2.841 CV 1
OR { 781}
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4.600 2.700 1.400 peak 925 spectrum 1 weight 0.10000E+01 volume 0.21177E-03 ppm1 8.511 ppm2 8.235 CV 1
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(( segid " " and resid 210 and name HD2 ))
ASSI { 764}
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3.900 1.900 1.900 peak 764 spectrum 1 weight 0.10000E+01 volume 0.67187E-03 ppm1 8.205 ppm2 4.420 CV 1
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ASSI { 717}
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5.100 3.200 0.900 peak 717 spectrum 1 weight 0.10000E+01 volume 0.38503E-03 ppm1 6.860 ppm2 0.785 CV 1
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OR { 717}
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5.300 3.600 0.700 peak 414 spectrum 1 weight 0.10000E+01 volume 0.24642E-03 ppm1 7.931 ppm2 1.353 CV 1
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ASSI { 384}
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4.400 2.400 1.600 peak 384 spectrum 1 weight 0.10000E+01 volume 0.24257E-03 ppm1 8.372 ppm2 6.643 CV 1
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ASSI { 186}
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4.800 2.900 1.200 peak 186 spectrum 1 weight 0.10000E+01 volume 0.39659E-03 ppm1 8.092 ppm2 1.253 CV 1
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3.000 1.100 1.100 peak 752 spectrum 1 weight 0.10000E+01 volume 0.14631E-02 ppm1 8.416 ppm2 3.325 CV 1
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ASSI { 769}
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5.000 3.100 1.000 peak 769 spectrum 1 weight 0.10000E+01 volume 0.51015E-03 ppm1 6.995 ppm2 1.492 CV 1
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OR { 769}
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3.400 1.400 1.400 peak 16 spectrum 1 weight 0.10000E+01 volume 0.12379E-02 ppm1 7.065 ppm2 3.996 CV 1
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ASSI { 439}
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3.100 1.200 1.200 peak 439 spectrum 1 weight 0.10000E+01 volume 0.17038E-02 ppm1 8.437 ppm2 3.812 CV 1
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ASSI { 60}
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4.800 2.900 1.200 peak 60 spectrum 1 weight 0.10000E+01 volume 0.77199E-03 ppm1 7.735 ppm2 0.661 CV 1
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ASSI { 87}
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5.700 4.100 0.300 peak 87 spectrum 1 weight 0.10000E+01 volume 0.25412E-03 ppm1 8.613 ppm2 6.440 CV 1
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ASSI { 1793}
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3.100 1.200 1.200 peak 1793 spectrum 1 weight 0.10000E+01 volume 0.17750E-02 ppm1 6.995 ppm2 3.911 CV 1
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ASSI { 829}
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(( segid " " and resid 299 and name H ))
3.900 1.900 1.900 peak 829 spectrum 1 weight 0.10000E+01 volume 0.66609E-03 ppm1 8.072 ppm2 7.510 CV 1
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ASSI { 67}
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3.900 1.900 1.900 peak 67 spectrum 1 weight 0.10000E+01 volume 0.88555E-03 ppm1 7.103 ppm2 3.690 CV 1
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OR { 67}
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ASSI { 708}
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5.000 3.200 1.000 peak 708 spectrum 1 weight 0.10000E+01 volume 0.35230E-03 ppm1 7.466 ppm2 2.885 CV 1
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ASSI { 699}
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3.000 1.100 1.100 peak 699 spectrum 1 weight 0.10000E+01 volume 0.24815E-02 ppm1 8.128 ppm2 1.607 CV 1
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(( segid " " and resid 333 and name HG ))
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ASSI { 11}
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4.400 2.400 1.600 peak 11 spectrum 1 weight 0.10000E+01 volume 0.91252E-03 ppm1 8.880 ppm2 1.738 CV 1
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OR { 11}
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ASSI { 308}
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6.000 4.800 0.000 peak 308 spectrum 1 weight 0.10000E+01 volume 0.21562E-03 ppm1 7.673 ppm2 0.373 CV 1
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( segid " " and resid 318 and name HD1%)
ASSI { 844}
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4.600 2.700 1.400 peak 844 spectrum 1 weight 0.10000E+01 volume 0.76621E-03 ppm1 7.980 ppm2 0.944 CV 1
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ASSI { 888}
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5.000 3.200 1.000 peak 888 spectrum 1 weight 0.10000E+01 volume 0.48321E-03 ppm1 8.053 ppm2 2.914 CV 1
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OR { 888}
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ASSI { 165}
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4.600 2.600 1.400 peak 165 spectrum 1 weight 0.10000E+01 volume 0.74118E-03 ppm1 7.446 ppm2 1.524 CV 1
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OR { 165}
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ASSI { 903}
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4.800 2.900 1.200 peak 903 spectrum 1 weight 0.10000E+01 volume 0.33113E-03 ppm1 8.202 ppm2 3.217 CV 1
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ASSI { 135}
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5.100 3.300 0.900 peak 135 spectrum 1 weight 0.10000E+01 volume 0.53902E-03 ppm1 7.530 ppm2 7.065 CV 1
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ASSI { 683}
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4.800 2.900 1.200 peak 683 spectrum 1 weight 0.10000E+01 volume 0.54290E-03 ppm1 8.689 ppm2 1.815 CV 1
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ASSI { 2850}
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3.100 1.200 1.200 peak 2850 spectrum 1 weight 0.10000E+01 volume 0.22197E-02 ppm1 6.980 ppm2 0.824 CV 1
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ASSI { 827}
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(( segid " " and resid 222 and name HE3 ))
3.800 1.800 1.800 peak 827 spectrum 1 weight 0.10000E+01 volume 0.71809E-03 ppm1 7.513 ppm2 2.715 CV 1
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ASSI { 161}
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3.100 1.200 1.200 peak 161 spectrum 1 weight 0.10000E+01 volume 0.99337E-03 ppm1 8.367 ppm2 3.052 CV 1
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ASSI { 658}
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4.900 3.000 1.100 peak 658 spectrum 1 weight 0.10000E+01 volume 0.66418E-03 ppm1 8.714 ppm2 0.195 CV 1
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ASSI { 2058}
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(( segid " " and resid 342 and name H ))
3.000 1.100 1.100 peak 2058 spectrum 1 weight 0.10000E+01 volume 0.12032E-02 ppm1 8.201 ppm2 8.652 CV 1
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ASSI { 91}
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5.100 3.200 0.900 peak 91 spectrum 1 weight 0.10000E+01 volume 0.55637E-03 ppm1 6.834 ppm2 0.765 CV 1
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ASSI { 265}
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4.500 2.500 1.500 peak 265 spectrum 1 weight 0.10000E+01 volume 0.30032E-03 ppm1 7.671 ppm2 7.135 CV 1
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ASSI { 601}
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4.200 2.200 1.800 peak 601 spectrum 1 weight 0.10000E+01 volume 0.17557E-02 ppm1 8.576 ppm2 0.693 CV 1
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ASSI { 436}
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6.000 6.000 0.000 peak 436 spectrum 1 weight 0.10000E+01 volume 0.23102E-03 ppm1 6.138 ppm2 0.380 CV 1
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ASSI { 342}
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4.100 2.100 1.900 peak 342 spectrum 1 weight 0.10000E+01 volume 0.18289E-02 ppm1 7.757 ppm2 0.860 CV 1
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ASSI { 857}
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3.200 1.300 1.300 peak 857 spectrum 1 weight 0.10000E+01 volume 0.16056E-02 ppm1 7.569 ppm2 3.818 CV 1
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OR { 857}
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ASSI { 118}
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3.500 1.500 1.500 peak 118 spectrum 1 weight 0.10000E+01 volume 0.94140E-03 ppm1 8.566 ppm2 3.862 CV 1
OR { 118}
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OR { 118}
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(( segid " " and resid 420 and name HB ))
2.900 2.900 3.100 peak 952 spectrum 1 weight 0.10000E+01 volume 0.61990E-03 ppm1 6.743 ppm2 1.772 CV 1
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(( segid " " and resid 429 and name HB3 ))
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ASSI { 113}
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(( segid " " and resid 398 and name HB ))
3.800 1.800 1.800 peak 113 spectrum 1 weight 0.10000E+01 volume 0.74502E-03 ppm1 7.774 ppm2 1.805 CV 1
OR { 113}
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OR { 113}
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ASSI { 1834}
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3.300 1.400 1.400 peak 1834 spectrum 1 weight 0.10000E+01 volume 0.52365E-03 ppm1 8.267 ppm2 4.441 CV 1
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ASSI { 277}
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4.700 2.700 1.300 peak 277 spectrum 1 weight 0.10000E+01 volume 0.93562E-03 ppm1 7.856 ppm2 0.991 CV 1
OR { 277}
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OR { 277}
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ASSI { 572}
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5.100 3.200 0.900 peak 572 spectrum 1 weight 0.10000E+01 volume 0.67187E-03 ppm1 8.081 ppm2 2.306 CV 1
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OR { 572}
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OR { 572}
(( segid " " and resid 397 and name H ))
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ASSI { 655}
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4.900 3.000 1.100 peak 655 spectrum 1 weight 0.10000E+01 volume 0.38503E-03 ppm1 7.705 ppm2 3.931 CV 1
OR { 655}
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OR { 655}
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(( segid " " and resid 343 and name HB3 ))
OR { 655}
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ASSI { 706}
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3.600 1.700 1.700 peak 706 spectrum 1 weight 0.10000E+01 volume 0.17403E-02 ppm1 7.266 ppm2 7.101 CV 1
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OR { 706}
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3.700 1.700 1.700 peak 2056 spectrum 1 weight 0.10000E+01 volume 0.17557E-02 ppm1 7.027 ppm2 3.662 CV 1
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ASSI { 2983}
(( segid " " and resid 205 and name H ))
(( segid " " and resid 205 and name HB2 ))
2.800 1.000 1.000 peak 2983 spectrum 1 weight 0.10000E+01 volume 0.15940E-02 ppm1 6.381 ppm2 2.744 CV 1
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(( segid " " and resid 205 and name H ))
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ASSI { 173}
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3.300 1.400 1.400 peak 173 spectrum 1 weight 0.10000E+01 volume 0.30302E-02 ppm1 8.165 ppm2 0.709 CV 1
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ASSI { 586}
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3.600 1.600 1.600 peak 586 spectrum 1 weight 0.10000E+01 volume 0.11050E-02 ppm1 8.631 ppm2 4.456 CV 1
OR { 586}
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ASSI { 645}
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( segid " " and resid 328 and name HG1%)
4.800 2.900 1.200 peak 645 spectrum 1 weight 0.10000E+01 volume 0.38887E-03 ppm1 7.798 ppm2 0.778 CV 1
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OR { 645}
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ASSI { 78}
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2.500 2.500 3.500 peak 78 spectrum 1 weight 0.10000E+01 volume 0.16479E-02 ppm1 7.526 ppm2 0.887 CV 1
OR { 78}
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( segid " " and resid 233 and name HG2%)
OR { 78}
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OR { 78}
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ASSI { 1161}
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3.300 1.400 1.400 peak 1161 spectrum 1 weight 0.10000E+01 volume 0.20926E-02 ppm1 7.130 ppm2 1.250 CV 1
OR { 1161}
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(( segid " " and resid 298 and name H ))
2.700 0.900 0.900 peak 1541 spectrum 1 weight 0.10000E+01 volume 0.20618E-02 ppm1 8.075 ppm2 7.348 CV 1
OR { 1541}
(( segid " " and resid 297 and name H ))
(( segid " " and resid 295 and name H ))
ASSI { 301}
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5.200 3.400 0.800 peak 301 spectrum 1 weight 0.10000E+01 volume 0.36962E-03 ppm1 7.111 ppm2 3.540 CV 1
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(( segid " " and resid 231 and name HA ))
ASSI { 1502}
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(( segid " " and resid 445 and name HA ))
2.200 0.600 0.600 peak 1502 spectrum 1 weight 0.10000E+01 volume 0.12754E-01 ppm1 7.906 ppm2 4.240 CV 1
OR { 1502}
(( segid " " and resid 445 and name H ))
(( segid " " and resid 444 and name HA ))
ASSI { 673}
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4.300 2.300 1.700 peak 673 spectrum 1 weight 0.10000E+01 volume 0.53328E-03 ppm1 7.962 ppm2 4.019 CV 1
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(( segid " " and resid 387 and name HB ))
OR { 673}
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OR { 673}
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ASSI { 2767}
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2.700 0.900 0.900 peak 2767 spectrum 1 weight 0.10000E+01 volume 0.22486E-02 ppm1 7.491 ppm2 1.839 CV 1
OR { 2767}
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OR { 2767}
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ASSI { 32}
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3.500 1.500 1.500 peak 32 spectrum 1 weight 0.10000E+01 volume 0.42913E-02 ppm1 7.921 ppm2 0.750 CV 1
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ASSI { 890}
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4.600 2.700 1.400 peak 890 spectrum 1 weight 0.10000E+01 volume 0.62759E-03 ppm1 10.125 ppm2 1.346 CV 1
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ASSI { 737}
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5.100 3.200 0.900 peak 737 spectrum 1 weight 0.10000E+01 volume 0.25219E-03 ppm1 8.694 ppm2 8.296 CV 1
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ASSI { 413}
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4.300 2.300 1.700 peak 413 spectrum 1 weight 0.10000E+01 volume 0.63337E-03 ppm1 7.787 ppm2 1.064 CV 1
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3.900 1.900 1.900 peak 810 spectrum 1 weight 0.10000E+01 volume 0.55059E-03 ppm1 8.050 ppm2 3.854 CV 1
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OR { 810}
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ASSI { 2001}
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2.900 1.000 1.000 peak 2001 spectrum 1 weight 0.10000E+01 volume 0.12360E-02 ppm1 7.729 ppm2 8.070 CV 1
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ASSI { 2297}
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2.800 1.000 1.000 peak 2297 spectrum 1 weight 0.10000E+01 volume 0.15863E-02 ppm1 8.630 ppm2 7.182 CV 1
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ASSI { 259}
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3.600 1.600 1.600 peak 259 spectrum 1 weight 0.10000E+01 volume 0.17788E-02 ppm1 7.362 ppm2 3.967 CV 1
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ASSI { 1257}
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2.400 0.700 0.700 peak 1257 spectrum 1 weight 0.10000E+01 volume 0.49418E-02 ppm1 8.334 ppm2 1.853 CV 1
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OR { 1257}
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ASSI { 912}
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5.700 4.100 0.300 peak 912 spectrum 1 weight 0.10000E+01 volume 0.55443E-03 ppm1 8.495 ppm2 2.387 CV 1
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OR { 912}
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ASSI { 894}
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5.600 3.900 0.400 peak 894 spectrum 1 weight 0.10000E+01 volume 0.52365E-03 ppm1 8.078 ppm2 0.827 CV 1
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( segid " " and resid 439 and name HD2%)
OR { 894}
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2.100 0.500 0.500 peak 1177 spectrum 1 weight 0.10000E+01 volume 0.18173E-02 ppm1 7.494 ppm2 4.341 CV 1
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ASSI { 335}
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3.400 1.400 1.400 peak 335 spectrum 1 weight 0.10000E+01 volume 0.13226E-02 ppm1 8.558 ppm2 1.521 CV 1
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ASSI { 880}
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5.500 3.800 0.500 peak 880 spectrum 1 weight 0.10000E+01 volume 0.36000E-03 ppm1 6.867 ppm2 7.154 CV 1
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ASSI { 299}
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4.000 2.000 2.000 peak 299 spectrum 1 weight 0.10000E+01 volume 0.75274E-03 ppm1 7.531 ppm2 2.222 CV 1
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OR { 299}
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ASSI { 933}
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3.800 1.800 1.800 peak 933 spectrum 1 weight 0.10000E+01 volume 0.62759E-03 ppm1 8.259 ppm2 1.757 CV 1
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OR { 933}
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ASSI { 430}
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5.600 3.900 0.400 peak 430 spectrum 1 weight 0.10000E+01 volume 0.34268E-03 ppm1 7.417 ppm2 2.819 CV 1
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OR { 430}
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ASSI { 2284}
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5.600 4.000 0.400 peak 2284 spectrum 1 weight 0.10000E+01 volume 0.64684E-03 ppm1 8.730 ppm2 6.820 CV 1
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ASSI { 540}
(( segid " " and resid 307 and name H ))
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4.100 2.100 1.900 peak 540 spectrum 1 weight 0.10000E+01 volume 0.12206E-02 ppm1 8.733 ppm2 2.302 CV 1
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OR { 540}
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OR { 540}
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OR { 540}
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ASSI { 940}
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5.500 3.700 0.500 peak 940 spectrum 1 weight 0.10000E+01 volume 0.28107E-03 ppm1 6.871 ppm2 8.504 CV 1
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ASSI { 389}
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3.400 1.400 1.400 peak 389 spectrum 1 weight 0.10000E+01 volume 0.31900E-02 ppm1 7.996 ppm2 1.400 CV 1
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ASSI { 63}
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( segid " " and resid 443 and name HD1%)
2.500 2.500 3.500 peak 63 spectrum 1 weight 0.10000E+01 volume 0.14188E-02 ppm1 7.906 ppm2 0.826 CV 1
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OR { 63}
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ASSI { 51}
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3.700 1.700 1.700 peak 51 spectrum 1 weight 0.10000E+01 volume 0.25951E-02 ppm1 8.443 ppm2 1.603 CV 1
OR { 51}
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OR { 51}
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ASSI { 1562}
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3.700 1.700 1.700 peak 1562 spectrum 1 weight 0.10000E+01 volume 0.16768E-02 ppm1 8.460 ppm2 7.097 CV 1
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ASSI { 307}
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3.800 1.800 1.800 peak 307 spectrum 1 weight 0.10000E+01 volume 0.21311E-02 ppm1 7.179 ppm2 1.856 CV 1
OR { 307}
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( segid " " and resid 225 and name HE% )
ASSI { 571}
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3.200 3.200 2.800 peak 571 spectrum 1 weight 0.10000E+01 volume 0.34075E-03 ppm1 7.334 ppm2 0.825 CV 1
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ASSI { 746}
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3.800 1.800 1.800 peak 746 spectrum 1 weight 0.10000E+01 volume 0.80471E-03 ppm1 8.931 ppm2 7.120 CV 1
OR { 746}
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OR { 746}
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ASSI { 183}
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5.800 4.200 0.200 peak 183 spectrum 1 weight 0.10000E+01 volume 0.40043E-03 ppm1 10.124 ppm2 1.780 CV 1
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ASSI { 150}
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3.700 1.700 1.700 peak 150 spectrum 1 weight 0.10000E+01 volume 0.89134E-03 ppm1 7.533 ppm2 2.557 CV 1
OR { 150}
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ASSI { 753}
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4.100 2.100 1.900 peak 753 spectrum 1 weight 0.10000E+01 volume 0.44087E-03 ppm1 8.422 ppm2 4.149 CV 1
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ASSI { 983}
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4.500 2.500 1.500 peak 983 spectrum 1 weight 0.10000E+01 volume 0.58909E-03 ppm1 7.320 ppm2 1.734 CV 1
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OR { 983}
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ASSI { 840}
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5.100 3.300 0.900 peak 840 spectrum 1 weight 0.10000E+01 volume 0.55637E-03 ppm1 7.758 ppm2 1.846 CV 1
OR { 840}
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OR { 840}
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ASSI { 108}
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5.300 3.600 0.700 peak 108 spectrum 1 weight 0.10000E+01 volume 0.34075E-03 ppm1 8.788 ppm2 1.601 CV 1
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OR { 108}
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OR { 108}
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ASSI { 106}
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4.600 2.600 1.400 peak 106 spectrum 1 weight 0.10000E+01 volume 0.38118E-03 ppm1 9.076 ppm2 1.421 CV 1
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ASSI { 1233}
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3.900 1.900 1.900 peak 1233 spectrum 1 weight 0.10000E+01 volume 0.38309E-03 ppm1 8.886 ppm2 3.575 CV 1
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ASSI { 1144}
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2.900 1.000 1.000 peak 1144 spectrum 1 weight 0.10000E+01 volume 0.14708E-02 ppm1 7.178 ppm2 8.634 CV 1
OR { 1144}
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ASSI { 1247}
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2.700 0.900 0.900 peak 1247 spectrum 1 weight 0.10000E+01 volume 0.37695E-02 ppm1 8.133 ppm2 4.412 CV 1
OR { 1247}
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ASSI { 7}
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4.900 3.000 1.100 peak 7 spectrum 1 weight 0.10000E+01 volume 0.73540E-03 ppm1 8.676 ppm2 1.028 CV 1
OR { 7}
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ASSI { 1148}
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2.200 0.600 0.600 peak 1148 spectrum 1 weight 0.10000E+01 volume 0.41700E-02 ppm1 9.177 ppm2 4.010 CV 1
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ASSI { 433}
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5.000 3.100 1.000 peak 433 spectrum 1 weight 0.10000E+01 volume 0.56215E-03 ppm1 8.625 ppm2 3.106 CV 1
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ASSI { 1784}
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(( segid " " and resid 424 and name H ))
3.200 1.300 1.300 peak 1784 spectrum 1 weight 0.10000E+01 volume 0.10800E-02 ppm1 8.689 ppm2 8.268 CV 1
OR { 1784}
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ASSI { 2241}
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4.800 2.900 1.200 peak 2241 spectrum 1 weight 0.10000E+01 volume 0.58524E-03 ppm1 7.532 ppm2 2.960 CV 1
OR { 2241}
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(( segid " " and resid 245 and name H ))
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3.000 1.100 1.100 peak 863 spectrum 1 weight 0.10000E+01 volume 0.88365E-03 ppm1 8.689 ppm2 4.458 CV 1
OR { 863}
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ASSI { 626}
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2.600 0.900 0.900 peak 626 spectrum 1 weight 0.10000E+01 volume 0.61183E-02 ppm1 7.772 ppm2 2.086 CV 1
OR { 626}
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OR { 626}
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ASSI { 758}
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2.600 0.800 0.800 peak 758 spectrum 1 weight 0.10000E+01 volume 0.53423E-02 ppm1 7.758 ppm2 4.137 CV 1
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ASSI { 442}
(( segid " " and resid 368 and name H ))
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4.200 2.200 1.800 peak 442 spectrum 1 weight 0.10000E+01 volume 0.69884E-03 ppm1 8.215 ppm2 8.375 CV 1
OR { 442}
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(( segid " " and resid 365 and name H ))
OR { 442}
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ASSI { 94}
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2.100 0.500 0.500 peak 94 spectrum 1 weight 0.10000E+01 volume 0.44778E-02 ppm1 7.098 ppm2 1.554 CV 1
OR { 94}
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(( segid " " and resid 308 and name HD2 ))
OR { 94}
(( segid " " and resid 308 and name H ))
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OR { 94}
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(( segid " " and resid 308 and name HD3 ))
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2.900 1.100 1.100 peak 49 spectrum 1 weight 0.10000E+01 volume 0.22447E-02 ppm1 7.587 ppm2 3.869 CV 1
OR { 49}
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OR { 49}
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2.900 1.000 1.000 peak 154 spectrum 1 weight 0.10000E+01 volume 0.42987E-02 ppm1 7.985 ppm2 4.090 CV 1
OR { 154}
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(( segid " " and resid 290 and name HA ))
OR { 154}
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(( segid " " and resid 290 and name HA ))
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ASSI { 759}
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2.600 0.900 0.900 peak 759 spectrum 1 weight 0.10000E+01 volume 0.37061E-02 ppm1 8.625 ppm2 2.110 CV 1
OR { 759}
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(( segid " " and resid 312 and name HB2 ))
OR { 759}
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ASSI { 451}
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3.400 1.500 1.500 peak 451 spectrum 1 weight 0.10000E+01 volume 0.79124E-03 ppm1 8.540 ppm2 3.988 CV 1
OR { 451}
(( segid " " and resid 270 and name H ))
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ASSI { 975}
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4.200 2.200 1.800 peak 975 spectrum 1 weight 0.10000E+01 volume 0.39850E-03 ppm1 8.570 ppm2 3.107 CV 1
OR { 975}
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ASSI { 561}
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(( segid " " and resid 268 and name HG3 ))
4.200 2.300 1.800 peak 561 spectrum 1 weight 0.10000E+01 volume 0.84705E-03 ppm1 8.067 ppm2 1.292 CV 1
OR { 561}
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OR { 561}
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( segid " " and resid 349 and name HG2%)
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3.500 1.500 1.500 peak 566 spectrum 1 weight 0.10000E+01 volume 0.16306E-02 ppm1 7.482 ppm2 0.382 CV 1
OR { 566}
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ASSI { 783}
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5.100 3.300 0.900 peak 783 spectrum 1 weight 0.10000E+01 volume 0.41968E-03 ppm1 8.125 ppm2 2.877 CV 1
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OR { 783}
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3.700 1.700 1.700 peak 525 spectrum 1 weight 0.10000E+01 volume 0.19040E-02 ppm1 8.774 ppm2 0.856 CV 1
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3.800 1.800 1.800 peak 700 spectrum 1 weight 0.10000E+01 volume 0.10126E-02 ppm1 6.128 ppm2 2.139 CV 1
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3.700 1.700 1.700 peak 511 spectrum 1 weight 0.10000E+01 volume 0.10877E-02 ppm1 7.937 ppm2 3.983 CV 1
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2.400 0.700 0.700 peak 1137 spectrum 1 weight 0.10000E+01 volume 0.27376E-02 ppm1 7.777 ppm2 0.427 CV 1
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4.700 2.800 1.300 peak 595 spectrum 1 weight 0.10000E+01 volume 0.61606E-03 ppm1 8.560 ppm2 3.981 CV 1
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4.600 2.600 1.400 peak 512 spectrum 1 weight 0.10000E+01 volume 0.54868E-03 ppm1 7.795 ppm2 3.902 CV 1
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ASSI { 1705}
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4.000 2.000 2.000 peak 1705 spectrum 1 weight 0.10000E+01 volume 0.31765E-03 ppm1 9.242 ppm2 2.471 CV 1
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ASSI { 3092}
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3.200 1.300 1.300 peak 3092 spectrum 1 weight 0.10000E+01 volume 0.38908E-02 ppm1 7.499 ppm2 1.669 CV 1
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5.100 3.200 0.900 peak 667 spectrum 1 weight 0.10000E+01 volume 0.39081E-03 ppm1 7.771 ppm2 8.690 CV 1
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ASSI { 1322}
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4.000 2.000 2.000 peak 1322 spectrum 1 weight 0.10000E+01 volume 0.10627E-02 ppm1 8.267 ppm2 1.634 CV 1
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ASSI { 293}
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4.800 2.900 1.200 peak 293 spectrum 1 weight 0.10000E+01 volume 0.40622E-03 ppm1 9.605 ppm2 2.293 CV 1
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3.700 1.700 1.700 peak 755 spectrum 1 weight 0.10000E+01 volume 0.21754E-03 ppm1 9.231 ppm2 3.685 CV 1
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ASSI { 797}
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3.300 1.300 1.300 peak 797 spectrum 1 weight 0.10000E+01 volume 0.66418E-03 ppm1 9.125 ppm2 1.578 CV 1
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ASSI { 160}
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6.000 4.800 0.000 peak 160 spectrum 1 weight 0.10000E+01 volume 0.31573E-03 ppm1 7.675 ppm2 0.622 CV 1
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2.400 0.700 0.700 peak 2715 spectrum 1 weight 0.10000E+01 volume 0.62219E-02 ppm1 8.702 ppm2 4.003 CV 1
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ASSI { 453}
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4.800 2.800 1.200 peak 453 spectrum 1 weight 0.10000E+01 volume 0.12667E-02 ppm1 7.587 ppm2 8.346 CV 1
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ASSI { 58}
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3.600 1.600 1.600 peak 58 spectrum 1 weight 0.10000E+01 volume 0.17692E-02 ppm1 7.492 ppm2 0.923 CV 1
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2.200 0.600 0.600 peak 2122 spectrum 1 weight 0.10000E+01 volume 0.49746E-02 ppm1 7.339 ppm2 3.948 CV 1
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ASSI { 325}
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5.000 3.100 1.000 peak 325 spectrum 1 weight 0.10000E+01 volume 0.59103E-03 ppm1 7.455 ppm2 4.138 CV 1
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ASSI { 573}
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4.900 3.000 1.100 peak 573 spectrum 1 weight 0.10000E+01 volume 0.25604E-03 ppm1 8.529 ppm2 7.801 CV 1
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ASSI { 33}
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6.000 6.000 0.000 peak 33 spectrum 1 weight 0.10000E+01 volume 0.30610E-03 ppm1 6.128 ppm2 0.629 CV 1
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ASSI { 143}
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4.900 3.000 1.100 peak 143 spectrum 1 weight 0.10000E+01 volume 0.49478E-03 ppm1 8.721 ppm2 0.374 CV 1
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OR { 143}
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3.100 1.200 1.200 peak 956 spectrum 1 weight 0.10000E+01 volume 0.60834E-03 ppm1 7.800 ppm2 2.040 CV 1
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4.400 2.400 1.600 peak 1097 spectrum 1 weight 0.10000E+01 volume 0.86246E-03 ppm1 8.445 ppm2 7.128 CV 1
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ASSI { 288}
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2.500 0.800 0.800 peak 288 spectrum 1 weight 0.10000E+01 volume 0.34768E-02 ppm1 8.729 ppm2 1.934 CV 1
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OR { 288}
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ASSI { 17}
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3.700 1.700 1.700 peak 17 spectrum 1 weight 0.10000E+01 volume 0.29070E-03 ppm1 8.616 ppm2 2.611 CV 1
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OR { 17}
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ASSI { 482}
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3.500 1.600 1.600 peak 482 spectrum 1 weight 0.10000E+01 volume 0.68728E-03 ppm1 7.311 ppm2 1.268 CV 1
OR { 482}
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ASSI { 199}
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3.400 1.400 1.400 peak 199 spectrum 1 weight 0.10000E+01 volume 0.37597E-02 ppm1 7.538 ppm2 0.382 CV 1
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ASSI { 969}
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5.400 3.700 0.600 peak 969 spectrum 1 weight 0.10000E+01 volume 0.34075E-03 ppm1 8.909 ppm2 3.633 CV 1
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ASSI { 343}
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4.200 2.200 1.800 peak 343 spectrum 1 weight 0.10000E+01 volume 0.11397E-02 ppm1 8.373 ppm2 1.364 CV 1
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OR { 343}
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4.900 3.000 1.100 peak 568 spectrum 1 weight 0.10000E+01 volume 0.32343E-03 ppm1 8.907 ppm2 8.483 CV 1
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4.100 2.100 1.900 peak 964 spectrum 1 weight 0.10000E+01 volume 0.14208E-02 ppm1 6.994 ppm2 1.718 CV 1
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OR { 964}
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3.700 1.700 1.700 peak 562 spectrum 1 weight 0.10000E+01 volume 0.11897E-02 ppm1 10.075 ppm2 0.727 CV 1
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2.800 1.000 1.000 peak 531 spectrum 1 weight 0.10000E+01 volume 0.30013E-02 ppm1 8.331 ppm2 3.918 CV 1
OR { 531}
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ASSI { 564}
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4.600 2.700 1.400 peak 564 spectrum 1 weight 0.10000E+01 volume 0.71999E-03 ppm1 7.502 ppm2 1.602 CV 1
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ASSI { 715}
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4.300 2.300 1.700 peak 715 spectrum 1 weight 0.10000E+01 volume 0.52171E-03 ppm1 7.832 ppm2 2.722 CV 1
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3.100 1.200 1.200 peak 929 spectrum 1 weight 0.10000E+01 volume 0.16210E-02 ppm1 8.907 ppm2 2.080 CV 1
OR { 929}
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OR { 929}
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ASSI { 257}
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5.700 4.100 0.300 peak 257 spectrum 1 weight 0.10000E+01 volume 0.29455E-03 ppm1 8.788 ppm2 2.780 CV 1
OR { 257}
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3.400 3.400 2.600 peak 39 spectrum 1 weight 0.10000E+01 volume 0.25604E-03 ppm1 7.929 ppm2 2.757 CV 1
OR { 39}
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2.500 0.800 0.800 peak 454 spectrum 1 weight 0.10000E+01 volume 0.71308E-02 ppm1 7.996 ppm2 3.973 CV 1
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3.800 1.800 1.800 peak 554 spectrum 1 weight 0.10000E+01 volume 0.14766E-02 ppm1 8.586 ppm2 0.381 CV 1
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2.800 1.000 1.000 peak 2580 spectrum 1 weight 0.10000E+01 volume 0.17345E-02 ppm1 7.991 ppm2 8.307 CV 1
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(( segid " " and resid 399 and name H ))
ASSI { 578}
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3.000 1.200 1.200 peak 578 spectrum 1 weight 0.10000E+01 volume 0.19502E-02 ppm1 7.796 ppm2 2.830 CV 1
OR { 578}
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ASSI { 375}
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3.800 1.800 1.800 peak 375 spectrum 1 weight 0.10000E+01 volume 0.11339E-02 ppm1 7.790 ppm2 2.283 CV 1
OR { 375}
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2.900 1.000 1.000 peak 2128 spectrum 1 weight 0.10000E+01 volume 0.10742E-02 ppm1 8.925 ppm2 8.504 CV 1
OR { 2128}
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ASSI { 555}
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4.500 2.600 1.500 peak 555 spectrum 1 weight 0.10000E+01 volume 0.91058E-03 ppm1 8.692 ppm2 1.636 CV 1
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2.800 1.000 1.000 peak 77 spectrum 1 weight 0.10000E+01 volume 0.28338E-02 ppm1 6.759 ppm2 4.537 CV 1
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ASSI { 238}
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4.500 2.600 1.500 peak 238 spectrum 1 weight 0.10000E+01 volume 0.47165E-03 ppm1 8.583 ppm2 0.194 CV 1
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3.400 1.400 1.400 peak 976 spectrum 1 weight 0.10000E+01 volume 0.11455E-02 ppm1 7.027 ppm2 4.276 CV 1
OR { 976}
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2.900 1.000 1.000 peak 1067 spectrum 1 weight 0.10000E+01 volume 0.28049E-02 ppm1 8.204 ppm2 0.843 CV 1
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4.100 2.100 1.900 peak 1847 spectrum 1 weight 0.10000E+01 volume 0.66996E-03 ppm1 6.382 ppm2 1.889 CV 1
OR { 1847}
(( segid " " and resid 205 and name H ))
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ASSI { 537}
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4.000 2.000 2.000 peak 537 spectrum 1 weight 0.10000E+01 volume 0.26759E-03 ppm1 8.320 ppm2 2.500 CV 1
OR { 537}
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ASSI { 2895}
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2.400 0.700 0.700 peak 2895 spectrum 1 weight 0.10000E+01 volume 0.34345E-02 ppm1 6.995 ppm2 0.923 CV 1
OR { 2895}
(( segid " " and resid 345 and name H ))
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ASSI { 2678}
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2.400 0.700 0.700 peak 2678 spectrum 1 weight 0.10000E+01 volume 0.41700E-02 ppm1 8.701 ppm2 1.875 CV 1
OR { 2678}
(( segid " " and resid 282 and name H ))
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ASSI { 776}
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4.600 2.600 1.400 peak 776 spectrum 1 weight 0.10000E+01 volume 0.81818E-03 ppm1 8.690 ppm2 1.213 CV 1
OR { 776}
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ASSI { 193}
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3.500 1.500 1.500 peak 193 spectrum 1 weight 0.10000E+01 volume 0.69500E-03 ppm1 8.716 ppm2 4.394 CV 1
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ASSI { 663}
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2.900 2.900 3.100 peak 663 spectrum 1 weight 0.10000E+01 volume 0.21292E-02 ppm1 8.203 ppm2 1.521 CV 1
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ASSI { 897}
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6.000 4.500 0.000 peak 897 spectrum 1 weight 0.10000E+01 volume 0.21947E-03 ppm1 8.925 ppm2 -0.156 CV 1
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ASSI { 2763}
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3.100 1.200 1.200 peak 2763 spectrum 1 weight 0.10000E+01 volume 0.15016E-02 ppm1 8.049 ppm2 3.902 CV 1
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ASSI { 885}
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4.800 2.900 1.200 peak 885 spectrum 1 weight 0.10000E+01 volume 0.94718E-03 ppm1 7.113 ppm2 0.780 CV 1
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ASSI { 825}
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3.500 1.600 1.600 peak 825 spectrum 1 weight 0.10000E+01 volume 0.14188E-02 ppm1 7.319 ppm2 4.005 CV 1
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ASSI { 869}
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4.800 2.900 1.200 peak 869 spectrum 1 weight 0.10000E+01 volume 0.81818E-03 ppm1 8.280 ppm2 1.853 CV 1
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4.200 2.200 1.800 peak 116 spectrum 1 weight 0.10000E+01 volume 0.42737E-03 ppm1 7.280 ppm2 4.018 CV 1
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ASSI { 483}
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4.400 2.500 1.600 peak 483 spectrum 1 weight 0.10000E+01 volume 0.11609E-02 ppm1 7.276 ppm2 0.404 CV 1
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ASSI { 2995}
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2.800 1.000 1.000 peak 2995 spectrum 1 weight 0.10000E+01 volume 0.26683E-02 ppm1 6.995 ppm2 4.021 CV 1
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ASSI { 244}
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4.900 3.000 1.100 peak 244 spectrum 1 weight 0.10000E+01 volume 0.49284E-03 ppm1 7.857 ppm2 2.696 CV 1
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ASSI { 295}
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3.900 1.900 1.900 peak 295 spectrum 1 weight 0.10000E+01 volume 0.18116E-02 ppm1 8.068 ppm2 0.802 CV 1
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ASSI { 848}
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5.100 3.200 0.900 peak 848 spectrum 1 weight 0.10000E+01 volume 0.42162E-03 ppm1 7.711 ppm2 1.969 CV 1
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ASSI { 2257}
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3.100 1.200 1.200 peak 2257 spectrum 1 weight 0.10000E+01 volume 0.17788E-02 ppm1 6.897 ppm2 3.799 CV 1
OR { 2257}
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ASSI { 283}
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5.100 3.200 0.900 peak 283 spectrum 1 weight 0.10000E+01 volume 0.56793E-03 ppm1 8.996 ppm2 4.393 CV 1
OR { 283}
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OR { 283}
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ASSI { 281}
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4.800 2.900 1.200 peak 281 spectrum 1 weight 0.10000E+01 volume 0.48900E-03 ppm1 7.538 ppm2 1.724 CV 1
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ASSI { 66}
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5.500 3.700 0.500 peak 66 spectrum 1 weight 0.10000E+01 volume 0.42737E-03 ppm1 7.564 ppm2 0.793 CV 1
OR { 66}
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( segid " " and resid 189 and name HD1%)
OR { 66}
(( segid " " and resid 185 and name HD22))
( segid " " and resid 186 and name HD1%)
ASSI { 2952}
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(( segid " " and resid 245 and name H ))
3.000 1.100 1.100 peak 2952 spectrum 1 weight 0.10000E+01 volume 0.13187E-02 ppm1 8.557 ppm2 7.526 CV 1
OR { 2952}
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OR { 2952}
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ASSI { 686}
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3.700 1.700 1.700 peak 686 spectrum 1 weight 0.10000E+01 volume 0.41006E-03 ppm1 8.519 ppm2 2.730 CV 1
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ASSI { 2045}
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4.300 2.300 1.700 peak 2045 spectrum 1 weight 0.10000E+01 volume 0.70846E-03 ppm1 8.703 ppm2 8.257 CV 1
OR { 2045}
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ASSI { 636}
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4.700 2.800 1.300 peak 636 spectrum 1 weight 0.10000E+01 volume 0.61412E-03 ppm1 7.091 ppm2 0.369 CV 1
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ASSI { 1260}
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3.700 1.700 1.700 peak 1260 spectrum 1 weight 0.10000E+01 volume 0.92983E-03 ppm1 7.264 ppm2 8.383 CV 1
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ASSI { 450}
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3.400 1.400 1.400 peak 450 spectrum 1 weight 0.10000E+01 volume 0.15594E-02 ppm1 7.440 ppm2 2.015 CV 1
OR { 450}
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OR { 450}
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ASSI { 399}
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4.200 2.200 1.800 peak 399 spectrum 1 weight 0.10000E+01 volume 0.10107E-02 ppm1 8.060 ppm2 1.609 CV 1
OR { 399}
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OR { 399}
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ASSI { 524}
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2.600 0.900 0.900 peak 524 spectrum 1 weight 0.10000E+01 volume 0.66609E-02 ppm1 7.098 ppm2 1.843 CV 1
OR { 524}
(( segid " " and resid 308 and name H ))
(( segid " " and resid 308 and name HB2 ))
OR { 524}
(( segid " " and resid 308 and name H ))
(( segid " " and resid 309 and name HB2 ))
OR { 524}
(( segid " " and resid 308 and name H ))
(( segid " " and resid 305 and name HB2 ))
OR { 524}
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(( segid " " and resid 308 and name H ))
(( segid " " and resid 309 and name HB3 ))
ASSI { 336}
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3.800 1.800 1.800 peak 336 spectrum 1 weight 0.10000E+01 volume 0.10550E-02 ppm1 8.716 ppm2 4.064 CV 1
OR { 336}
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ASSI { 438}
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(( segid " " and resid 426 and name HA ))
4.400 2.400 1.600 peak 438 spectrum 1 weight 0.10000E+01 volume 0.46587E-03 ppm1 10.081 ppm2 3.697 CV 1
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(( segid " " and resid 429 and name HA ))
ASSI { 1859}
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(( segid " " and resid 387 and name H ))
3.400 1.400 1.400 peak 1859 spectrum 1 weight 0.10000E+01 volume 0.98568E-03 ppm1 9.605 ppm2 7.972 CV 1
OR { 1859}
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(( segid " " and resid 386 and name H ))
ASSI { 3148}
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(( segid " " and resid 398 and name H ))
2.900 1.100 1.100 peak 3148 spectrum 1 weight 0.10000E+01 volume 0.14285E-02 ppm1 8.324 ppm2 8.698 CV 1
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(( segid " " and resid 316 and name H ))
ASSI { 870}
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4.200 2.200 1.800 peak 870 spectrum 1 weight 0.10000E+01 volume 0.84321E-03 ppm1 7.564 ppm2 1.718 CV 1
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OR { 870}
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OR { 870}
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(( segid " " and resid 189 and name HG12))
ASSI { 328}
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4.600 2.600 1.400 peak 328 spectrum 1 weight 0.10000E+01 volume 0.47359E-03 ppm1 7.564 ppm2 2.298 CV 1
OR { 328}
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ASSI { 469}
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4.700 2.700 1.300 peak 469 spectrum 1 weight 0.10000E+01 volume 0.35809E-03 ppm1 7.662 ppm2 7.348 CV 1
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(( segid " " and resid 314 and name HD21))
ASSI { 467}
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(( segid " " and resid 293 and name HA ))
4.800 2.800 1.200 peak 467 spectrum 1 weight 0.10000E+01 volume 0.32535E-03 ppm1 7.799 ppm2 4.293 CV 1
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ASSI { 544}
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3.300 1.400 1.400 peak 544 spectrum 1 weight 0.10000E+01 volume 0.25431E-02 ppm1 6.979 ppm2 1.647 CV 1
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4.500 2.600 1.500 peak 441 spectrum 1 weight 0.10000E+01 volume 0.11743E-02 ppm1 7.736 ppm2 1.782 CV 1
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ASSI { 692}
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4.500 2.500 1.500 peak 692 spectrum 1 weight 0.10000E+01 volume 0.67187E-03 ppm1 7.628 ppm2 0.892 CV 1
OR { 692}
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3.000 1.100 1.100 peak 3124 spectrum 1 weight 0.10000E+01 volume 0.15112E-02 ppm1 6.455 ppm2 3.895 CV 1
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ASSI { 707}
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4.300 2.300 1.700 peak 707 spectrum 1 weight 0.10000E+01 volume 0.69500E-03 ppm1 9.623 ppm2 1.806 CV 1
OR { 707}
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OR { 707}
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ASSI { 421}
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3.400 1.500 1.500 peak 421 spectrum 1 weight 0.10000E+01 volume 0.16075E-02 ppm1 8.216 ppm2 4.008 CV 1
OR { 421}
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ASSI { 2593}
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(( segid " " and resid 198 and name H ))
2.600 0.900 0.900 peak 2593 spectrum 1 weight 0.10000E+01 volume 0.44951E-02 ppm1 8.055 ppm2 8.523 CV 1
OR { 2593}
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(( segid " " and resid 185 and name H ))
OR { 2593}
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ASSI { 12}
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5.400 3.700 0.600 peak 12 spectrum 1 weight 0.10000E+01 volume 0.28300E-03 ppm1 7.982 ppm2 1.127 CV 1
OR { 12}
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OR { 12}
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ASSI { 316}
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2.600 0.900 0.900 peak 316 spectrum 1 weight 0.10000E+01 volume 0.92754E-02 ppm1 8.233 ppm2 4.304 CV 1
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ASSI { 580}
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3.900 1.900 1.900 peak 580 spectrum 1 weight 0.10000E+01 volume 0.21831E-02 ppm1 7.994 ppm2 0.699 CV 1
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3.300 1.300 1.300 peak 233 spectrum 1 weight 0.10000E+01 volume 0.16922E-02 ppm1 7.309 ppm2 4.178 CV 1
OR { 233}
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OR { 233}
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ASSI { 618}
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2.800 0.900 0.900 peak 618 spectrum 1 weight 0.10000E+01 volume 0.28049E-02 ppm1 7.704 ppm2 1.836 CV 1
OR { 618}
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OR { 618}
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3.000 1.100 1.100 peak 804 spectrum 1 weight 0.10000E+01 volume 0.17692E-02 ppm1 8.200 ppm2 1.241 CV 1
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ASSI { 302}
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3.600 1.600 1.600 peak 302 spectrum 1 weight 0.10000E+01 volume 0.56600E-03 ppm1 7.545 ppm2 3.147 CV 1
OR { 302}
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OR { 302}
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4.500 2.600 1.500 peak 926 spectrum 1 weight 0.10000E+01 volume 0.70074E-03 ppm1 8.872 ppm2 3.983 CV 1
OR { 926}
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ASSI { 73}
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4.800 2.900 1.200 peak 73 spectrum 1 weight 0.10000E+01 volume 0.33305E-03 ppm1 9.090 ppm2 0.748 CV 1
OR { 73}
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OR { 73}
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ASSI { 14}
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4.800 2.800 1.200 peak 14 spectrum 1 weight 0.10000E+01 volume 0.51209E-03 ppm1 6.898 ppm2 1.891 CV 1
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OR { 14}
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ASSI { 657}
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3.100 3.100 2.900 peak 657 spectrum 1 weight 0.10000E+01 volume 0.41390E-03 ppm1 7.125 ppm2 2.419 CV 1
OR { 657}
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ASSI { 518}
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3.100 1.200 1.200 peak 518 spectrum 1 weight 0.10000E+01 volume 0.19714E-02 ppm1 8.312 ppm2 2.184 CV 1
OR { 518}
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(( segid " " and resid 433 and name HB3 ))
OR { 518}
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ASSI { 279}
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4.000 2.000 2.000 peak 279 spectrum 1 weight 0.10000E+01 volume 0.16171E-02 ppm1 7.266 ppm2 1.071 CV 1
OR { 279}
(( segid " " and resid 363 and name H ))
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ASSI { 23}
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4.100 2.100 1.900 peak 23 spectrum 1 weight 0.10000E+01 volume 0.87593E-03 ppm1 7.922 ppm2 1.953 CV 1
OR { 23}
(( segid " " and resid 300 and name H ))
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OR { 23}
(( segid " " and resid 300 and name H ))
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ASSI { 495}
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2.900 1.000 1.000 peak 495 spectrum 1 weight 0.10000E+01 volume 0.67726E-02 ppm1 7.958 ppm2 3.992 CV 1
OR { 495}
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ASSI { 498}
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ASSI { 978}
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ASSI { 876}
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3.300 1.300 1.300 peak 876 spectrum 1 weight 0.10000E+01 volume 0.28685E-03 ppm1 7.562 ppm2 1.229 CV 1
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4.500 2.500 1.500 peak 791 spectrum 1 weight 0.10000E+01 volume 0.70846E-03 ppm1 7.433 ppm2 4.202 CV 1
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ASSI { 1143}
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2.900 1.100 1.100 peak 1143 spectrum 1 weight 0.10000E+01 volume 0.18385E-02 ppm1 8.882 ppm2 7.313 CV 1
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ASSI { 401}
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3.900 1.900 1.900 peak 401 spectrum 1 weight 0.10000E+01 volume 0.97027E-03 ppm1 8.373 ppm2 7.109 CV 1
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ASSI { 2737}
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3.000 1.100 1.100 peak 2737 spectrum 1 weight 0.10000E+01 volume 0.14670E-02 ppm1 6.912 ppm2 4.335 CV 1
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ASSI { 48}
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3.300 1.300 1.300 peak 48 spectrum 1 weight 0.10000E+01 volume 0.49478E-03 ppm1 6.628 ppm2 1.778 CV 1
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3.100 1.200 1.200 peak 345 spectrum 1 weight 0.10000E+01 volume 0.21793E-02 ppm1 8.478 ppm2 2.140 CV 1
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4.000 2.000 2.000 peak 882 spectrum 1 weight 0.10000E+01 volume 0.69884E-03 ppm1 6.916 ppm2 1.922 CV 1
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ASSI { 410}
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4.100 2.100 1.900 peak 410 spectrum 1 weight 0.10000E+01 volume 0.15536E-02 ppm1 8.045 ppm2 0.654 CV 1
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5.200 3.300 0.800 peak 216 spectrum 1 weight 0.10000E+01 volume 0.43315E-03 ppm1 8.071 ppm2 7.057 CV 1
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ASSI { 425}
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4.800 2.900 1.200 peak 425 spectrum 1 weight 0.10000E+01 volume 0.62374E-03 ppm1 8.607 ppm2 2.291 CV 1
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ASSI { 711}
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4.700 2.700 1.300 peak 711 spectrum 1 weight 0.10000E+01 volume 0.56984E-03 ppm1 9.264 ppm2 1.610 CV 1
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4.200 2.200 1.800 peak 185 spectrum 1 weight 0.10000E+01 volume 0.48515E-03 ppm1 7.671 ppm2 3.987 CV 1
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ASSI { 884}
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5.500 3.800 0.500 peak 884 spectrum 1 weight 0.10000E+01 volume 0.30417E-03 ppm1 9.091 ppm2 0.935 CV 1
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4.300 2.300 1.700 peak 851 spectrum 1 weight 0.10000E+01 volume 0.85668E-03 ppm1 7.796 ppm2 1.244 CV 1
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4.900 3.000 1.100 peak 360 spectrum 1 weight 0.10000E+01 volume 0.59681E-03 ppm1 7.699 ppm2 2.257 CV 1
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OR { 360}
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ASSI { 57}
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4.000 2.000 2.000 peak 57 spectrum 1 weight 0.10000E+01 volume 0.86824E-03 ppm1 8.739 ppm2 4.017 CV 1
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ASSI { 42}
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3.700 1.700 1.700 peak 42 spectrum 1 weight 0.10000E+01 volume 0.12360E-02 ppm1 8.070 ppm2 3.749 CV 1
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ASSI { 906}
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4.800 2.900 1.200 peak 906 spectrum 1 weight 0.10000E+01 volume 0.67959E-03 ppm1 8.074 ppm2 1.540 CV 1
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ASSI { 30}
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4.600 2.700 1.400 peak 30 spectrum 1 weight 0.10000E+01 volume 0.26759E-03 ppm1 8.090 ppm2 8.507 CV 1
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ASSI { 805}
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4.700 2.800 1.300 peak 805 spectrum 1 weight 0.10000E+01 volume 0.49478E-03 ppm1 7.616 ppm2 4.415 CV 1
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OR { 805}
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ASSI { 889}
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4.900 2.900 1.100 peak 889 spectrum 1 weight 0.10000E+01 volume 0.95681E-03 ppm1 8.508 ppm2 0.497 CV 1
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OR { 889}
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ASSI { 2335}
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3.000 1.100 1.100 peak 2335 spectrum 1 weight 0.10000E+01 volume 0.10569E-02 ppm1 9.037 ppm2 1.559 CV 1
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ASSI { 955}
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3.700 1.700 1.700 peak 955 spectrum 1 weight 0.10000E+01 volume 0.71809E-03 ppm1 8.559 ppm2 4.189 CV 1
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ASSI { 274}
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2.200 0.600 0.600 peak 274 spectrum 1 weight 0.10000E+01 volume 0.46203E-02 ppm1 7.053 ppm2 0.736 CV 1
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4.400 2.400 1.600 peak 953 spectrum 1 weight 0.10000E+01 volume 0.47359E-03 ppm1 8.052 ppm2 2.241 CV 1
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ASSI { 56}
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3.400 1.400 1.400 peak 56 spectrum 1 weight 0.10000E+01 volume 0.22216E-02 ppm1 8.337 ppm2 0.806 CV 1
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3.000 1.100 1.100 peak 1278 spectrum 1 weight 0.10000E+01 volume 0.51286E-02 ppm1 7.545 ppm2 4.299 CV 1
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ASSI { 898}
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ASSI { 865}
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4.100 2.100 1.900 peak 865 spectrum 1 weight 0.10000E+01 volume 0.60065E-03 ppm1 7.500 ppm2 1.889 CV 1
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ASSI { 169}
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2.600 0.900 0.900 peak 6 spectrum 1 weight 0.10000E+01 volume 0.33343E-02 ppm1 8.201 ppm2 1.682 CV 1
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2.200 0.600 0.600 peak 1214 spectrum 1 weight 0.10000E+01 volume 0.10292E-01 ppm1 8.063 ppm2 3.861 CV 1
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3.700 1.700 1.700 peak 813 spectrum 1 weight 0.10000E+01 volume 0.15998E-02 ppm1 7.299 ppm2 3.818 CV 1
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ASSI { 305}
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3.000 1.200 1.200 peak 350 spectrum 1 weight 0.10000E+01 volume 0.18096E-02 ppm1 8.367 ppm2 1.810 CV 1
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ASSI { 816}
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3.800 1.800 1.800 peak 816 spectrum 1 weight 0.10000E+01 volume 0.13880E-02 ppm1 8.627 ppm2 0.744 CV 1
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2.700 0.900 0.900 peak 103 spectrum 1 weight 0.10000E+01 volume 0.22909E-02 ppm1 7.790 ppm2 3.297 CV 1
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3.900 1.900 1.900 peak 739 spectrum 1 weight 0.10000E+01 volume 0.75274E-03 ppm1 7.444 ppm2 0.768 CV 1
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3.000 1.100 1.100 peak 3159 spectrum 1 weight 0.10000E+01 volume 0.57562E-03 ppm1 7.950 ppm2 7.186 CV 1
OR { 3159}
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(( segid " " and resid 331 and name H ))
ASSI { 456}
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(( segid " " and resid 433 and name HB3 ))
4.000 2.000 2.000 peak 456 spectrum 1 weight 0.10000E+01 volume 0.66034E-03 ppm1 8.202 ppm2 2.181 CV 1
OR { 456}
(( segid " " and resid 435 and name H ))
(( segid " " and resid 439 and name HB2 ))
ASSI { 374}
(( segid " " and resid 368 and name H ))
( segid " " and resid 367 and name HD2%)
4.400 2.400 1.600 peak 374 spectrum 1 weight 0.10000E+01 volume 0.13591E-02 ppm1 8.213 ppm2 0.816 CV 1
OR { 374}
(( segid " " and resid 437 and name H ))
( segid " " and resid 436 and name HD2%)
OR { 374}
(( segid " " and resid 368 and name H ))
( segid " " and resid 323 and name HG1%)
OR { 374}
(( segid " " and resid 437 and name H ))
( segid " " and resid 402 and name HG2%)
ASSI { 340}
(( segid " " and resid 203 and name H ))
(( segid " " and resid 202 and name HB3 ))
4.600 2.600 1.400 peak 340 spectrum 1 weight 0.10000E+01 volume 0.42547E-03 ppm1 8.269 ppm2 2.274 CV 1
OR { 340}
(( segid " " and resid 203 and name H ))
(( segid " " and resid 202 and name HG2 ))
OR { 340}
(( segid " " and resid 203 and name H ))
( segid " " and resid 203 and name HE% )
ASSI { 2703}
(( segid " " and resid 227 and name H ))
(( segid " " and resid 226 and name HA ))
2.800 1.000 1.000 peak 2703 spectrum 1 weight 0.10000E+01 volume 0.27645E-02 ppm1 7.129 ppm2 4.387 CV 1
OR { 2703}
(( segid " " and resid 227 and name H ))
(( segid " " and resid 225 and name HA ))
ASSI { 419}
(( segid " " and resid 329 and name H ))
(( segid " " and resid 332 and name HG2 ))
3.600 1.600 1.600 peak 419 spectrum 1 weight 0.10000E+01 volume 0.16190E-02 ppm1 7.963 ppm2 2.098 CV 1
OR { 419}
(( segid " " and resid 431 and name H ))
(( segid " " and resid 432 and name HB ))
OR { 419}
(( segid " " and resid 329 and name H ))
(( segid " " and resid 334 and name HG3 ))
ASSI { 344}
(( segid " " and resid 257 and name H ))
(( segid " " and resid 254 and name HB3 ))
3.700 1.700 1.700 peak 344 spectrum 1 weight 0.10000E+01 volume 0.75274E-03 ppm1 7.435 ppm2 2.957 CV 1
OR { 344}
(( segid " " and resid 257 and name H ))
(( segid " " and resid 239 and name HE2 ))
ASSI { 734}
(( segid " " and resid 242 and name H ))
( segid " " and resid 240 and name HG2%)
5.100 3.200 0.900 peak 734 spectrum 1 weight 0.10000E+01 volume 0.73924E-03 ppm1 7.542 ppm2 0.792 CV 1
OR { 734}
(( segid " " and resid 242 and name H ))
( segid " " and resid 266 and name HD2%)
ASSI { 198}
(( segid " " and resid 331 and name H ))
(( segid " " and resid 331 and name HG2 ))
2.400 0.700 0.700 peak 198 spectrum 1 weight 0.10000E+01 volume 0.41006E-02 ppm1 7.179 ppm2 1.552 CV 1
OR { 198}
(( segid " " and resid 331 and name H ))
( segid " " and resid 330 and name HB% )
ASSI { 1990}
(( segid " " and resid 321 and name H ))
(( segid " " and resid 319 and name H ))
4.500 2.600 1.500 peak 1990 spectrum 1 weight 0.10000E+01 volume 0.23872E-03 ppm1 8.595 ppm2 7.800 CV 1
OR { 1990}
(( segid " " and resid 321 and name H ))
(( segid " " and resid 323 and name H ))
ASSI { 939}
(( segid " " and resid 256 and name H ))
(( segid " " and resid 257 and name HA ))
5.200 3.300 0.800 peak 939 spectrum 1 weight 0.10000E+01 volume 0.55059E-03 ppm1 8.259 ppm2 4.409 CV 1
OR { 939}
(( segid " " and resid 256 and name H ))
(( segid " " and resid 258 and name HA ))
ASSI { 685}
(( segid " " and resid 314 and name HD21))
(( segid " " and resid 317 and name HB3 ))
3.400 1.500 1.500 peak 685 spectrum 1 weight 0.10000E+01 volume 0.11166E-02 ppm1 7.382 ppm2 1.131 CV 1
OR { 685}
(( segid " " and resid 314 and name HD21))
( segid " " and resid 280 and name HG2%)
OR { 685}
(( segid " " and resid 314 and name HD21))
( segid " " and resid 310 and name HD1%)
ASSI { 2440}
(( segid " " and resid 429 and name H ))
(( segid " " and resid 429 and name HA ))
3.300 1.400 1.400 peak 2440 spectrum 1 weight 0.10000E+01 volume 0.93756E-03 ppm1 8.116 ppm2 3.733 CV 1
OR { 2440}
(( segid " " and resid 429 and name H ))
(( segid " " and resid 426 and name HA ))
ASSI { 1439}
(( segid " " and resid 410 and name H ))
(( segid " " and resid 410 and name HA ))
3.000 1.200 1.200 peak 1439 spectrum 1 weight 0.10000E+01 volume 0.23872E-02 ppm1 7.900 ppm2 4.348 CV 1
OR { 1439}
(( segid " " and resid 410 and name H ))
(( segid " " and resid 407 and name HA ))
ASSI { 361}
(( segid " " and resid 271 and name H ))
(( segid " " and resid 271 and name HG ))
3.600 1.600 1.600 peak 361 spectrum 1 weight 0.10000E+01 volume 0.11705E-02 ppm1 7.668 ppm2 2.201 CV 1
OR { 361}
(( segid " " and resid 271 and name H ))
(( segid " " and resid 269 and name HB2 ))
ASSI { 902}
(( segid " " and resid 364 and name H ))
( segid " " and resid 360 and name HD% )
4.300 2.300 1.700 peak 902 spectrum 1 weight 0.10000E+01 volume 0.75465E-03 ppm1 7.555 ppm2 7.109 CV 1
OR { 902}
(( segid " " and resid 242 and name H ))
(( segid " " and resid 239 and name H ))
OR { 902}
(( segid " " and resid 364 and name H ))
(( segid " " and resid 363 and name HD2 ))
OR { 902}
(( segid " " and resid 364 and name H ))
( segid " " and resid 361 and name HD% )
OR { 902}
(( segid " " and resid 364 and name H ))
( segid " " and resid 368 and name HD% )
OR { 902}
(( segid " " and resid 242 and name H ))
( segid " " and resid 258 and name HD% )
ASSI { 194}
(( segid " " and resid 305 and name H ))
(( segid " " and resid 302 and name HA ))
3.100 1.200 1.200 peak 194 spectrum 1 weight 0.10000E+01 volume 0.19040E-02 ppm1 7.497 ppm2 4.328 CV 1
OR { 194}
(( segid " " and resid 299 and name H ))
(( segid " " and resid 295 and name HB ))
OR { 194}
(( segid " " and resid 299 and name H ))
(( segid " " and resid 293 and name HA ))
ASSI { 662}
(( segid " " and resid 363 and name H ))
( segid " " and resid 367 and name HD2%)
4.400 2.400 1.600 peak 662 spectrum 1 weight 0.10000E+01 volume 0.94140E-03 ppm1 7.264 ppm2 0.767 CV 1
OR { 662}
(( segid " " and resid 363 and name H ))
( segid " " and resid 323 and name HG1%)
ASSI { 411}
(( segid " " and resid 229 and name H ))
(( segid " " and resid 335 and name HB ))
4.100 2.100 1.900 peak 411 spectrum 1 weight 0.10000E+01 volume 0.74696E-03 ppm1 9.620 ppm2 4.210 CV 1
OR { 411}
(( segid " " and resid 229 and name H ))
(( segid " " and resid 335 and name HA ))
OR { 411}
(( segid " " and resid 229 and name H ))
(( segid " " and resid 227 and name HA ))
ASSI { 738}
(( segid " " and resid 269 and name HE22))
(( segid " " and resid 244 and name HD2 ))
3.500 3.500 2.500 peak 738 spectrum 1 weight 0.10000E+01 volume 0.57946E-03 ppm1 6.868 ppm2 0.979 CV 1
OR { 738}
(( segid " " and resid 269 and name HE22))
( segid " " and resid 240 and name HG1%)
OR { 738}
(( segid " " and resid 269 and name HE22))
( segid " " and resid 189 and name HG2%)
ASSI { 182}
(( segid " " and resid 280 and name H ))
( segid " " and resid 278 and name HD2%)
5.700 4.100 0.300 peak 182 spectrum 1 weight 0.10000E+01 volume 0.32343E-03 ppm1 7.658 ppm2 0.729 CV 1
OR { 182}
(( segid " " and resid 280 and name H ))
( segid " " and resid 283 and name HD1%)
OR { 182}
(( segid " " and resid 280 and name H ))
( segid " " and resid 350 and name HG1%)
OR { 182}
(( segid " " and resid 280 and name H ))
( segid " " and resid 350 and name HG2%)
ASSI { 36}
(( segid " " and resid 254 and name HD21))
( segid " " and resid 255 and name HD1%)
5.400 3.600 0.600 peak 36 spectrum 1 weight 0.10000E+01 volume 0.39659E-03 ppm1 7.494 ppm2 0.622 CV 1
OR { 36}
(( segid " " and resid 254 and name HD21))
( segid " " and resid 253 and name HG2%)
ASSI { 219}
(( segid " " and resid 290 and name H ))
(( segid " " and resid 293 and name HA ))
5.600 3.900 0.400 peak 219 spectrum 1 weight 0.10000E+01 volume 0.49668E-03 ppm1 7.821 ppm2 4.341 CV 1
OR { 219}
(( segid " " and resid 290 and name H ))
(( segid " " and resid 302 and name HA ))
ASSI { 405}
(( segid " " and resid 314 and name H ))
(( segid " " and resid 317 and name HB3 ))
4.400 2.400 1.600 peak 405 spectrum 1 weight 0.10000E+01 volume 0.14073E-02 ppm1 7.342 ppm2 1.103 CV 1
OR { 405}
(( segid " " and resid 314 and name H ))
( segid " " and resid 310 and name HD1%)
OR { 405}
(( segid " " and resid 314 and name H ))
( segid " " and resid 310 and name HD2%)
ASSI { 251}
(( segid " " and resid 316 and name H ))
(( segid " " and resid 317 and name HB2 ))
4.300 2.400 1.700 peak 251 spectrum 1 weight 0.10000E+01 volume 0.70846E-03 ppm1 8.715 ppm2 1.374 CV 1
OR { 251}
(( segid " " and resid 316 and name H ))
(( segid " " and resid 208 and name HB2 ))
OR { 251}
(( segid " " and resid 316 and name H ))
(( segid " " and resid 318 and name HB ))
ASSI { 1773}
(( segid " " and resid 216 and name H ))
(( segid " " and resid 216 and name HA ))
3.100 1.200 1.200 peak 1773 spectrum 1 weight 0.10000E+01 volume 0.18058E-02 ppm1 7.634 ppm2 3.896 CV 1
OR { 1773}
(( segid " " and resid 216 and name H ))
(( segid " " and resid 215 and name HA ))
ASSI { 2752}
(( segid " " and resid 201 and name H ))
(( segid " " and resid 199 and name HA ))
4.300 2.300 1.700 peak 2752 spectrum 1 weight 0.10000E+01 volume 0.40622E-03 ppm1 7.497 ppm2 3.856 CV 1
OR { 2752}
(( segid " " and resid 201 and name H ))
(( segid " " and resid 197 and name HA ))
ASSI { 774}
(( segid " " and resid 426 and name H ))
( segid " " and resid 416 and name HD1%)
3.500 1.500 1.500 peak 774 spectrum 1 weight 0.10000E+01 volume 0.40100E-02 ppm1 7.994 ppm2 0.854 CV 1
OR { 774}
(( segid " " and resid 426 and name H ))
( segid " " and resid 423 and name HD1%)
OR { 774}
(( segid " " and resid 426 and name H ))
( segid " " and resid 423 and name HD2%)
OR { 774}
(( segid " " and resid 400 and name H ))
( segid " " and resid 398 and name HG2%)
OR { 774}
(( segid " " and resid 434 and name H ))
( segid " " and resid 435 and name HD1%)
OR { 774}
(( segid " " and resid 415 and name H ))
( segid " " and resid 416 and name HD1%)
OR { 774}
(( segid " " and resid 434 and name H ))
( segid " " and resid 435 and name HG2%)
OR { 774}
(( segid " " and resid 400 and name H ))
( segid " " and resid 439 and name HD2%)
OR { 774}
(( segid " " and resid 306 and name H ))
( segid " " and resid 283 and name HD2%)
OR { 774}
(( segid " " and resid 434 and name H ))
( segid " " and resid 436 and name HD2%)
OR { 774}
(( segid " " and resid 400 and name H ))
( segid " " and resid 443 and name HD1%)
OR { 774}
(( segid " " and resid 415 and name H ))
( segid " " and resid 420 and name HG2%)
ASSI { 286}
(( segid " " and resid 395 and name HE22))
(( segid " " and resid 398 and name H ))
6.000 4.500 0.000 peak 286 spectrum 1 weight 0.10000E+01 volume 0.29840E-03 ppm1 6.972 ppm2 8.688 CV 1
OR { 286}
(( segid " " and resid 395 and name HE22))
(( segid " " and resid 396 and name H ))
ASSI { 843}
(( segid " " and resid 283 and name H ))
(( segid " " and resid 284 and name HA ))
4.600 2.700 1.400 peak 843 spectrum 1 weight 0.10000E+01 volume 0.51209E-03 ppm1 7.323 ppm2 4.316 CV 1
OR { 843}
(( segid " " and resid 283 and name H ))
(( segid " " and resid 279 and name HA ))
OR { 843}
(( segid " " and resid 283 and name H ))
(( segid " " and resid 285 and name HA ))
ASSI { 444}
(( segid " " and resid 428 and name H ))
(( segid " " and resid 425 and name HD3 ))
3.900 1.900 1.900 peak 444 spectrum 1 weight 0.10000E+01 volume 0.85284E-03 ppm1 7.727 ppm2 1.591 CV 1
OR { 444}
(( segid " " and resid 428 and name H ))
(( segid " " and resid 425 and name HD2 ))
OR { 444}
(( segid " " and resid 428 and name H ))
(( segid " " and resid 416 and name HG ))
ASSI { 582}
(( segid " " and resid 359 and name H ))
( segid " " and resid 358 and name HD% )
3.400 1.400 1.400 peak 582 spectrum 1 weight 0.10000E+01 volume 0.20195E-02 ppm1 7.197 ppm2 7.054 CV 1
OR { 582}
(( segid " " and resid 359 and name H ))
( segid " " and resid 360 and name HD% )
OR { 582}
(( segid " " and resid 359 and name H ))
( segid " " and resid 361 and name HE% )
ASSI { 99}
(( segid " " and resid 199 and name H ))
( segid " " and resid 201 and name HG2%)
3.800 1.800 1.800 peak 99 spectrum 1 weight 0.10000E+01 volume 0.12398E-02 ppm1 7.773 ppm2 1.340 CV 1
OR { 99}
(( segid " " and resid 199 and name H ))
(( segid " " and resid 210 and name HB3 ))
OR { 99}
(( segid " " and resid 199 and name H ))
(( segid " " and resid 194 and name HG ))
OR { 99}
(( segid " " and resid 199 and name H ))
(( segid " " and resid 208 and name HB2 ))
ASSI { 620}
(( segid " " and resid 375 and name HE22))
(( segid " " and resid 218 and name HA ))
2.900 2.900 3.100 peak 620 spectrum 1 weight 0.10000E+01 volume 0.82974E-03 ppm1 7.505 ppm2 4.066 CV 1
OR { 620}
(( segid " " and resid 375 and name HE22))
(( segid " " and resid 374 and name HA ))
OR { 620}
(( segid " " and resid 375 and name HE22))
(( segid " " and resid 219 and name HA ))
OR { 620}
(( segid " " and resid 375 and name HE22))
(( segid " " and resid 380 and name HA ))
OR { 620}
(( segid " " and resid 375 and name HE22))
(( segid " " and resid 403 and name HA ))
ASSI { 437}
(( segid " " and resid 364 and name H ))
( segid " " and resid 367 and name HD2%)
4.600 2.600 1.400 peak 437 spectrum 1 weight 0.10000E+01 volume 0.81434E-03 ppm1 7.556 ppm2 0.793 CV 1
OR { 437}
(( segid " " and resid 364 and name H ))
( segid " " and resid 323 and name HG1%)
ASSI { 497}
(( segid " " and resid 328 and name H ))
(( segid " " and resid 327 and name HB2 ))
3.300 1.300 1.300 peak 497 spectrum 1 weight 0.10000E+01 volume 0.10839E-02 ppm1 7.195 ppm2 3.116 CV 1
OR { 497}
(( segid " " and resid 328 and name H ))
(( segid " " and resid 327 and name HB3 ))
OR { 497}
(( segid " " and resid 359 and name H ))
(( segid " " and resid 360 and name HB3 ))
ASSI { 726}
(( segid " " and resid 351 and name HE22))
(( segid " " and resid 350 and name HA ))
3.000 1.100 1.100 peak 726 spectrum 1 weight 0.10000E+01 volume 0.27992E-02 ppm1 7.561 ppm2 4.539 CV 1
OR { 726}
(( segid " " and resid 351 and name HE22))
(( segid " " and resid 277 and name HA ))
ASSI { 2970}
(( segid " " and resid 283 and name H ))
(( segid " " and resid 283 and name HA ))
3.100 1.200 1.200 peak 2970 spectrum 1 weight 0.10000E+01 volume 0.12821E-02 ppm1 7.318 ppm2 4.519 CV 1
OR { 2970}
(( segid " " and resid 283 and name H ))
(( segid " " and resid 280 and name HB ))
ASSI { 787}
(( segid " " and resid 357 and name H ))
( segid " " and resid 360 and name HD% )
4.200 2.200 1.800 peak 787 spectrum 1 weight 0.10000E+01 volume 0.90480E-03 ppm1 8.142 ppm2 7.066 CV 1
OR { 787}
(( segid " " and resid 357 and name H ))
( segid " " and resid 360 and name HE% )
OR { 787}
(( segid " " and resid 357 and name H ))
( segid " " and resid 361 and name HE% )
OR { 787}
(( segid " " and resid 357 and name H ))
( segid " " and resid 358 and name HD% )
OR { 787}
(( segid " " and resid 357 and name H ))
(( segid " " and resid 352 and name H ))
ASSI { 795}
(( segid " " and resid 381 and name H ))
(( segid " " and resid 380 and name HA ))
2.400 0.700 0.700 peak 795 spectrum 1 weight 0.10000E+01 volume 0.58757E-02 ppm1 8.201 ppm2 4.069 CV 1
OR { 795}
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(( segid " " and resid 343 and name HA ))
OR { 795}
(( segid " " and resid 343 and name H ))
(( segid " " and resid 340 and name HA ))
ASSI { 484}
(( segid " " and resid 192 and name H ))
(( segid " " and resid 273 and name HA ))
5.200 3.400 0.800 peak 484 spectrum 1 weight 0.10000E+01 volume 0.55831E-03 ppm1 6.707 ppm2 4.430 CV 1
OR { 484}
(( segid " " and resid 192 and name H ))
(( segid " " and resid 196 and name HA ))
OR { 484}
(( segid " " and resid 192 and name H ))
(( segid " " and resid 276 and name HA ))
ASSI { 237}
(( segid " " and resid 305 and name H ))
(( segid " " and resid 308 and name H ))
4.300 2.300 1.700 peak 237 spectrum 1 weight 0.10000E+01 volume 0.10049E-02 ppm1 7.496 ppm2 7.084 CV 1
OR { 237}
(( segid " " and resid 305 and name H ))
( segid " " and resid 303 and name HD% )
OR { 237}
(( segid " " and resid 299 and name H ))
( segid " " and resid 303 and name HD% )
OR { 237}
(( segid " " and resid 299 and name H ))
(( segid " " and resid 363 and name HD2 ))
ASSI { 704}
(( segid " " and resid 225 and name H ))
(( segid " " and resid 226 and name HD2 ))
5.700 4.100 0.300 peak 704 spectrum 1 weight 0.10000E+01 volume 0.55831E-03 ppm1 7.799 ppm2 1.589 CV 1
OR { 704}
(( segid " " and resid 225 and name H ))
(( segid " " and resid 331 and name HD3 ))
OR { 704}
(( segid " " and resid 225 and name H ))
(( segid " " and resid 331 and name HD2 ))
OR { 704}
(( segid " " and resid 225 and name H ))
(( segid " " and resid 226 and name HD3 ))
OR { 704}
(( segid " " and resid 225 and name H ))
(( segid " " and resid 331 and name HG2 ))
ASSI { 723}
(( segid " " and resid 239 and name H ))
(( segid " " and resid 240 and name HB ))
3.900 1.900 1.900 peak 723 spectrum 1 weight 0.10000E+01 volume 0.21331E-02 ppm1 7.098 ppm2 2.203 CV 1
OR { 723}
(( segid " " and resid 239 and name H ))
(( segid " " and resid 242 and name HB3 ))
OR { 723}
(( segid " " and resid 239 and name H ))
(( segid " " and resid 242 and name HB2 ))
OR { 723}
(( segid " " and resid 239 and name H ))
(( segid " " and resid 242 and name HG2 ))
ASSI { 896}
(( segid " " and resid 277 and name H ))
(( segid " " and resid 280 and name H ))
5.000 3.100 1.000 peak 896 spectrum 1 weight 0.10000E+01 volume 0.27144E-03 ppm1 8.684 ppm2 7.666 CV 1
OR { 896}
(( segid " " and resid 277 and name H ))
(( segid " " and resid 277 and name HD21))
ASSI { 95}
(( segid " " and resid 355 and name H ))
(( segid " " and resid 354 and name H ))
3.600 1.600 1.600 peak 95 spectrum 1 weight 0.10000E+01 volume 0.48515E-03 ppm1 8.079 ppm2 8.927 CV 1
OR { 95}
(( segid " " and resid 355 and name H ))
(( segid " " and resid 353 and name H ))
ASSI { 2597}
(( segid " " and resid 306 and name H ))
(( segid " " and resid 307 and name H ))
2.400 0.700 0.700 peak 2597 spectrum 1 weight 0.10000E+01 volume 0.28377E-02 ppm1 8.002 ppm2 8.729 CV 1
OR { 2597}
(( segid " " and resid 302 and name H ))
(( segid " " and resid 303 and name H ))
ASSI { 500}
(( segid " " and resid 396 and name H ))
(( segid " " and resid 395 and name HA ))
3.800 1.900 1.900 peak 500 spectrum 1 weight 0.10000E+01 volume 0.14747E-02 ppm1 8.691 ppm2 3.764 CV 1
OR { 500}
(( segid " " and resid 396 and name H ))
(( segid " " and resid 397 and name HA2 ))
OR { 500}
(( segid " " and resid 396 and name H ))
(( segid " " and resid 397 and name HA3 ))
ASSI { 133}
(( segid " " and resid 351 and name H ))
(( segid " " and resid 351 and name HA ))
2.400 0.700 0.700 peak 133 spectrum 1 weight 0.10000E+01 volume 0.45935E-02 ppm1 7.885 ppm2 3.831 CV 1
OR { 133}
(( segid " " and resid 251 and name H ))
(( segid " " and resid 250 and name HA ))
ASSI { 1988}
(( segid " " and resid 405 and name H ))
(( segid " " and resid 405 and name HB2 ))
2.100 0.600 0.600 peak 1988 spectrum 1 weight 0.10000E+01 volume 0.85266E-02 ppm1 8.370 ppm2 2.006 CV 1
OR { 1988}
(( segid " " and resid 365 and name H ))
(( segid " " and resid 365 and name HB2 ))
OR { 1988}
(( segid " " and resid 365 and name H ))
(( segid " " and resid 365 and name HB3 ))
ASSI { 214}
(( segid " " and resid 255 and name H ))
( segid " " and resid 255 and name HD2%)
2.400 0.700 0.700 peak 214 spectrum 1 weight 0.10000E+01 volume 0.22698E-02 ppm1 8.622 ppm2 0.774 CV 1
OR { 214}
(( segid " " and resid 330 and name H ))
( segid " " and resid 329 and name HG2%)
ASSI { 271}
(( segid " " and resid 287 and name H ))
(( segid " " and resid 284 and name HG3 ))
4.000 2.000 2.000 peak 271 spectrum 1 weight 0.10000E+01 volume 0.75465E-03 ppm1 8.003 ppm2 2.619 CV 1
OR { 271}
(( segid " " and resid 287 and name H ))
(( segid " " and resid 284 and name HG2 ))
OR { 271}
(( segid " " and resid 287 and name H ))
(( segid " " and resid 303 and name HB3 ))
ASSI { 304}
(( segid " " and resid 420 and name H ))
(( segid " " and resid 420 and name HA ))
2.400 0.700 0.700 peak 304 spectrum 1 weight 0.10000E+01 volume 0.10421E-01 ppm1 7.495 ppm2 3.989 CV 1
OR { 304}
(( segid " " and resid 420 and name H ))
(( segid " " and resid 419 and name HA3 ))
OR { 304}
(( segid " " and resid 420 and name H ))
(( segid " " and resid 418 and name HA3 ))
ASSI { 479}
(( segid " " and resid 377 and name H ))
( segid " " and resid 376 and name HG1%)
3.100 1.200 1.200 peak 479 spectrum 1 weight 0.10000E+01 volume 0.44567E-02 ppm1 8.237 ppm2 0.914 CV 1
OR { 479}
(( segid " " and resid 377 and name H ))
( segid " " and resid 376 and name HG2%)
OR { 479}
(( segid " " and resid 266 and name H ))
( segid " " and resid 266 and name HD1%)
ASSI { 188}
(( segid " " and resid 320 and name H ))
( segid " " and resid 316 and name HD1%)
4.400 2.500 1.600 peak 188 spectrum 1 weight 0.10000E+01 volume 0.82590E-03 ppm1 8.417 ppm2 0.786 CV 1
OR { 188}
(( segid " " and resid 320 and name H ))
( segid " " and resid 316 and name HD2%)
OR { 188}
(( segid " " and resid 320 and name H ))
( segid " " and resid 323 and name HG1%)
OR { 188}
(( segid " " and resid 320 and name H ))
( segid " " and resid 278 and name HD2%)
OR { 188}
(( segid " " and resid 320 and name H ))
( segid " " and resid 271 and name HD1%)
OR { 188}
(( segid " " and resid 320 and name H ))
( segid " " and resid 372 and name HG2%)
OR { 188}
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4.300 2.300 1.700 peak 273 spectrum 1 weight 0.10000E+01 volume 0.10704E-02 ppm1 7.321 ppm2 2.230 CV 1
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3.000 1.100 1.100 peak 366 spectrum 1 weight 0.10000E+01 volume 0.24411E-02 ppm1 8.200 ppm2 1.864 CV 1
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3.700 1.700 1.700 peak 2411 spectrum 1 weight 0.10000E+01 volume 0.34460E-02 ppm1 7.644 ppm2 2.056 CV 1
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ASSI { 239}
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4.100 2.100 1.900 peak 239 spectrum 1 weight 0.10000E+01 volume 0.94718E-03 ppm1 8.541 ppm2 1.540 CV 1
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4.400 2.400 1.600 peak 19 spectrum 1 weight 0.10000E+01 volume 0.35615E-03 ppm1 7.177 ppm2 3.876 CV 1
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ASSI { 1489}
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2.600 0.900 0.900 peak 1489 spectrum 1 weight 0.10000E+01 volume 0.16056E-02 ppm1 7.473 ppm2 3.900 CV 1
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ASSI { 231}
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4.000 2.000 2.000 peak 231 spectrum 1 weight 0.10000E+01 volume 0.14381E-02 ppm1 8.417 ppm2 0.383 CV 1
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3.400 1.400 1.400 peak 911 spectrum 1 weight 0.10000E+01 volume 0.11532E-02 ppm1 8.674 ppm2 3.828 CV 1
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ASSI { 716}
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4.400 2.500 1.600 peak 716 spectrum 1 weight 0.10000E+01 volume 0.75081E-03 ppm1 8.687 ppm2 1.928 CV 1
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2.900 2.900 3.100 peak 901 spectrum 1 weight 0.10000E+01 volume 0.65262E-03 ppm1 7.361 ppm2 3.738 CV 1
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ASSI { 152}
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3.300 1.400 1.400 peak 152 spectrum 1 weight 0.10000E+01 volume 0.15286E-02 ppm1 7.191 ppm2 3.872 CV 1
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3.400 1.400 1.400 peak 794 spectrum 1 weight 0.10000E+01 volume 0.14034E-02 ppm1 8.322 ppm2 4.037 CV 1
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ASSI { 622}
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3.700 1.700 1.700 peak 622 spectrum 1 weight 0.10000E+01 volume 0.16075E-02 ppm1 8.053 ppm2 1.358 CV 1
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ASSI { 440}
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2.600 0.800 0.800 peak 440 spectrum 1 weight 0.10000E+01 volume 0.52461E-02 ppm1 7.820 ppm2 2.015 CV 1
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ASSI { 966}
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4.600 2.700 1.400 peak 966 spectrum 1 weight 0.10000E+01 volume 0.11801E-02 ppm1 8.530 ppm2 1.550 CV 1
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OR { 966}
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3.400 1.400 1.400 peak 650 spectrum 1 weight 0.10000E+01 volume 0.95681E-03 ppm1 7.300 ppm2 2.955 CV 1
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ASSI { 522}
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3.400 1.400 1.400 peak 522 spectrum 1 weight 0.10000E+01 volume 0.21677E-02 ppm1 9.036 ppm2 1.440 CV 1
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ASSI { 604}
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5.400 3.600 0.600 peak 604 spectrum 1 weight 0.10000E+01 volume 0.45818E-03 ppm1 9.122 ppm2 1.818 CV 1
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2.800 1.000 1.000 peak 1312 spectrum 1 weight 0.10000E+01 volume 0.23275E-02 ppm1 7.610 ppm2 2.077 CV 1
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3.200 1.300 1.300 peak 2837 spectrum 1 weight 0.10000E+01 volume 0.11204E-02 ppm1 7.625 ppm2 4.566 CV 1
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ASSI { 457}
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2.600 2.600 3.400 peak 457 spectrum 1 weight 0.10000E+01 volume 0.12610E-02 ppm1 7.562 ppm2 1.884 CV 1
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ASSI { 638}
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4.400 2.400 1.600 peak 638 spectrum 1 weight 0.10000E+01 volume 0.26182E-03 ppm1 8.044 ppm2 2.880 CV 1
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ASSI { 298}
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3.300 1.400 1.400 peak 298 spectrum 1 weight 0.10000E+01 volume 0.26259E-02 ppm1 7.099 ppm2 2.178 CV 1
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ASSI { 1459}
(( segid " " and resid 305 and name H ))
(( segid " " and resid 306 and name H ))
2.600 0.900 0.900 peak 1459 spectrum 1 weight 0.10000E+01 volume 0.24276E-02 ppm1 7.500 ppm2 8.026 CV 1
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(( segid " " and resid 297 and name H ))
OR { 1459}
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(( segid " " and resid 301 and name H ))
ASSI { 309}
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4.600 2.600 1.400 peak 309 spectrum 1 weight 0.10000E+01 volume 0.56406E-03 ppm1 8.262 ppm2 2.631 CV 1
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ASSI { 432}
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5.400 3.700 0.600 peak 432 spectrum 1 weight 0.10000E+01 volume 0.22717E-03 ppm1 7.956 ppm2 1.599 CV 1
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4.400 2.400 1.600 peak 263 spectrum 1 weight 0.10000E+01 volume 0.17230E-02 ppm1 6.785 ppm2 0.712 CV 1
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2.400 2.400 3.600 peak 126 spectrum 1 weight 0.10000E+01 volume 0.18866E-02 ppm1 6.628 ppm2 0.885 CV 1
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1.900 0.400 0.400 peak 713 spectrum 1 weight 0.10000E+01 volume 0.16011E-01 ppm1 7.990 ppm2 1.987 CV 1
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2.700 0.900 0.900 peak 1333 spectrum 1 weight 0.10000E+01 volume 0.39543E-02 ppm1 7.997 ppm2 4.371 CV 1
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ASSI { 2827}
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3.900 1.900 1.900 peak 845 spectrum 1 weight 0.10000E+01 volume 0.10723E-02 ppm1 10.123 ppm2 1.614 CV 1
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ASSI { 702}
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4.000 2.000 2.000 peak 702 spectrum 1 weight 0.10000E+01 volume 0.13996E-02 ppm1 8.217 ppm2 1.616 CV 1
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OR { 702}
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ASSI { 591}
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3.800 1.800 1.800 peak 591 spectrum 1 weight 0.10000E+01 volume 0.17192E-02 ppm1 8.219 ppm2 0.400 CV 1
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2.400 0.700 0.700 peak 1400 spectrum 1 weight 0.10000E+01 volume 0.60182E-02 ppm1 8.530 ppm2 4.300 CV 1
OR { 1400}
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(( segid " " and resid 294 and name HB ))
ASSI { 994}
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5.300 3.500 0.700 peak 994 spectrum 1 weight 0.10000E+01 volume 0.57946E-03 ppm1 7.443 ppm2 0.046 CV 1
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ASSI { 312}
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2.700 0.900 0.900 peak 312 spectrum 1 weight 0.10000E+01 volume 0.22755E-02 ppm1 8.066 ppm2 1.570 CV 1
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OR { 312}
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(( segid " " and resid 308 and name H ))
3.700 1.800 1.800 peak 291 spectrum 1 weight 0.10000E+01 volume 0.12109E-02 ppm1 8.004 ppm2 7.089 CV 1
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OR { 291}
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3.900 1.900 1.900 peak 327 spectrum 1 weight 0.10000E+01 volume 0.47937E-03 ppm1 8.991 ppm2 1.867 CV 1
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OR { 327}
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(( segid " " and resid 265 and name H ))
4.200 2.200 1.800 peak 920 spectrum 1 weight 0.10000E+01 volume 0.47359E-03 ppm1 8.058 ppm2 7.726 CV 1
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ASSI { 2735}
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3.500 1.500 1.500 peak 2735 spectrum 1 weight 0.10000E+01 volume 0.67765E-03 ppm1 9.261 ppm2 4.075 CV 1
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ASSI { 2306}
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(( segid " " and resid 368 and name H ))
2.700 0.900 0.900 peak 2306 spectrum 1 weight 0.10000E+01 volume 0.18693E-02 ppm1 7.864 ppm2 8.218 CV 1
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(( segid " " and resid 269 and name H ))
ASSI { 958}
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2.700 0.900 0.900 peak 958 spectrum 1 weight 0.10000E+01 volume 0.11705E-02 ppm1 8.573 ppm2 1.973 CV 1
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ASSI { 202}
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(( segid " " and resid 189 and name HB ))
2.900 1.000 1.000 peak 202 spectrum 1 weight 0.10000E+01 volume 0.16190E-02 ppm1 8.886 ppm2 2.189 CV 1
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OR { 202}
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2.500 0.800 0.800 peak 1548 spectrum 1 weight 0.10000E+01 volume 0.79875E-02 ppm1 8.385 ppm2 1.674 CV 1
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(( segid " " and resid 421 and name HB3 ))
OR { 1548}
(( segid " " and resid 421 and name H ))
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2.700 0.900 0.900 peak 803 spectrum 1 weight 0.10000E+01 volume 0.31014E-02 ppm1 8.666 ppm2 3.827 CV 1
OR { 803}
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ASSI { 355}
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5.700 4.100 0.300 peak 355 spectrum 1 weight 0.10000E+01 volume 0.27915E-03 ppm1 8.681 ppm2 6.410 CV 1
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ASSI { 2891}
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4.400 2.500 1.600 peak 2891 spectrum 1 weight 0.10000E+01 volume 0.11127E-02 ppm1 7.776 ppm2 -0.168 CV 1
OR { 2891}
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ASSI { 1409}
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3.800 1.800 1.800 peak 1409 spectrum 1 weight 0.10000E+01 volume 0.17615E-02 ppm1 8.059 ppm2 2.236 CV 1
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ASSI { 696}
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OR { 696}
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5.100 3.200 0.900 peak 877 spectrum 1 weight 0.10000E+01 volume 0.27144E-03 ppm1 7.181 ppm2 4.386 CV 1
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OR { 877}
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ASSI { 833}
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5.300 3.500 0.700 peak 833 spectrum 1 weight 0.10000E+01 volume 0.41775E-03 ppm1 6.654 ppm2 1.058 CV 1
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ASSI { 2089}
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4.500 2.500 1.500 peak 2089 spectrum 1 weight 0.10000E+01 volume 0.36578E-03 ppm1 8.416 ppm2 0.192 CV 1
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ASSI { 835}
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3.100 1.200 1.200 peak 835 spectrum 1 weight 0.10000E+01 volume 0.12783E-02 ppm1 7.666 ppm2 3.678 CV 1
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ASSI { 972}
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2.700 0.900 0.900 peak 972 spectrum 1 weight 0.10000E+01 volume 0.23275E-02 ppm1 7.710 ppm2 2.821 CV 1
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ASSI { 201}
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4.400 2.400 1.600 peak 201 spectrum 1 weight 0.10000E+01 volume 0.98374E-03 ppm1 7.337 ppm2 1.725 CV 1
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ASSI { 44}
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5.000 3.100 1.000 peak 44 spectrum 1 weight 0.10000E+01 volume 0.77199E-03 ppm1 8.207 ppm2 1.884 CV 1
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ASSI { 1417}
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3.800 1.800 1.800 peak 1417 spectrum 1 weight 0.10000E+01 volume 0.62568E-03 ppm1 7.625 ppm2 3.995 CV 1
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ASSI { 542}
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3.500 1.500 1.500 peak 542 spectrum 1 weight 0.10000E+01 volume 0.11204E-02 ppm1 6.862 ppm2 1.832 CV 1
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ASSI { 177}
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5.100 3.300 0.900 peak 177 spectrum 1 weight 0.10000E+01 volume 0.54096E-03 ppm1 7.873 ppm2 2.966 CV 1
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ASSI { 2055}
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3.300 1.400 1.400 peak 2055 spectrum 1 weight 0.10000E+01 volume 0.24161E-02 ppm1 6.947 ppm2 1.150 CV 1
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ASSI { 170}
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3.900 1.900 1.900 peak 170 spectrum 1 weight 0.10000E+01 volume 0.27222E-02 ppm1 8.708 ppm2 0.619 CV 1
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ASSI { 557}
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3.800 1.800 1.800 peak 557 spectrum 1 weight 0.10000E+01 volume 0.12591E-02 ppm1 6.331 ppm2 0.458 CV 1
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ASSI { 400}
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2.400 0.700 0.700 peak 400 spectrum 1 weight 0.10000E+01 volume 0.19405E-02 ppm1 6.882 ppm2 3.865 CV 1
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ASSI { 107}
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6.000 4.600 0.000 peak 107 spectrum 1 weight 0.10000E+01 volume 0.30032E-03 ppm1 7.664 ppm2 3.827 CV 1
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ASSI { 85}
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4.700 2.700 1.300 peak 85 spectrum 1 weight 0.10000E+01 volume 0.51015E-03 ppm1 7.860 ppm2 3.813 CV 1
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ASSI { 1762}
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3.100 1.200 1.200 peak 1762 spectrum 1 weight 0.10000E+01 volume 0.16075E-02 ppm1 7.884 ppm2 4.557 CV 1
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ASSI { 1932}
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3.600 1.600 1.600 peak 1932 spectrum 1 weight 0.10000E+01 volume 0.56215E-03 ppm1 8.200 ppm2 3.936 CV 1
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ASSI { 944}
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5.100 3.200 0.900 peak 944 spectrum 1 weight 0.10000E+01 volume 0.47553E-03 ppm1 8.785 ppm2 3.116 CV 1
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ASSI { 276}
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3.200 1.300 1.300 peak 276 spectrum 1 weight 0.10000E+01 volume 0.25393E-02 ppm1 8.239 ppm2 1.977 CV 1
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OR { 276}
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(( segid " " and resid 376 and name HB ))
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ASSI { 317}
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2.900 2.900 3.100 peak 317 spectrum 1 weight 0.10000E+01 volume 0.27279E-02 ppm1 6.947 ppm2 0.705 CV 1
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OR { 317}
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ASSI { 352}
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4.700 2.800 1.300 peak 352 spectrum 1 weight 0.10000E+01 volume 0.40622E-03 ppm1 7.502 ppm2 0.744 CV 1
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5.000 3.100 1.000 peak 141 spectrum 1 weight 0.10000E+01 volume 0.75274E-03 ppm1 7.182 ppm2 1.248 CV 1
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ASSI { 860}
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5.000 3.100 1.000 peak 860 spectrum 1 weight 0.10000E+01 volume 0.37540E-03 ppm1 8.608 ppm2 6.865 CV 1
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ASSI { 2183}
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5.300 3.600 0.700 peak 2183 spectrum 1 weight 0.10000E+01 volume 0.51403E-03 ppm1 8.508 ppm2 -0.159 CV 1
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ASSI { 815}
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5.200 3.300 0.800 peak 815 spectrum 1 weight 0.10000E+01 volume 0.81628E-03 ppm1 7.493 ppm2 4.146 CV 1
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ASSI { 1921}
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3.400 1.500 1.500 peak 1921 spectrum 1 weight 0.10000E+01 volume 0.13591E-02 ppm1 8.267 ppm2 1.306 CV 1
OR { 1921}
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ASSI { 315}
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5.000 3.200 1.000 peak 315 spectrum 1 weight 0.10000E+01 volume 0.51787E-03 ppm1 8.081 ppm2 2.096 CV 1
OR { 315}
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OR { 315}
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ASSI { 371}
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2.400 0.700 0.700 peak 371 spectrum 1 weight 0.10000E+01 volume 0.59258E-02 ppm1 7.100 ppm2 3.978 CV 1
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ASSI { 802}
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5.200 3.300 0.800 peak 802 spectrum 1 weight 0.10000E+01 volume 0.49668E-03 ppm1 8.887 ppm2 0.771 CV 1
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ASSI { 1696}
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3.000 1.100 1.100 peak 1696 spectrum 1 weight 0.10000E+01 volume 0.19329E-02 ppm1 7.110 ppm2 3.910 CV 1
OR { 1696}
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ASSI { 98}
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4.800 2.900 1.200 peak 98 spectrum 1 weight 0.10000E+01 volume 0.52171E-03 ppm1 7.812 ppm2 1.714 CV 1
OR { 98}
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OR { 98}
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ASSI { 818}
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3.800 1.800 1.800 peak 818 spectrum 1 weight 0.10000E+01 volume 0.11243E-02 ppm1 7.500 ppm2 2.068 CV 1
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OR { 818}
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ASSI { 402}
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4.900 3.100 1.100 peak 402 spectrum 1 weight 0.10000E+01 volume 0.23872E-03 ppm1 7.912 ppm2 8.727 CV 1
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ASSI { 184}
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3.100 1.200 1.200 peak 184 spectrum 1 weight 0.10000E+01 volume 0.24372E-02 ppm1 7.495 ppm2 3.928 CV 1
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OR { 184}
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ASSI { 398}
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3.600 1.700 1.700 peak 398 spectrum 1 weight 0.10000E+01 volume 0.33690E-03 ppm1 7.465 ppm2 0.595 CV 1
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ASSI { 329}
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4.100 2.100 1.900 peak 329 spectrum 1 weight 0.10000E+01 volume 0.12610E-02 ppm1 7.495 ppm2 2.369 CV 1
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OR { 329}
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ASSI { 1381}
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2.600 0.900 0.900 peak 1381 spectrum 1 weight 0.10000E+01 volume 0.19251E-02 ppm1 6.330 ppm2 1.362 CV 1
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ASSI { 982}
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4.400 2.400 1.600 peak 982 spectrum 1 weight 0.10000E+01 volume 0.43125E-03 ppm1 8.419 ppm2 1.381 CV 1
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OR { 982}
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OR { 982}
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ASSI { 951}
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4.100 2.100 1.900 peak 951 spectrum 1 weight 0.10000E+01 volume 0.12206E-02 ppm1 6.792 ppm2 1.731 CV 1
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ASSI { 254}
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3.800 1.800 1.800 peak 254 spectrum 1 weight 0.10000E+01 volume 0.94908E-03 ppm1 8.537 ppm2 0.896 CV 1
OR { 254}
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OR { 254}
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4.800 2.900 1.200 peak 458 spectrum 1 weight 0.10000E+01 volume 0.45818E-03 ppm1 7.627 ppm2 1.770 CV 1
OR { 458}
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OR { 458}
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3.500 1.600 1.600 peak 724 spectrum 1 weight 0.10000E+01 volume 0.13418E-02 ppm1 8.118 ppm2 1.559 CV 1
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ASSI { 779}
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4.600 2.700 1.400 peak 779 spectrum 1 weight 0.10000E+01 volume 0.82396E-03 ppm1 7.550 ppm2 1.185 CV 1
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ASSI { 954}
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5.200 3.400 0.800 peak 954 spectrum 1 weight 0.10000E+01 volume 0.53134E-03 ppm1 8.045 ppm2 7.076 CV 1
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OR { 954}
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OR { 954}
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ASSI { 423}
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4.600 2.700 1.400 peak 423 spectrum 1 weight 0.10000E+01 volume 0.77199E-03 ppm1 8.626 ppm2 3.864 CV 1
OR { 423}
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OR { 423}
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5.300 3.500 0.700 peak 959 spectrum 1 weight 0.10000E+01 volume 0.31765E-03 ppm1 7.469 ppm2 8.112 CV 1
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ASSI { 2255}
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5.300 3.500 0.700 peak 2255 spectrum 1 weight 0.10000E+01 volume 0.34075E-03 ppm1 7.342 ppm2 0.193 CV 1
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ASSI { 923}
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5.700 4.000 0.300 peak 923 spectrum 1 weight 0.10000E+01 volume 0.26567E-03 ppm1 9.082 ppm2 2.248 CV 1
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ASSI { 665}
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4.900 3.100 1.100 peak 665 spectrum 1 weight 0.10000E+01 volume 0.71037E-03 ppm1 7.065 ppm2 0.372 CV 1
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4.200 2.200 1.800 peak 334 spectrum 1 weight 0.10000E+01 volume 0.12109E-02 ppm1 9.035 ppm2 0.734 CV 1
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3.600 1.600 1.600 peak 547 spectrum 1 weight 0.10000E+01 volume 0.32958E-02 ppm1 7.795 ppm2 2.131 CV 1
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ASSI { 326}
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5.200 3.400 0.800 peak 326 spectrum 1 weight 0.10000E+01 volume 0.57946E-03 ppm1 7.999 ppm2 6.812 CV 1
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ASSI { 842}
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4.900 3.000 1.100 peak 842 spectrum 1 weight 0.10000E+01 volume 0.71615E-03 ppm1 7.822 ppm2 7.058 CV 1
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ASSI { 770}
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5.300 3.500 0.700 peak 770 spectrum 1 weight 0.10000E+01 volume 0.36772E-03 ppm1 7.442 ppm2 2.852 CV 1
OR { 770}
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OR { 770}
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ASSI { 721}
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3.100 1.200 1.200 peak 721 spectrum 1 weight 0.10000E+01 volume 0.13842E-02 ppm1 8.078 ppm2 7.356 CV 1
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(( segid " " and resid 301 and name HE22))
ASSI { 515}
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5.400 3.600 0.600 peak 515 spectrum 1 weight 0.10000E+01 volume 0.45240E-03 ppm1 7.780 ppm2 7.138 CV 1
OR { 515}
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ASSI { 21}
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5.800 4.200 0.200 peak 21 spectrum 1 weight 0.10000E+01 volume 0.53712E-03 ppm1 8.419 ppm2 0.382 CV 1
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ASSI { 204}
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3.200 3.200 2.800 peak 204 spectrum 1 weight 0.10000E+01 volume 0.30032E-03 ppm1 6.333 ppm2 3.803 CV 1
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(( segid " " and resid 320 and name HA ))
ASSI { 874}
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3.500 1.500 1.500 peak 874 spectrum 1 weight 0.10000E+01 volume 0.32246E-02 ppm1 8.337 ppm2 1.633 CV 1
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OR { 874}
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ASSI { 892}
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4.100 2.100 1.900 peak 892 spectrum 1 weight 0.10000E+01 volume 0.10030E-02 ppm1 7.539 ppm2 3.287 CV 1
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ASSI { 519}
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4.500 2.600 1.500 peak 519 spectrum 1 weight 0.10000E+01 volume 0.32920E-03 ppm1 7.851 ppm2 1.603 CV 1
OR { 519}
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(( segid " " and resid 321 and name HB3 ))
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ASSI { 830}
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4.600 2.600 1.400 peak 830 spectrum 1 weight 0.10000E+01 volume 0.84515E-03 ppm1 8.733 ppm2 1.370 CV 1
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OR { 830}
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ASSI { 296}
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5.400 3.600 0.600 peak 296 spectrum 1 weight 0.10000E+01 volume 0.34460E-03 ppm1 7.066 ppm2 3.813 CV 1
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(( segid " " and resid 314 and name HA ))
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ASSI { 501}
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4.800 2.900 1.200 peak 501 spectrum 1 weight 0.10000E+01 volume 0.32343E-03 ppm1 9.113 ppm2 3.626 CV 1
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ASSI { 191}
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2.300 0.600 0.600 peak 191 spectrum 1 weight 0.10000E+01 volume 0.69461E-02 ppm1 7.767 ppm2 1.657 CV 1
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(( segid " " and resid 443 and name HB3 ))
OR { 191}
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ASSI { 289}
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2.500 0.800 0.800 peak 289 spectrum 1 weight 0.10000E+01 volume 0.50402E-02 ppm1 8.371 ppm2 3.877 CV 1
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(( segid " " and resid 365 and name HA ))
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ASSI { 788}
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( segid " " and resid 274 and name HD2%)
3.100 1.200 1.200 peak 788 spectrum 1 weight 0.10000E+01 volume 0.39909E-02 ppm1 7.027 ppm2 0.767 CV 1
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ASSI { 209}
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4.200 2.200 1.800 peak 209 spectrum 1 weight 0.10000E+01 volume 0.10280E-02 ppm1 8.908 ppm2 0.952 CV 1
OR { 209}
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( segid " " and resid 233 and name HG2%)
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ASSI { 1686}
(( segid " " and resid 320 and name H ))
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3.900 1.900 1.900 peak 1686 spectrum 1 weight 0.10000E+01 volume 0.71231E-03 ppm1 8.419 ppm2 3.124 CV 1
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(( segid " " and resid 319 and name HB3 ))
ASSI { 1363}
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(( segid " " and resid 418 and name H ))
2.800 1.000 1.000 peak 1363 spectrum 1 weight 0.10000E+01 volume 0.15266E-02 ppm1 7.760 ppm2 8.165 CV 1
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(( segid " " and resid 429 and name H ))
ASSI { 145}
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(( segid " " and resid 382 and name HD1 ))
4.600 2.600 1.400 peak 145 spectrum 1 weight 0.10000E+01 volume 0.54481E-03 ppm1 7.964 ppm2 6.941 CV 1
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ASSI { 139}
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4.100 2.100 1.900 peak 139 spectrum 1 weight 0.10000E+01 volume 0.88171E-03 ppm1 8.143 ppm2 4.023 CV 1
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OR { 139}
(( segid " " and resid 357 and name H ))
(( segid " " and resid 343 and name HA ))
ASSI { 836}
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4.700 2.800 1.300 peak 836 spectrum 1 weight 0.10000E+01 volume 0.79315E-03 ppm1 7.095 ppm2 0.815 CV 1
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ASSI { 200}
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( segid " " and resid 350 and name HG2%)
5.500 3.800 0.500 peak 200 spectrum 1 weight 0.10000E+01 volume 0.41775E-03 ppm1 7.678 ppm2 0.744 CV 1
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( segid " " and resid 278 and name HD2%)
OR { 200}
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( segid " " and resid 350 and name HG1%)
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ASSI { 642}
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4.200 2.200 1.800 peak 642 spectrum 1 weight 0.10000E+01 volume 0.13187E-02 ppm1 7.099 ppm2 1.044 CV 1
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OR { 642}
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ASSI { 322}
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4.500 2.500 1.500 peak 322 spectrum 1 weight 0.10000E+01 volume 0.16960E-02 ppm1 7.396 ppm2 1.547 CV 1
OR { 322}
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OR { 322}
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ASSI { 617}
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3.900 1.900 1.900 peak 617 spectrum 1 weight 0.10000E+01 volume 0.51593E-03 ppm1 7.527 ppm2 4.394 CV 1
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ASSI { 207}
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( segid " " and resid 323 and name HG1%)
3.600 1.600 1.600 peak 207 spectrum 1 weight 0.10000E+01 volume 0.34961E-02 ppm1 7.785 ppm2 0.789 CV 1
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OR { 207}
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OR { 207}
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ASSI { 109}
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2.800 1.000 1.000 peak 109 spectrum 1 weight 0.10000E+01 volume 0.74696E-03 ppm1 6.758 ppm2 0.721 CV 1
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ASSI { 602}
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4.200 2.200 1.800 peak 602 spectrum 1 weight 0.10000E+01 volume 0.16980E-02 ppm1 7.759 ppm2 0.681 CV 1
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ASSI { 647}
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5.200 3.400 0.800 peak 647 spectrum 1 weight 0.10000E+01 volume 0.46587E-03 ppm1 9.046 ppm2 1.936 CV 1
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OR { 647}
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ASSI { 220}
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3.700 1.700 1.700 peak 220 spectrum 1 weight 0.10000E+01 volume 0.17095E-02 ppm1 8.928 ppm2 0.875 CV 1
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ASSI { 3085}
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2.200 0.600 0.600 peak 3085 spectrum 1 weight 0.10000E+01 volume 0.99047E-02 ppm1 6.947 ppm2 1.821 CV 1
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OR { 3085}
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ASSI { 507}
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5.000 3.100 1.000 peak 507 spectrum 1 weight 0.10000E+01 volume 0.73156E-03 ppm1 7.865 ppm2 0.917 CV 1
OR { 507}
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ASSI { 89}
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(( segid " " and resid 298 and name HB3 ))
3.300 1.400 1.400 peak 89 spectrum 1 weight 0.10000E+01 volume 0.30725E-02 ppm1 7.338 ppm2 1.980 CV 1
OR { 89}
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OR { 89}
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ASSI { 772}
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3.900 1.900 1.900 peak 772 spectrum 1 weight 0.10000E+01 volume 0.51787E-03 ppm1 8.436 ppm2 3.282 CV 1
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ASSI { 1607}
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2.500 2.500 3.500 peak 1607 spectrum 1 weight 0.10000E+01 volume 0.13052E-02 ppm1 7.645 ppm2 0.845 CV 1
OR { 1607}
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OR { 1607}
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ASSI { 691}
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5.000 3.100 1.000 peak 691 spectrum 1 weight 0.10000E+01 volume 0.67765E-03 ppm1 7.190 ppm2 0.937 CV 1
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( segid " " and resid 267 and name HD1%)
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ASSI { 623}
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(( segid " " and resid 291 and name HB3 ))
4.200 2.200 1.800 peak 623 spectrum 1 weight 0.10000E+01 volume 0.16248E-02 ppm1 7.818 ppm2 3.080 CV 1
OR { 623}
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ASSI { 679}
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4.200 2.200 1.800 peak 679 spectrum 1 weight 0.10000E+01 volume 0.62184E-03 ppm1 7.000 ppm2 4.429 CV 1
OR { 679}
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OR { 679}
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ASSI { 253}
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5.100 3.300 0.900 peak 253 spectrum 1 weight 0.10000E+01 volume 0.59293E-03 ppm1 7.432 ppm2 3.984 CV 1
OR { 253}
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ASSI { 46}
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4.700 2.800 1.300 peak 46 spectrum 1 weight 0.10000E+01 volume 0.43893E-03 ppm1 8.617 ppm2 2.407 CV 1
OR { 46}
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OR { 46}
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ASSI { 822}
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( segid " " and resid 284 and name HE% )
2.500 0.800 0.800 peak 822 spectrum 1 weight 0.10000E+01 volume 0.13803E-02 ppm1 7.676 ppm2 2.140 CV 1
OR { 822}
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(( segid " " and resid 351 and name HB3 ))
OR { 822}
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(( segid " " and resid 351 and name HG2 ))
ASSI { 25}
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6.000 4.800 0.000 peak 25 spectrum 1 weight 0.10000E+01 volume 0.32920E-03 ppm1 6.868 ppm2 0.614 CV 1
OR { 25}
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( segid " " and resid 253 and name HG2%)
ASSI { 282}
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5.200 3.300 0.800 peak 282 spectrum 1 weight 0.10000E+01 volume 0.62759E-03 ppm1 8.203 ppm2 7.148 CV 1
OR { 282}
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ASSI { 311}
(( segid " " and resid 293 and name H ))
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3.600 1.700 1.700 peak 311 spectrum 1 weight 0.10000E+01 volume 0.11821E-02 ppm1 7.006 ppm2 4.015 CV 1
OR { 311}
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ASSI { 904}
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3.700 3.700 2.300 peak 904 spectrum 1 weight 0.10000E+01 volume 0.57368E-03 ppm1 8.095 ppm2 0.957 CV 1
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ASSI { 701}
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4.600 2.600 1.400 peak 701 spectrum 1 weight 0.10000E+01 volume 0.58718E-03 ppm1 7.110 ppm2 1.260 CV 1
OR { 701}
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ASSI { 481}
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3.200 1.300 1.300 peak 481 spectrum 1 weight 0.10000E+01 volume 0.19925E-02 ppm1 7.545 ppm2 1.642 CV 1
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(( segid " " and resid 392 and name HB3 ))
ASSI { 2830}
(( segid " " and resid 287 and name H ))
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4.200 2.200 1.800 peak 2830 spectrum 1 weight 0.10000E+01 volume 0.10935E-02 ppm1 8.017 ppm2 0.390 CV 1
OR { 2830}
(( segid " " and resid 287 and name H ))
( segid " " and resid 279 and name HD2%)
ASSI { 545}
(( segid " " and resid 365 and name H ))
(( segid " " and resid 367 and name H ))
3.300 1.400 1.400 peak 545 spectrum 1 weight 0.10000E+01 volume 0.14708E-02 ppm1 8.370 ppm2 7.851 CV 1
OR { 545}
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(( segid " " and resid 243 and name H ))
ASSI { 705}
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5.600 3.900 0.400 peak 705 spectrum 1 weight 0.10000E+01 volume 0.25797E-03 ppm1 8.773 ppm2 2.169 CV 1
OR { 705}
(( segid " " and resid 237 and name H ))
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ASSI { 1044}
(( segid " " and resid 310 and name H ))
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3.100 1.200 1.200 peak 1044 spectrum 1 weight 0.10000E+01 volume 0.25085E-02 ppm1 7.065 ppm2 4.185 CV 1
OR { 1044}
(( segid " " and resid 310 and name H ))
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ASSI { 819}
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( segid " " and resid 189 and name HD1%)
4.300 2.300 1.700 peak 819 spectrum 1 weight 0.10000E+01 volume 0.48321E-03 ppm1 8.205 ppm2 0.771 CV 1
OR { 819}
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OR { 819}
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( segid " " and resid 194 and name HD1%)
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(( segid " " and resid 202 and name H ))
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ASSI { 603}
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5.600 4.000 0.400 peak 603 spectrum 1 weight 0.10000E+01 volume 0.39081E-03 ppm1 8.333 ppm2 0.052 CV 1
OR { 603}
(( segid " " and resid 366 and name H ))
(( segid " " and resid 367 and name HB3 ))
ASSI { 672}
(( segid " " and resid 279 and name H ))
(( segid " " and resid 277 and name HB3 ))
3.600 1.600 1.600 peak 672 spectrum 1 weight 0.10000E+01 volume 0.83165E-03 ppm1 9.037 ppm2 1.957 CV 1
OR { 672}
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OR { 672}
(( segid " " and resid 279 and name H ))
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ASSI { 1403}
(( segid " " and resid 355 and name H ))
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2.400 0.700 0.700 peak 1403 spectrum 1 weight 0.10000E+01 volume 0.57696E-02 ppm1 8.076 ppm2 4.020 CV 1
OR { 1403}
(( segid " " and resid 301 and name H ))
(( segid " " and resid 301 and name HA ))
ASSI { 1569}
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(( segid " " and resid 228 and name HA ))
2.800 1.000 1.000 peak 1569 spectrum 1 weight 0.10000E+01 volume 0.13418E-02 ppm1 9.621 ppm2 3.984 CV 1
OR { 1569}
(( segid " " and resid 229 and name H ))
(( segid " " and resid 229 and name HA3 ))
ASSI { 354}
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4.800 2.900 1.200 peak 354 spectrum 1 weight 0.10000E+01 volume 0.78352E-03 ppm1 7.858 ppm2 0.813 CV 1
OR { 354}
(( segid " " and resid 319 and name H ))
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OR { 354}
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ASSI { 732}
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(( segid " " and resid 301 and name HA ))
3.600 1.600 1.600 peak 732 spectrum 1 weight 0.10000E+01 volume 0.16595E-02 ppm1 7.012 ppm2 4.019 CV 1
OR { 732}
(( segid " " and resid 304 and name HE22))
(( segid " " and resid 367 and name HA ))
OR { 732}
(( segid " " and resid 304 and name HE22))
(( segid " " and resid 304 and name HA ))
ASSI { 621}
(( segid " " and resid 349 and name H ))
( segid " " and resid 350 and name HG2%)
3.600 1.700 1.700 peak 621 spectrum 1 weight 0.10000E+01 volume 0.26067E-02 ppm1 7.111 ppm2 0.739 CV 1
OR { 621}
(( segid " " and resid 349 and name H ))
( segid " " and resid 350 and name HG1%)
OR { 621}
(( segid " " and resid 349 and name H ))
( segid " " and resid 346 and name HD2%)
ASSI { 528}
(( segid " " and resid 397 and name H ))
(( segid " " and resid 398 and name HB ))
4.600 2.700 1.400 peak 528 spectrum 1 weight 0.10000E+01 volume 0.73350E-03 ppm1 8.080 ppm2 1.790 CV 1
OR { 528}
(( segid " " and resid 397 and name H ))
(( segid " " and resid 399 and name HB3 ))
ASSI { 120}
(( segid " " and resid 227 and name H ))
(( segid " " and resid 334 and name HG3 ))
5.100 3.200 0.900 peak 120 spectrum 1 weight 0.10000E+01 volume 0.55443E-03 ppm1 7.126 ppm2 2.200 CV 1
OR { 120}
(( segid " " and resid 227 and name H ))
(( segid " " and resid 334 and name HG2 ))
OR { 120}
(( segid " " and resid 227 and name H ))
(( segid " " and resid 220 and name HB ))
ASSI { 981}
(( segid " " and resid 340 and name HE22))
(( segid " " and resid 343 and name HB2 ))
5.800 4.300 0.200 peak 981 spectrum 1 weight 0.10000E+01 volume 0.44662E-03 ppm1 7.419 ppm2 3.874 CV 1
OR { 981}
(( segid " " and resid 340 and name HE22))
(( segid " " and resid 344 and name HA ))
OR { 981}
(( segid " " and resid 340 and name HE22))
(( segid " " and resid 342 and name HA ))
OR { 981}
(( segid " " and resid 340 and name HE22))
(( segid " " and resid 343 and name HB3 ))
ASSI { 514}
(( segid " " and resid 261 and name HD22))
(( segid " " and resid 260 and name HD3 ))
3.400 1.400 1.400 peak 514 spectrum 1 weight 0.10000E+01 volume 0.29070E-03 ppm1 6.630 ppm2 3.830 CV 1
OR { 514}
(( segid " " and resid 261 and name HD22))
(( segid " " and resid 233 and name HA ))
OR { 514}
(( segid " " and resid 261 and name HD22))
(( segid " " and resid 234 and name HB2 ))
OR { 514}
(( segid " " and resid 261 and name HD22))
(( segid " " and resid 234 and name HB3 ))
OR { 514}
(( segid " " and resid 261 and name HD22))
(( segid " " and resid 216 and name HA ))
ASSI { 765}
(( segid " " and resid 325 and name H ))
( segid " " and resid 328 and name HG2%)
4.400 2.400 1.600 peak 765 spectrum 1 weight 0.10000E+01 volume 0.96259E-03 ppm1 8.510 ppm2 0.770 CV 1
OR { 765}
(( segid " " and resid 325 and name H ))
( segid " " and resid 323 and name HG1%)
OR { 765}
(( segid " " and resid 325 and name H ))
( segid " " and resid 346 and name HD2%)
OR { 765}
(( segid " " and resid 325 and name H ))
( segid " " and resid 328 and name HG1%)
ASSI { 473}
(( segid " " and resid 359 and name H ))
(( segid " " and resid 360 and name HB2 ))
4.900 3.000 1.100 peak 473 spectrum 1 weight 0.10000E+01 volume 0.41968E-03 ppm1 7.198 ppm2 2.776 CV 1
OR { 473}
(( segid " " and resid 328 and name H ))
(( segid " " and resid 225 and name HG2 ))
OR { 473}
(( segid " " and resid 359 and name H ))
(( segid " " and resid 291 and name HB2 ))
ASSI { 735}
(( segid " " and resid 214 and name H ))
(( segid " " and resid 209 and name HG ))
4.300 2.300 1.700 peak 735 spectrum 1 weight 0.10000E+01 volume 0.45050E-03 ppm1 7.188 ppm2 0.756 CV 1
OR { 735}
(( segid " " and resid 214 and name H ))
( segid " " and resid 255 and name HD2%)
OR { 735}
(( segid " " and resid 214 and name H ))
( segid " " and resid 263 and name HG2%)
OR { 735}
(( segid " " and resid 214 and name H ))
( segid " " and resid 278 and name HD2%)
ASSI { 349}
(( segid " " and resid 265 and name H ))
(( segid " " and resid 261 and name HB3 ))
3.100 3.100 2.900 peak 349 spectrum 1 weight 0.10000E+01 volume 0.58524E-03 ppm1 7.752 ppm2 3.034 CV 1
OR { 349}
(( segid " " and resid 265 and name H ))
(( segid " " and resid 235 and name HA3 ))
OR { 349}
(( segid " " and resid 265 and name H ))
(( segid " " and resid 217 and name HA ))
ASSI { 846}
(( segid " " and resid 267 and name H ))
( segid " " and resid 266 and name HD1%)
3.700 1.700 1.700 peak 846 spectrum 1 weight 0.10000E+01 volume 0.29320E-02 ppm1 8.066 ppm2 0.913 CV 1
OR { 846}
(( segid " " and resid 267 and name H ))
( segid " " and resid 267 and name HD2%)
OR { 846}
(( segid " " and resid 267 and name H ))
( segid " " and resid 267 and name HD1%)
ASSI { 527}
(( segid " " and resid 397 and name H ))
(( segid " " and resid 392 and name HB2 ))
4.500 2.600 1.500 peak 527 spectrum 1 weight 0.10000E+01 volume 0.60449E-03 ppm1 8.080 ppm2 1.968 CV 1
OR { 527}
(( segid " " and resid 397 and name H ))
(( segid " " and resid 402 and name HB ))
OR { 527}
(( segid " " and resid 397 and name H ))
(( segid " " and resid 439 and name HG ))
OR { 527}
(( segid " " and resid 397 and name H ))
(( segid " " and resid 439 and name HB3 ))
ASSI { 372}
(( segid " " and resid 438 and name H ))
( segid " " and resid 435 and name HG2%)
4.100 2.100 1.900 peak 372 spectrum 1 weight 0.10000E+01 volume 0.11224E-02 ppm1 7.569 ppm2 0.861 CV 1
OR { 372}
(( segid " " and resid 438 and name H ))
( segid " " and resid 439 and name HD1%)
OR { 372}
(( segid " " and resid 438 and name H ))
( segid " " and resid 439 and name HD2%)
OR { 372}
(( segid " " and resid 438 and name H ))
( segid " " and resid 436 and name HD2%)
ASSI { 359}
(( segid " " and resid 324 and name H ))
( segid " " and resid 373 and name HD2%)
3.600 1.600 1.600 peak 359 spectrum 1 weight 0.10000E+01 volume 0.19405E-02 ppm1 8.499 ppm2 0.467 CV 1
OR { 359}
(( segid " " and resid 324 and name H ))
( segid " " and resid 323 and name HG2%)
OR { 359}
(( segid " " and resid 324 and name H ))
(( segid " " and resid 217 and name HG13))
OR { 359}
(( segid " " and resid 324 and name H ))
(( segid " " and resid 373 and name HB2 ))
OR { 359}
(( segid " " and resid 324 and name H ))
( segid " " and resid 217 and name HG2%)
ASSI { 596}
(( segid " " and resid 225 and name H ))
(( segid " " and resid 230 and name HG13))
5.100 3.200 0.900 peak 596 spectrum 1 weight 0.10000E+01 volume 0.30610E-03 ppm1 7.798 ppm2 0.964 CV 1
OR { 596}
(( segid " " and resid 225 and name H ))
( segid " " and resid 230 and name HG2%)
OR { 596}
(( segid " " and resid 225 and name H ))
( segid " " and resid 264 and name HB% )
ASSI { 71}
(( segid " " and resid 335 and name H ))
(( segid " " and resid 332 and name HB3 ))
5.100 3.300 0.900 peak 71 spectrum 1 weight 0.10000E+01 volume 0.24064E-03 ppm1 8.870 ppm2 2.564 CV 1
OR { 71}
(( segid " " and resid 335 and name H ))
(( segid " " and resid 331 and name HB2 ))
OR { 71}
(( segid " " and resid 335 and name H ))
(( segid " " and resid 331 and name HB3 ))
ASSI { 1903}
(( segid " " and resid 403 and name H ))
(( segid " " and resid 402 and name HB ))
2.200 0.600 0.600 peak 1903 spectrum 1 weight 0.10000E+01 volume 0.81127E-02 ppm1 7.553 ppm2 1.896 CV 1
OR { 1903}
(( segid " " and resid 442 and name H ))
(( segid " " and resid 442 and name HB2 ))
OR { 1903}
(( segid " " and resid 403 and name H ))
(( segid " " and resid 403 and name HG3 ))
ASSI { 324}
(( segid " " and resid 359 and name H ))
(( segid " " and resid 358 and name HA ))
3.300 1.400 1.400 peak 324 spectrum 1 weight 0.10000E+01 volume 0.19040E-02 ppm1 7.196 ppm2 4.004 CV 1
OR { 324}
(( segid " " and resid 359 and name H ))
(( segid " " and resid 355 and name HA ))
OR { 324}
(( segid " " and resid 359 and name H ))
(( segid " " and resid 291 and name HA ))
ASSI { 563}
(( segid " " and resid 344 and name H ))
(( segid " " and resid 341 and name HA ))
3.700 1.700 1.700 peak 563 spectrum 1 weight 0.10000E+01 volume 0.90480E-03 ppm1 7.676 ppm2 4.392 CV 1
OR { 563}
(( segid " " and resid 414 and name H ))
(( segid " " and resid 410 and name HA ))
OR { 563}
(( segid " " and resid 414 and name H ))
(( segid " " and resid 415 and name HA ))
ASSI { 272}
(( segid " " and resid 394 and name H ))
(( segid " " and resid 397 and name HA2 ))
3.900 1.900 1.900 peak 272 spectrum 1 weight 0.10000E+01 volume 0.90096E-03 ppm1 7.544 ppm2 3.773 CV 1
OR { 272}
(( segid " " and resid 394 and name H ))
(( segid " " and resid 395 and name HA ))
OR { 272}
(( segid " " and resid 394 and name H ))
(( segid " " and resid 397 and name HA3 ))
ASSI { 38}
(( segid " " and resid 226 and name H ))
(( segid " " and resid 226 and name HG3 ))
3.000 1.100 1.100 peak 38 spectrum 1 weight 0.10000E+01 volume 0.17654E-02 ppm1 7.440 ppm2 1.247 CV 1
OR { 38}
(( segid " " and resid 226 and name H ))
(( segid " " and resid 226 and name HG2 ))
OR { 38}
(( segid " " and resid 226 and name H ))
( segid " " and resid 335 and name HG2%)
ASSI { 148}
(( segid " " and resid 331 and name H ))
(( segid " " and resid 330 and name HA ))
3.500 1.600 1.600 peak 148 spectrum 1 weight 0.10000E+01 volume 0.14612E-02 ppm1 7.180 ppm2 4.141 CV 1
OR { 148}
(( segid " " and resid 331 and name H ))
(( segid " " and resid 332 and name HA ))
ASSI { 670}
(( segid " " and resid 366 and name H ))
(( segid " " and resid 365 and name HB2 ))
2.600 0.900 0.900 peak 670 spectrum 1 weight 0.10000E+01 volume 0.33132E-02 ppm1 8.331 ppm2 1.996 CV 1
OR { 670}
(( segid " " and resid 366 and name H ))
(( segid " " and resid 365 and name HB3 ))
OR { 670}
(( segid " " and resid 315 and name H ))
(( segid " " and resid 310 and name HB3 ))
ASSI { 1294}
(( segid " " and resid 300 and name H ))
(( segid " " and resid 299 and name HA ))
3.000 1.100 1.100 peak 1294 spectrum 1 weight 0.10000E+01 volume 0.21408E-02 ppm1 7.922 ppm2 3.762 CV 1
OR { 1294}
(( segid " " and resid 300 and name H ))
(( segid " " and resid 297 and name HA ))
ASSI { 1694}
(( segid " " and resid 346 and name H ))
(( segid " " and resid 346 and name HA ))
2.700 0.900 0.900 peak 1694 spectrum 1 weight 0.10000E+01 volume 0.22871E-02 ppm1 8.995 ppm2 4.044 CV 1
OR { 1694}
(( segid " " and resid 346 and name H ))
(( segid " " and resid 343 and name HA ))
ASSI { 682}
(( segid " " and resid 269 and name HE22))
( segid " " and resid 190 and name HD% )
5.000 3.100 1.000 peak 682 spectrum 1 weight 0.10000E+01 volume 0.41006E-03 ppm1 6.868 ppm2 7.855 CV 1
OR { 682}
(( segid " " and resid 269 and name HE22))
(( segid " " and resid 268 and name H ))
ASSI { 761}
(( segid " " and resid 295 and name H ))
(( segid " " and resid 296 and name HA ))
4.600 2.600 1.400 peak 761 spectrum 1 weight 0.10000E+01 volume 0.80855E-03 ppm1 7.395 ppm2 3.753 CV 1
OR { 761}
(( segid " " and resid 295 and name H ))
(( segid " " and resid 299 and name HA ))
OR { 761}
(( segid " " and resid 295 and name H ))
(( segid " " and resid 297 and name HA ))
OR { 761}
(( segid " " and resid 295 and name H ))
(( segid " " and resid 292 and name HA2 ))
ASSI { 931}
(( segid " " and resid 299 and name H ))
(( segid " " and resid 299 and name HG3 ))
2.200 0.600 0.600 peak 931 spectrum 1 weight 0.10000E+01 volume 0.33267E-02 ppm1 7.500 ppm2 1.405 CV 1
OR { 931}
(( segid " " and resid 299 and name H ))
(( segid " " and resid 299 and name HB2 ))
OR { 931}
(( segid " " and resid 299 and name H ))
(( segid " " and resid 299 and name HG2 ))
OR { 931}
(( segid " " and resid 305 and name H ))
(( segid " " and resid 308 and name HG3 ))
ASSI { 687}
(( segid " " and resid 432 and name H ))
( segid " " and resid 432 and name HG1%)
2.900 1.000 1.000 peak 687 spectrum 1 weight 0.10000E+01 volume 0.25585E-02 ppm1 8.479 ppm2 1.104 CV 1
OR { 687}
(( segid " " and resid 272 and name H ))
(( segid " " and resid 271 and name HB3 ))
OR { 687}
(( segid " " and resid 432 and name H ))
( segid " " and resid 432 and name HG2%)
ASSI { 356}
(( segid " " and resid 189 and name H ))
( segid " " and resid 189 and name HG2%)
4.600 2.600 1.400 peak 356 spectrum 1 weight 0.10000E+01 volume 0.84705E-03 ppm1 8.894 ppm2 0.946 CV 1
OR { 356}
(( segid " " and resid 215 and name H ))
( segid " " and resid 376 and name HG1%)
OR { 356}
(( segid " " and resid 215 and name H ))
( segid " " and resid 267 and name HD1%)
ASSI { 932}
(( segid " " and resid 269 and name HE21))
( segid " " and resid 190 and name HE% )
4.500 2.500 1.500 peak 932 spectrum 1 weight 0.10000E+01 volume 0.34075E-03 ppm1 8.091 ppm2 7.150 CV 1
OR { 932}
(( segid " " and resid 269 and name HE21))
( segid " " and resid 270 and name HD% )
ASSI { 688}
(( segid " " and resid 361 and name H ))
( segid " " and resid 339 and name HG2%)
4.100 2.100 1.900 peak 688 spectrum 1 weight 0.10000E+01 volume 0.13245E-02 ppm1 8.405 ppm2 0.666 CV 1
OR { 688}
(( segid " " and resid 361 and name H ))
( segid " " and resid 357 and name HD1%)
ASSI { 230}
(( segid " " and resid 365 and name HE22))
( segid " " and resid 323 and name HG2%)
3.100 1.200 1.200 peak 230 spectrum 1 weight 0.10000E+01 volume 0.50631E-03 ppm1 7.588 ppm2 0.421 CV 1
OR { 230}
(( segid " " and resid 365 and name HE22))
( segid " " and resid 371 and name HG1%)
ASSI { 2824}
(( segid " " and resid 216 and name H ))
(( segid " " and resid 213 and name HA ))
3.700 1.700 1.700 peak 2824 spectrum 1 weight 0.10000E+01 volume 0.66418E-03 ppm1 7.638 ppm2 3.578 CV 1
OR { 2824}
(( segid " " and resid 216 and name H ))
(( segid " " and resid 214 and name HA ))
ASSI { 69}
(( segid " " and resid 412 and name H ))
(( segid " " and resid 409 and name HG ))
5.000 3.100 1.000 peak 69 spectrum 1 weight 0.10000E+01 volume 0.36772E-03 ppm1 8.448 ppm2 1.408 CV 1
OR { 69}
(( segid " " and resid 412 and name H ))
(( segid " " and resid 429 and name HG ))
OR { 69}
(( segid " " and resid 412 and name H ))
(( segid " " and resid 429 and name HB2 ))
ASSI { 856}
(( segid " " and resid 266 and name H ))
(( segid " " and resid 266 and name HA ))
3.100 1.200 1.200 peak 856 spectrum 1 weight 0.10000E+01 volume 0.14939E-02 ppm1 8.234 ppm2 4.009 CV 1
OR { 856}
(( segid " " and resid 266 and name H ))
(( segid " " and resid 265 and name HB3 ))
OR { 856}
(( segid " " and resid 266 and name H ))
(( segid " " and resid 265 and name HB2 ))
ASSI { 102}
(( segid " " and resid 356 and name H ))
(( segid " " and resid 355 and name HA ))
3.500 1.600 1.600 peak 102 spectrum 1 weight 0.10000E+01 volume 0.10088E-02 ppm1 7.364 ppm2 4.019 CV 1
OR { 102}
(( segid " " and resid 356 and name H ))
(( segid " " and resid 353 and name HB3 ))
OR { 102}
(( segid " " and resid 356 and name H ))
(( segid " " and resid 353 and name HB2 ))
ASSI { 648}
(( segid " " and resid 186 and name H ))
(( segid " " and resid 187 and name HB2 ))
4.200 2.300 1.800 peak 648 spectrum 1 weight 0.10000E+01 volume 0.13033E-02 ppm1 8.053 ppm2 1.713 CV 1
OR { 648}
(( segid " " and resid 197 and name H ))
(( segid " " and resid 193 and name HB3 ))
OR { 648}
(( segid " " and resid 197 and name H ))
(( segid " " and resid 210 and name HG2 ))
OR { 648}
(( segid " " and resid 186 and name H ))
(( segid " " and resid 187 and name HB3 ))
OR { 648}
(( segid " " and resid 197 and name H ))
(( segid " " and resid 200 and name HG2 ))
OR { 648}
(( segid " " and resid 197 and name H ))
(( segid " " and resid 189 and name HG13))
OR { 648}
(( segid " " and resid 197 and name H ))
(( segid " " and resid 189 and name HG12))
ASSI { 417}
(( segid " " and resid 242 and name H ))
(( segid " " and resid 240 and name HA ))
4.400 2.400 1.600 peak 417 spectrum 1 weight 0.10000E+01 volume 0.56600E-03 ppm1 7.555 ppm2 3.248 CV 1
OR { 417}
(( segid " " and resid 364 and name H ))
(( segid " " and resid 323 and name HA ))
OR { 417}
(( segid " " and resid 242 and name H ))
(( segid " " and resid 244 and name HA ))
OR { 417}
(( segid " " and resid 364 and name H ))
(( segid " " and resid 368 and name HB2 ))
ASSI { 607}
(( segid " " and resid 219 and name H ))
( segid " " and resid 220 and name HG1%)
4.500 2.500 1.500 peak 607 spectrum 1 weight 0.10000E+01 volume 0.10993E-02 ppm1 7.699 ppm2 1.112 CV 1
OR { 607}
(( segid " " and resid 219 and name H ))
(( segid " " and resid 255 and name HB3 ))
OR { 607}
(( segid " " and resid 219 and name H ))
( segid " " and resid 220 and name HG2%)
ASSI { 3128}
(( segid " " and resid 361 and name H ))
( segid " " and resid 361 and name HD% )
3.200 1.300 1.300 peak 3128 spectrum 1 weight 0.10000E+01 volume 0.19598E-02 ppm1 8.403 ppm2 7.118 CV 1
OR { 3128}
(( segid " " and resid 361 and name H ))
( segid " " and resid 360 and name HD% )
ASSI { 127}
(( segid " " and resid 386 and name H ))
( segid " " and resid 385 and name HE% )
3.700 1.700 1.700 peak 127 spectrum 1 weight 0.10000E+01 volume 0.17076E-02 ppm1 7.958 ppm2 1.955 CV 1
OR { 127}
(( segid " " and resid 329 and name H ))
( segid " " and resid 225 and name HE% )
OR { 127}
(( segid " " and resid 329 and name H ))
(( segid " " and resid 332 and name HG3 ))
OR { 127}
(( segid " " and resid 431 and name H ))
(( segid " " and resid 433 and name HB2 ))
ASSI { 1227}
(( segid " " and resid 199 and name H ))
(( segid " " and resid 199 and name HB2 ))
2.300 0.700 0.700 peak 1227 spectrum 1 weight 0.10000E+01 volume 0.46552E-02 ppm1 7.767 ppm2 1.872 CV 1
OR { 1227}
(( segid " " and resid 444 and name H ))
(( segid " " and resid 444 and name HB2 ))
ASSI { 681}
(( segid " " and resid 213 and name H ))
( segid " " and resid 267 and name HD2%)
5.400 3.700 0.600 peak 681 spectrum 1 weight 0.10000E+01 volume 0.34075E-03 ppm1 5.882 ppm2 0.933 CV 1
OR { 681}
(( segid " " and resid 213 and name H ))
( segid " " and resid 267 and name HD1%)
OR { 681}
(( segid " " and resid 213 and name H ))
( segid " " and resid 266 and name HD1%)
OR { 681}
(( segid " " and resid 213 and name H ))
( segid " " and resid 189 and name HG2%)
ASSI { 461}
(( segid " " and resid 225 and name H ))
(( segid " " and resid 227 and name HB2 ))
5.000 3.100 1.000 peak 461 spectrum 1 weight 0.10000E+01 volume 0.30032E-03 ppm1 7.795 ppm2 3.123 CV 1
OR { 461}
(( segid " " and resid 225 and name H ))
(( segid " " and resid 327 and name HB3 ))
OR { 461}
(( segid " " and resid 225 and name H ))
(( segid " " and resid 327 and name HB2 ))
ASSI { 300}
(( segid " " and resid 293 and name HE ))
(( segid " " and resid 298 and name HB2 ))
4.100 2.100 1.900 peak 300 spectrum 1 weight 0.10000E+01 volume 0.35230E-03 ppm1 7.791 ppm2 1.899 CV 1
OR { 300}
(( segid " " and resid 293 and name HE ))
(( segid " " and resid 302 and name HB2 ))
ASSI { 172}
(( segid " " and resid 337 and name H ))
(( segid " " and resid 338 and name HB2 ))
4.800 2.900 1.200 peak 172 spectrum 1 weight 0.10000E+01 volume 0.69884E-03 ppm1 7.313 ppm2 2.840 CV 1
OR { 172}
(( segid " " and resid 337 and name H ))
(( segid " " and resid 341 and name HB3 ))
OR { 172}
(( segid " " and resid 337 and name H ))
(( segid " " and resid 341 and name HB2 ))
ASSI { 654}
(( segid " " and resid 272 and name H ))
(( segid " " and resid 349 and name HA ))
4.400 2.400 1.600 peak 654 spectrum 1 weight 0.10000E+01 volume 0.85093E-03 ppm1 8.494 ppm2 3.976 CV 1
OR { 654}
(( segid " " and resid 272 and name H ))
(( segid " " and resid 274 and name HA ))
ASSI { 709}
(( segid " " and resid 326 and name H ))
( segid " " and resid 328 and name HG2%)
4.200 2.300 1.800 peak 709 spectrum 1 weight 0.10000E+01 volume 0.12090E-02 ppm1 8.931 ppm2 0.786 CV 1
OR { 709}
(( segid " " and resid 326 and name H ))
( segid " " and resid 323 and name HG1%)
OR { 709}
(( segid " " and resid 326 and name H ))
( segid " " and resid 346 and name HD2%)
OR { 709}
(( segid " " and resid 326 and name H ))
( segid " " and resid 328 and name HG1%)
OR { 709}
(( segid " " and resid 326 and name H ))
( segid " " and resid 329 and name HG2%)
ASSI { 771}
(( segid " " and resid 417 and name H ))
(( segid " " and resid 414 and name HA ))
3.300 1.400 1.400 peak 771 spectrum 1 weight 0.10000E+01 volume 0.24007E-02 ppm1 7.757 ppm2 3.968 CV 1
OR { 771}
(( segid " " and resid 430 and name H ))
(( segid " " and resid 427 and name HA ))
OR { 771}
(( segid " " and resid 417 and name H ))
(( segid " " and resid 418 and name HA3 ))
OR { 771}
(( segid " " and resid 417 and name H ))
(( segid " " and resid 418 and name HA2 ))
ASSI { 3029}
(( segid " " and resid 238 and name H ))
(( segid " " and resid 238 and name HB2 ))
2.800 1.000 1.000 peak 3029 spectrum 1 weight 0.10000E+01 volume 0.25778E-02 ppm1 8.664 ppm2 3.848 CV 1
OR { 3029}
(( segid " " and resid 238 and name H ))
(( segid " " and resid 238 and name HB3 ))
OR { 3029}
(( segid " " and resid 238 and name H ))
(( segid " " and resid 237 and name HA ))
ASSI { 130}
(( segid " " and resid 338 and name H ))
(( segid " " and resid 337 and name HB3 ))
2.700 0.900 0.900 peak 130 spectrum 1 weight 0.10000E+01 volume 0.73540E-03 ppm1 7.706 ppm2 1.529 CV 1
OR { 130}
(( segid " " and resid 338 and name H ))
(( segid " " and resid 339 and name HG13))
ASSI { 114}
(( segid " " and resid 266 and name H ))
(( segid " " and resid 263 and name H ))
4.900 2.900 1.100 peak 114 spectrum 1 weight 0.10000E+01 volume 0.30032E-03 ppm1 8.231 ppm2 7.149 CV 1
OR { 114}
(( segid " " and resid 266 and name H ))
( segid " " and resid 190 and name HE% )
OR { 114}
(( segid " " and resid 266 and name H ))
( segid " " and resid 270 and name HD% )
ASSI { 979}
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( segid " " and resid 258 and name HE% )
4.900 3.100 1.100 peak 979 spectrum 1 weight 0.10000E+01 volume 0.49284E-03 ppm1 8.258 ppm2 6.656 CV 1
OR { 979}
(( segid " " and resid 256 and name H ))
( segid " " and resid 223 and name HE% )
ASSI { 2905}
(( segid " " and resid 404 and name H ))
( segid " " and resid 407 and name HE% )
4.800 2.900 1.200 peak 2905 spectrum 1 weight 0.10000E+01 volume 0.71231E-03 ppm1 7.634 ppm2 6.881 CV 1
OR { 2905}
(( segid " " and resid 404 and name H ))
( segid " " and resid 204 and name HE% )
ASSI { 1016}
(( segid " " and resid 246 and name H ))
(( segid " " and resid 246 and name HA ))
2.800 1.000 1.000 peak 1016 spectrum 1 weight 0.10000E+01 volume 0.31149E-02 ppm1 7.447 ppm2 3.856 CV 1
OR { 1016}
(( segid " " and resid 246 and name H ))
(( segid " " and resid 243 and name HA ))
ASSI { 1380}
(( segid " " and resid 191 and name H ))
(( segid " " and resid 190 and name HB3 ))
4.900 3.000 1.100 peak 1380 spectrum 1 weight 0.10000E+01 volume 0.19251E-03 ppm1 9.229 ppm2 3.065 CV 1
OR { 1380}
(( segid " " and resid 191 and name H ))
(( segid " " and resid 275 and name HD3 ))
ASSI { 1198}
(( segid " " and resid 394 and name H ))
(( segid " " and resid 398 and name H ))
3.900 1.900 1.900 peak 1198 spectrum 1 weight 0.10000E+01 volume 0.79893E-03 ppm1 7.545 ppm2 8.695 CV 1
OR { 1198}
(( segid " " and resid 394 and name H ))
(( segid " " and resid 396 and name H ))
ASSI { 13}
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(( segid " " and resid 198 and name HB ))
4.300 2.300 1.700 peak 13 spectrum 1 weight 0.10000E+01 volume 0.95871E-03 ppm1 8.050 ppm2 2.071 CV 1
OR { 13}
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(( segid " " and resid 200 and name HB3 ))
OR { 13}
(( segid " " and resid 197 and name H ))
(( segid " " and resid 200 and name HB2 ))
OR { 13}
(( segid " " and resid 197 and name H ))
(( segid " " and resid 199 and name HB3 ))
ASSI { 2119}
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(( segid " " and resid 214 and name HA ))
3.700 1.700 1.700 peak 2119 spectrum 1 weight 0.10000E+01 volume 0.82780E-03 ppm1 7.493 ppm2 3.574 CV 1
OR { 2119}
(( segid " " and resid 217 and name H ))
(( segid " " and resid 213 and name HA ))
ASSI { 3075}
(( segid " " and resid 295 and name H ))
( segid " " and resid 294 and name HG2%)
2.900 1.100 1.100 peak 3075 spectrum 1 weight 0.10000E+01 volume 0.89423E-02 ppm1 7.396 ppm2 1.199 CV 1
OR { 3075}
(( segid " " and resid 295 and name H ))
( segid " " and resid 295 and name HG2%)
ASSI { 464}
(( segid " " and resid 293 and name H ))
(( segid " " and resid 293 and name HB2 ))
2.500 0.800 0.800 peak 464 spectrum 1 weight 0.10000E+01 volume 0.22043E-02 ppm1 7.004 ppm2 1.711 CV 1
OR { 464}
(( segid " " and resid 293 and name H ))
(( segid " " and resid 293 and name HB3 ))
OR { 464}
(( segid " " and resid 293 and name H ))
(( segid " " and resid 299 and name HB3 ))
ASSI { 83}
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( segid " " and resid 364 and name HG2%)
4.100 2.100 1.900 peak 83 spectrum 1 weight 0.10000E+01 volume 0.12360E-02 ppm1 8.216 ppm2 0.889 CV 1
OR { 83}
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( segid " " and resid 436 and name HD2%)
OR { 83}
(( segid " " and resid 437 and name H ))
( segid " " and resid 435 and name HG2%)
ASSI { 909}
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( segid " " and resid 416 and name HD1%)
3.200 1.300 1.300 peak 909 spectrum 1 weight 0.10000E+01 volume 0.31765E-03 ppm1 6.752 ppm2 0.819 CV 1
OR { 909}
(( segid " " and resid 417 and name HE22))
( segid " " and resid 420 and name HD1%)
ASSI { 97}
(( segid " " and resid 271 and name H ))
(( segid " " and resid 272 and name HG3 ))
4.000 2.000 2.000 peak 97 spectrum 1 weight 0.10000E+01 volume 0.11878E-02 ppm1 7.670 ppm2 1.840 CV 1
OR { 97}
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(( segid " " and resid 268 and name HB3 ))
OR { 97}
(( segid " " and resid 271 and name H ))
(( segid " " and resid 268 and name HB2 ))
OR { 97}
(( segid " " and resid 271 and name H ))
(( segid " " and resid 272 and name HG2 ))
OR { 97}
(( segid " " and resid 271 and name H ))
(( segid " " and resid 272 and name HB2 ))
ASSI { 680}
(( segid " " and resid 358 and name H ))
( segid " " and resid 359 and name HG1%)
3.900 1.900 1.900 peak 680 spectrum 1 weight 0.10000E+01 volume 0.22832E-02 ppm1 8.565 ppm2 0.895 CV 1
OR { 680}
(( segid " " and resid 358 and name H ))
( segid " " and resid 357 and name HD2%)
OR { 680}
(( segid " " and resid 321 and name H ))
( segid " " and resid 321 and name HD1%)
OR { 680}
(( segid " " and resid 321 and name H ))
( segid " " and resid 325 and name HE% )
OR { 680}
(( segid " " and resid 321 and name H ))
( segid " " and resid 364 and name HG2%)
ASSI { 504}
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(( segid " " and resid 278 and name HA ))
4.400 2.400 1.600 peak 504 spectrum 1 weight 0.10000E+01 volume 0.58140E-03 ppm1 8.328 ppm2 3.825 CV 1
OR { 504}
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(( segid " " and resid 314 and name HA ))
ASSI { 242}
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(( segid " " and resid 343 and name HB2 ))
5.300 3.500 0.700 peak 242 spectrum 1 weight 0.10000E+01 volume 0.34268E-03 ppm1 6.785 ppm2 3.888 CV 1
OR { 242}
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(( segid " " and resid 342 and name HA ))
OR { 242}
(( segid " " and resid 340 and name HE21))
(( segid " " and resid 343 and name HB3 ))
OR { 242}
(( segid " " and resid 340 and name HE21))
(( segid " " and resid 344 and name HA ))
ASSI { 1711}
(( segid " " and resid 322 and name H ))
(( segid " " and resid 322 and name HA ))
3.200 1.200 1.200 peak 1711 spectrum 1 weight 0.10000E+01 volume 0.88171E-03 ppm1 8.218 ppm2 3.389 CV 1
OR { 1711}
(( segid " " and resid 322 and name H ))
(( segid " " and resid 318 and name HA ))
ASSI { 784}
(( segid " " and resid 351 and name HE22))
( segid " " and resid 271 and name HD2%)
2.700 0.900 0.900 peak 784 spectrum 1 weight 0.10000E+01 volume 0.96065E-03 ppm1 7.562 ppm2 0.722 CV 1
OR { 784}
(( segid " " and resid 351 and name HE22))
( segid " " and resid 350 and name HG1%)
OR { 784}
(( segid " " and resid 351 and name HE22))
( segid " " and resid 350 and name HG2%)
OR { 784}
(( segid " " and resid 351 and name HE22))
( segid " " and resid 278 and name HD2%)
OR { 784}
(( segid " " and resid 351 and name HE22))
( segid " " and resid 321 and name HD2%)
ASSI { 333}
(( segid " " and resid 289 and name H ))
(( segid " " and resid 287 and name HA ))
4.100 2.100 1.900 peak 333 spectrum 1 weight 0.10000E+01 volume 0.78546E-03 ppm1 7.994 ppm2 3.474 CV 1
OR { 333}
(( segid " " and resid 302 and name H ))
(( segid " " and resid 303 and name HB2 ))
OR { 333}
(( segid " " and resid 400 and name H ))
(( segid " " and resid 398 and name HA ))
OR { 333}
(( segid " " and resid 306 and name H ))
(( segid " " and resid 303 and name HB2 ))
OR { 333}
(( segid " " and resid 306 and name H ))
(( segid " " and resid 287 and name HA ))
ASSI { 153}
(( segid " " and resid 305 and name H ))
(( segid " " and resid 304 and name HG2 ))
4.300 2.300 1.700 peak 153 spectrum 1 weight 0.10000E+01 volume 0.11436E-02 ppm1 7.496 ppm2 2.475 CV 1
OR { 153}
(( segid " " and resid 299 and name H ))
(( segid " " and resid 301 and name HG2 ))
OR { 153}
(( segid " " and resid 299 and name H ))
(( segid " " and resid 296 and name HG3 ))
OR { 153}
(( segid " " and resid 299 and name H ))
(( segid " " and resid 296 and name HG2 ))
ASSI { 2110}
(( segid " " and resid 324 and name H ))
(( segid " " and resid 324 and name HB3 ))
2.700 0.900 0.900 peak 2110 spectrum 1 weight 0.10000E+01 volume 0.18173E-02 ppm1 8.501 ppm2 3.276 CV 1
OR { 2110}
(( segid " " and resid 324 and name H ))
(( segid " " and resid 323 and name HA ))
ASSI { 2709}
(( segid " " and resid 225 and name H ))
(( segid " " and resid 226 and name HB3 ))
4.100 2.100 1.900 peak 2709 spectrum 1 weight 0.10000E+01 volume 0.29108E-02 ppm1 7.796 ppm2 1.952 CV 1
OR { 2709}
(( segid " " and resid 225 and name H ))
( segid " " and resid 225 and name HE% )
ASSI { 948}
(( segid " " and resid 354 and name HD22))
(( segid " " and resid 355 and name H ))
6.000 4.700 0.000 peak 948 spectrum 1 weight 0.10000E+01 volume 0.19636E-03 ppm1 6.456 ppm2 8.090 CV 1
OR { 948}
(( segid " " and resid 354 and name HD22))
(( segid " " and resid 357 and name H ))
ASSI { 179}
(( segid " " and resid 291 and name H ))
( segid " " and resid 356 and name HG2%)
5.000 3.100 1.000 peak 179 spectrum 1 weight 0.10000E+01 volume 0.38118E-03 ppm1 7.362 ppm2 0.388 CV 1
OR { 179}
(( segid " " and resid 291 and name H ))
( segid " " and resid 306 and name HD1%)
ASSI { 639}
(( segid " " and resid 273 and name H ))
(( segid " " and resid 270 and name HA ))
3.500 1.500 1.500 peak 639 spectrum 1 weight 0.10000E+01 volume 0.11917E-02 ppm1 7.704 ppm2 3.667 CV 1
OR { 639}
(( segid " " and resid 273 and name H ))
(( segid " " and resid 271 and name HA ))
OR { 639}
(( segid " " and resid 273 and name H ))
(( segid " " and resid 190 and name HA ))
ASSI { 749}
(( segid " " and resid 224 and name H ))
(( segid " " and resid 225 and name HA ))
5.500 3.800 0.500 peak 749 spectrum 1 weight 0.10000E+01 volume 0.22717E-03 ppm1 9.054 ppm2 4.361 CV 1
OR { 749}
(( segid " " and resid 224 and name H ))
(( segid " " and resid 260 and name HA ))
OR { 749}
(( segid " " and resid 224 and name H ))
(( segid " " and resid 226 and name HA ))
ASSI { 407}
(( segid " " and resid 346 and name H ))
(( segid " " and resid 344 and name HB ))
5.100 3.200 0.900 peak 407 spectrum 1 weight 0.10000E+01 volume 0.46781E-03 ppm1 8.995 ppm2 1.921 CV 1
OR { 407}
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(( segid " " and resid 348 and name HG3 ))
OR { 407}
(( segid " " and resid 346 and name H ))
(( segid " " and resid 348 and name HB2 ))
ASSI { 227}
(( segid " " and resid 314 and name H ))
(( segid " " and resid 317 and name HB2 ))
4.300 2.400 1.700 peak 227 spectrum 1 weight 0.10000E+01 volume 0.96259E-03 ppm1 7.341 ppm2 1.369 CV 1
OR { 227}
(( segid " " and resid 314 and name H ))
(( segid " " and resid 310 and name HB2 ))
OR { 227}
(( segid " " and resid 314 and name H ))
(( segid " " and resid 194 and name HG ))
OR { 227}
(( segid " " and resid 314 and name H ))
(( segid " " and resid 208 and name HB2 ))
ASSI { 2036}
(( segid " " and resid 318 and name H ))
(( segid " " and resid 318 and name HB ))
2.600 0.800 0.800 peak 2036 spectrum 1 weight 0.10000E+01 volume 0.31515E-02 ppm1 8.048 ppm2 1.368 CV 1
OR { 2036}
(( segid " " and resid 318 and name H ))
(( segid " " and resid 317 and name HB2 ))
ASSI { 351}
(( segid " " and resid 334 and name H ))
(( segid " " and resid 332 and name HB2 ))
4.800 2.900 1.200 peak 351 spectrum 1 weight 0.10000E+01 volume 0.56984E-03 ppm1 8.128 ppm2 1.826 CV 1
OR { 351}
(( segid " " and resid 334 and name H ))
(( segid " " and resid 337 and name HG2 ))
OR { 351}
(( segid " " and resid 334 and name H ))
( segid " " and resid 337 and name HE% )
ASSI { 93}
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(( segid " " and resid 429 and name HG ))
3.300 1.400 1.400 peak 93 spectrum 1 weight 0.10000E+01 volume 0.11628E-02 ppm1 6.976 ppm2 1.410 CV 1
OR { 93}
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(( segid " " and resid 409 and name HG ))
OR { 93}
(( segid " " and resid 433 and name HE21))
(( segid " " and resid 429 and name HB2 ))
ASSI { 383}
(( segid " " and resid 398 and name H ))
(( segid " " and resid 400 and name HG2 ))
5.000 3.100 1.000 peak 383 spectrum 1 weight 0.10000E+01 volume 0.48706E-03 ppm1 8.681 ppm2 2.309 CV 1
OR { 383}
(( segid " " and resid 398 and name H ))
(( segid " " and resid 401 and name HG3 ))
OR { 383}
(( segid " " and resid 398 and name H ))
(( segid " " and resid 401 and name HG2 ))
OR { 383}
(( segid " " and resid 398 and name H ))
(( segid " " and resid 395 and name HG2 ))
ASSI { 2414}
(( segid " " and resid 359 and name H ))
(( segid " " and resid 359 and name HA ))
2.900 1.000 1.000 peak 2414 spectrum 1 weight 0.10000E+01 volume 0.25489E-02 ppm1 7.197 ppm2 3.308 CV 1
OR { 2414}
(( segid " " and resid 359 and name H ))
(( segid " " and resid 358 and name HB2 ))
ASSI { 2323}
(( segid " " and resid 293 and name H ))
(( segid " " and resid 295 and name H ))
4.100 2.100 1.900 peak 2323 spectrum 1 weight 0.10000E+01 volume 0.12263E-02 ppm1 7.003 ppm2 7.379 CV 1
OR { 2323}
(( segid " " and resid 293 and name H ))
(( segid " " and resid 291 and name H ))
ASSI { 2969}
(( segid " " and resid 197 and name H ))
(( segid " " and resid 196 and name HB3 ))
3.300 1.400 1.400 peak 2969 spectrum 1 weight 0.10000E+01 volume 0.23660E-02 ppm1 8.053 ppm2 2.754 CV 1
OR { 2969}
(( segid " " and resid 186 and name H ))
(( segid " " and resid 185 and name HB2 ))
ASSI { 598}
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(( segid " " and resid 415 and name HB2 ))
4.400 2.400 1.600 peak 598 spectrum 1 weight 0.10000E+01 volume 0.54290E-03 ppm1 8.479 ppm2 2.794 CV 1
OR { 598}
(( segid " " and resid 413 and name H ))
(( segid " " and resid 410 and name HB2 ))
ASSI { 64}
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(( segid " " and resid 225 and name H ))
4.900 2.900 1.100 peak 64 spectrum 1 weight 0.10000E+01 volume 0.25203E-03 ppm1 7.245 ppm2 7.753 CV 1
OR { 64}
(( segid " " and resid 222 and name H ))
(( segid " " and resid 219 and name H ))
ASSI { 77}
(( segid " " and resid 434 and name H ))
(( segid " " and resid 432 and name H ))
3.700 1.700 1.700 peak 77 spectrum 1 weight 0.10000E+01 volume 0.89691E-03 ppm1 7.983 ppm2 8.472 CV 1
OR { 77}
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(( segid " " and resid 413 and name H ))
OR { 77}
(( segid " " and resid 415 and name H ))
(( segid " " and resid 412 and name H ))
ASSI { 80}
(( segid " " and resid 291 and name H ))
(( segid " " and resid 289 and name H ))
4.600 2.600 1.400 peak 80 spectrum 1 weight 0.10000E+01 volume 0.24924E-03 ppm1 7.358 ppm2 7.976 CV 1
OR { 80}
(( segid " " and resid 291 and name H ))
(( segid " " and resid 287 and name H ))
OR { 80}
(( segid " " and resid 291 and name H ))
(( segid " " and resid 302 and name H ))
OR { 80}
(( segid " " and resid 291 and name H ))
(( segid " " and resid 300 and name H ))
ASSI { 478}
(( segid " " and resid 316 and name H ))
(( segid " " and resid 317 and name H ))
2.400 0.700 0.700 peak 478 spectrum 1 weight 0.10000E+01 volume 0.14890E-02 ppm1 8.704 ppm2 7.529 CV 1
OR { 478}
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(( segid " " and resid 403 and name H ))
ASSI { 391}
(( segid " " and resid 197 and name H ))
(( segid " " and resid 198 and name H ))
3.100 1.200 1.200 peak 391 spectrum 1 weight 0.10000E+01 volume 0.95529E-03 ppm1 8.053 ppm2 8.579 CV 1
OR { 391}
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(( segid " " and resid 187 and name H ))
ASSI { 51}
(( segid " " and resid 272 and name H ))
(( segid " " and resid 273 and name H ))
2.200 0.600 0.600 peak 51 spectrum 1 weight 0.10000E+01 volume 0.21728E-02 ppm1 8.496 ppm2 7.686 CV 1
OR { 51}
(( segid " " and resid 272 and name H ))
(( segid " " and resid 271 and name H ))
ASSI { 72}
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(( segid " " and resid 270 and name H ))
4.600 2.600 1.400 peak 72 spectrum 1 weight 0.10000E+01 volume 0.27056E-03 ppm1 8.055 ppm2 8.508 CV 1
OR { 72}
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(( segid " " and resid 264 and name H ))
OR { 72}
(( segid " " and resid 267 and name H ))
(( segid " " and resid 272 and name H ))
ASSI { 443}
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(( segid " " and resid 324 and name H ))
2.600 0.800 0.800 peak 443 spectrum 1 weight 0.10000E+01 volume 0.92377E-03 ppm1 7.759 ppm2 8.490 CV 1
OR { 443}
(( segid " " and resid 323 and name H ))
(( segid " " and resid 325 and name H ))
ASSI { 377}
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(( segid " " and resid 415 and name H ))
4.200 2.200 1.800 peak 377 spectrum 1 weight 0.10000E+01 volume 0.60506E-03 ppm1 8.486 ppm2 7.966 CV 1
OR { 377}
(( segid " " and resid 413 and name H ))
(( segid " " and resid 416 and name H ))
ASSI { 401}
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(( segid " " and resid 361 and name H ))
3.800 1.800 1.800 peak 401 spectrum 1 weight 0.10000E+01 volume 0.75144E-03 ppm1 7.280 ppm2 8.363 CV 1
OR { 401}
(( segid " " and resid 363 and name H ))
(( segid " " and resid 365 and name H ))
OR { 401}
(( segid " " and resid 363 and name H ))
(( segid " " and resid 366 and name H ))
ASSI { 40}
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(( segid " " and resid 289 and name H ))
2.700 0.900 0.900 peak 40 spectrum 1 weight 0.10000E+01 volume 0.17002E-02 ppm1 7.813 ppm2 7.986 CV 1
OR { 40}
(( segid " " and resid 290 and name H ))
(( segid " " and resid 287 and name H ))
OR { 40}
(( segid " " and resid 290 and name H ))
(( segid " " and resid 302 and name H ))
ASSI { 46}
(( segid " " and resid 288 and name H ))
(( segid " " and resid 290 and name H ))
4.600 2.700 1.400 peak 46 spectrum 1 weight 0.10000E+01 volume 0.54019E-03 ppm1 7.463 ppm2 7.807 CV 1
OR { 46}
(( segid " " and resid 288 and name H ))
(( segid " " and resid 292 and name H ))
ASSI { 119}
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(( segid " " and resid 360 and name H ))
2.600 0.800 0.800 peak 119 spectrum 1 weight 0.10000E+01 volume 0.14992E-02 ppm1 8.377 ppm2 7.270 CV 1
OR { 119}
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(( segid " " and resid 363 and name H ))
ASSI { 168}
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(( segid " " and resid 280 and name H ))
2.100 0.500 0.500 peak 168 spectrum 1 weight 0.10000E+01 volume 0.19365E-02 ppm1 9.021 ppm2 7.656 CV 1
OR { 168}
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(( segid " " and resid 277 and name HD21))
ASSI { 75}
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(( segid " " and resid 264 and name H ))
2.500 0.800 0.800 peak 75 spectrum 1 weight 0.10000E+01 volume 0.18318E-02 ppm1 7.110 ppm2 8.493 CV 1
OR { 75}
(( segid " " and resid 263 and name H ))
(( segid " " and resid 259 and name H ))
ASSI { 86}
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(( segid " " and resid 246 and name H ))
2.700 0.900 0.900 peak 86 spectrum 1 weight 0.10000E+01 volume 0.14630E-02 ppm1 8.424 ppm2 7.488 CV 1
OR { 86}
(( segid " " and resid 247 and name H ))
(( segid " " and resid 245 and name H ))
ASSI { 34}
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(( segid " " and resid 264 and name H ))
4.300 2.300 1.700 peak 34 spectrum 1 weight 0.10000E+01 volume 0.50775E-03 ppm1 8.229 ppm2 8.508 CV 1
OR { 34}
(( segid " " and resid 266 and name H ))
(( segid " " and resid 270 and name H ))
OR { 34}
(( segid " " and resid 266 and name H ))
(( segid " " and resid 244 and name H ))
ASSI { 17}
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(( segid " " and resid 317 and name H ))
3.900 1.900 1.900 peak 17 spectrum 1 weight 0.10000E+01 volume 0.61987E-03 ppm1 8.311 ppm2 7.503 CV 1
OR { 17}
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(( segid " " and resid 364 and name H ))
OR { 17}
(( segid " " and resid 366 and name H ))
(( segid " " and resid 371 and name H ))
ASSI { 480}
(( segid " " and resid 317 and name H ))
(( segid " " and resid 316 and name H ))
2.300 0.700 0.700 peak 480 spectrum 1 weight 0.10000E+01 volume 0.20820E-02 ppm1 7.502 ppm2 8.696 CV 1
OR { 480}
(( segid " " and resid 305 and name H ))
(( segid " " and resid 304 and name H ))
ASSI { 76}
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(( segid " " and resid 428 and name H ))
2.500 0.800 0.800 peak 76 spectrum 1 weight 0.10000E+01 volume 0.21227E-02 ppm1 8.041 ppm2 7.737 CV 1
OR { 76}
(( segid " " and resid 427 and name H ))
(( segid " " and resid 425 and name H ))
OR { 76}
(( segid " " and resid 427 and name H ))
(( segid " " and resid 430 and name H ))
ASSI { 108}
(( segid " " and resid 306 and name H ))
(( segid " " and resid 308 and name H ))
4.000 2.000 2.000 peak 108 spectrum 1 weight 0.10000E+01 volume 0.46605E-03 ppm1 8.012 ppm2 7.091 CV 1
OR { 108}
(( segid " " and resid 306 and name H ))
(( segid " " and resid 310 and name H ))
ASSI { 59}
(( segid " " and resid 351 and name H ))
(( segid " " and resid 352 and name H ))
2.500 0.800 0.800 peak 59 spectrum 1 weight 0.10000E+01 volume 0.21153E-02 ppm1 7.885 ppm2 7.073 CV 1
OR { 59}
(( segid " " and resid 351 and name H ))
(( segid " " and resid 349 and name H ))
ASSI { 84}
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(( segid " " and resid 340 and name H ))
2.700 0.900 0.900 peak 84 spectrum 1 weight 0.10000E+01 volume 0.17188E-02 ppm1 8.516 ppm2 8.140 CV 1
OR { 84}
(( segid " " and resid 341 and name H ))
(( segid " " and resid 343 and name H ))
ASSI { 5}
(( segid " " and resid 398 and name H ))
(( segid " " and resid 394 and name H ))
4.800 2.800 1.200 peak 5 spectrum 1 weight 0.10000E+01 volume 0.19643E-03 ppm1 8.675 ppm2 7.549 CV 1
OR { 5}
(( segid " " and resid 398 and name H ))
(( segid " " and resid 403 and name H ))
OR { 5}
(( segid " " and resid 398 and name H ))
(( segid " " and resid 442 and name H ))
ASSI { 283}
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(( segid " " and resid 218 and name H ))
2.200 0.600 0.600 peak 283 spectrum 1 weight 0.10000E+01 volume 0.25425E-02 ppm1 7.488 ppm2 7.961 CV 1
OR { 283}
(( segid " " and resid 299 and name H ))
(( segid " " and resid 300 and name H ))
ASSI { 228}
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2.400 0.700 0.700 peak 228 spectrum 1 weight 0.10000E+01 volume 0.14427E-02 ppm1 8.012 ppm2 7.452 CV 1
OR { 228}
(( segid " " and resid 287 and name H ))
(( segid " " and resid 288 and name H ))
ASSI { 73}
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(( segid " " and resid 307 and name H ))
4.200 2.200 1.800 peak 73 spectrum 1 weight 0.10000E+01 volume 0.27889E-03 ppm1 7.486 ppm2 8.721 CV 1
OR { 73}
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(( segid " " and resid 316 and name H ))
ASSI { 374}
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(( segid " " and resid 437 and name H ))
4.100 2.100 1.900 peak 374 spectrum 1 weight 0.10000E+01 volume 0.50405E-03 ppm1 8.767 ppm2 8.207 CV 1
OR { 374}
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(( segid " " and resid 391 and name H ))
ASSI { 111}
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(( segid " " and resid 272 and name H ))
2.300 0.700 0.700 peak 111 spectrum 1 weight 0.10000E+01 volume 0.20459E-02 ppm1 7.664 ppm2 8.513 CV 1
OR { 111}
(( segid " " and resid 271 and name H ))
(( segid " " and resid 270 and name H ))
ASSI { 495}
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(( segid " " and resid 288 and name H ))
2.600 0.800 0.800 peak 495 spectrum 1 weight 0.10000E+01 volume 0.15390E-02 ppm1 8.011 ppm2 7.492 CV 1
OR { 495}
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(( segid " " and resid 305 and name H ))
ASSI { 44}
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(( segid " " and resid 428 and name H ))
2.300 0.700 0.700 peak 44 spectrum 1 weight 0.10000E+01 volume 0.23840E-02 ppm1 8.104 ppm2 7.743 CV 1
OR { 44}
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(( segid " " and resid 430 and name H ))
ASSI { 55}
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(( segid " " and resid 431 and name H ))
2.300 0.600 0.600 peak 55 spectrum 1 weight 0.10000E+01 volume 0.40075E-02 ppm1 7.761 ppm2 7.951 CV 1
OR { 55}
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(( segid " " and resid 416 and name H ))
OR { 55}
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(( segid " " and resid 415 and name H ))
OR { 55}
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(( segid " " and resid 419 and name H ))
ASSI { 61}
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(( segid " " and resid 264 and name H ))
4.000 2.000 2.000 peak 61 spectrum 1 weight 0.10000E+01 volume 0.55038E-03 ppm1 7.879 ppm2 8.478 CV 1
OR { 61}
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(( segid " " and resid 259 and name H ))
ASSI { 62}
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(( segid " " and resid 402 and name H ))
2.500 0.800 0.800 peak 62 spectrum 1 weight 0.10000E+01 volume 0.20801E-02 ppm1 7.790 ppm2 8.707 CV 1
OR { 62}
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(( segid " " and resid 409 and name H ))
OR { 62}
(( segid " " and resid 401 and name H ))
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ASSI { 474}
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2.300 0.700 0.700 peak 474 spectrum 1 weight 0.10000E+01 volume 0.24637E-02 ppm1 8.923 ppm2 8.209 CV 1
OR { 474}
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(( segid " " and resid 435 and name H ))
ASSI { 224}
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(( segid " " and resid 302 and name H ))
3.500 1.500 1.500 peak 224 spectrum 1 weight 0.10000E+01 volume 0.85615E-03 ppm1 8.666 ppm2 7.997 CV 1
OR { 224}
(( segid " " and resid 304 and name H ))
(( segid " " and resid 306 and name H ))
ASSI { 125}
(( segid " " and resid 307 and name H ))
(( segid " " and resid 305 and name H ))
3.600 1.600 1.600 peak 125 spectrum 1 weight 0.10000E+01 volume 0.72366E-03 ppm1 8.721 ppm2 7.484 CV 1
OR { 125}
(( segid " " and resid 307 and name H ))
(( segid " " and resid 309 and name H ))
ASSI { 41}
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(( segid " " and resid 340 and name H ))
4.900 3.000 1.100 peak 41 spectrum 1 weight 0.10000E+01 volume 0.33819E-03 ppm1 7.760 ppm2 8.157 CV 1
OR { 41}
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(( segid " " and resid 343 and name H ))
ASSI { 29}
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(( segid " " and resid 404 and name H ))
4.000 2.000 2.000 peak 29 spectrum 1 weight 0.10000E+01 volume 0.50218E-03 ppm1 9.256 ppm2 7.611 CV 1
OR { 29}
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(( segid " " and resid 403 and name H ))
OR { 29}
(( segid " " and resid 406 and name H ))
(( segid " " and resid 438 and name H ))
ASSI { 13}
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(( segid " " and resid 298 and name H ))
4.400 2.400 1.600 peak 13 spectrum 1 weight 0.10000E+01 volume 0.79498E-03 ppm1 7.918 ppm2 7.330 CV 1
OR { 13}
(( segid " " and resid 300 and name H ))
(( segid " " and resid 301 and name HE22))
ASSI { 100}
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(( segid " " and resid 367 and name H ))
3.700 1.700 1.700 peak 100 spectrum 1 weight 0.10000E+01 volume 0.79868E-03 ppm1 8.355 ppm2 7.842 CV 1
OR { 100}
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(( segid " " and resid 407 and name H ))
OR { 100}
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(( segid " " and resid 243 and name H ))
OR { 100}
(( segid " " and resid 405 and name H ))
(( segid " " and resid 410 and name H ))
ASSI { 441}
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(( segid " " and resid 333 and name H ))
2.600 0.800 0.800 peak 441 spectrum 1 weight 0.10000E+01 volume 0.95342E-03 ppm1 7.431 ppm2 8.622 CV 1
OR { 441}
(( segid " " and resid 332 and name H ))
(( segid " " and resid 330 and name H ))
ASSI { 30}
(( segid " " and resid 301 and name H ))
(( segid " " and resid 303 and name H ))
4.100 2.100 1.900 peak 30 spectrum 1 weight 0.10000E+01 volume 0.41232E-03 ppm1 8.055 ppm2 8.729 CV 1
OR { 30}
(( segid " " and resid 301 and name H ))
(( segid " " and resid 304 and name H ))
ASSI { 101}
(( segid " " and resid 404 and name H ))
(( segid " " and resid 402 and name H ))
3.800 1.800 1.800 peak 101 spectrum 1 weight 0.10000E+01 volume 0.73476E-03 ppm1 7.625 ppm2 8.739 CV 1
OR { 101}
(( segid " " and resid 441 and name H ))
(( segid " " and resid 439 and name H ))
OR { 101}
(( segid " " and resid 404 and name H ))
(( segid " " and resid 409 and name H ))
ASSI { 19}
(( segid " " and resid 431 and name H ))
(( segid " " and resid 430 and name H ))
2.800 1.000 1.000 peak 19 spectrum 1 weight 0.10000E+01 volume 0.88950E-03 ppm1 7.965 ppm2 7.764 CV 1
OR { 19}
(( segid " " and resid 431 and name H ))
(( segid " " and resid 428 and name H ))
ASSI { 81}
(( segid " " and resid 440 and name H ))
(( segid " " and resid 441 and name H ))
2.600 0.800 0.800 peak 81 spectrum 1 weight 0.10000E+01 volume 0.19986E-02 ppm1 8.428 ppm2 7.596 CV 1
OR { 81}
(( segid " " and resid 440 and name H ))
(( segid " " and resid 438 and name H ))
OR { 81}
(( segid " " and resid 440 and name H ))
(( segid " " and resid 442 and name H ))
OR { 81}
(( segid " " and resid 440 and name H ))
(( segid " " and resid 443 and name H ))
ASSI { 12}
(( segid " " and resid 401 and name H ))
(( segid " " and resid 399 and name H ))
3.700 1.700 1.700 peak 12 spectrum 1 weight 0.10000E+01 volume 0.82833E-03 ppm1 7.792 ppm2 8.331 CV 1
OR { 12}
(( segid " " and resid 407 and name H ))
(( segid " " and resid 405 and name H ))
OR { 12}
(( segid " " and resid 401 and name H ))
(( segid " " and resid 405 and name H ))
ASSI { 48}
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(( segid " " and resid 271 and name H ))
4.100 2.100 1.900 peak 48 spectrum 1 weight 0.10000E+01 volume 0.54019E-03 ppm1 8.191 ppm2 7.670 CV 1
OR { 48}
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(( segid " " and resid 273 and name H ))
ASSI { 70}
(( segid " " and resid 264 and name H ))
(( segid " " and resid 266 and name H ))
4.300 2.400 1.700 peak 70 spectrum 1 weight 0.10000E+01 volume 0.41048E-03 ppm1 8.494 ppm2 8.218 CV 1
OR { 70}
(( segid " " and resid 264 and name H ))
(( segid " " and resid 269 and name H ))
ASSI { 10}
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(( segid " " and resid 217 and name H ))
4.700 2.800 1.300 peak 10 spectrum 1 weight 0.10000E+01 volume 0.30021E-03 ppm1 7.706 ppm2 7.474 CV 1
OR { 10}
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(( segid " " and resid 375 and name HE22))
OR { 10}
(( segid " " and resid 219 and name H ))
(( segid " " and resid 257 and name H ))
OR { 10}
(( segid " " and resid 219 and name H ))
(( segid " " and resid 254 and name HD21))
ASSI { 25}
(( segid " " and resid 258 and name H ))
(( segid " " and resid 257 and name H ))
2.200 0.600 0.600 peak 25 spectrum 1 weight 0.10000E+01 volume 0.16669E-02 ppm1 8.139 ppm2 7.444 CV 1
OR { 25}
(( segid " " and resid 258 and name H ))
(( segid " " and resid 254 and name HD21))
ASSI { 57}
(( segid " " and resid 327 and name H ))
(( segid " " and resid 326 and name H ))
2.800 1.000 1.000 peak 57 spectrum 1 weight 0.10000E+01 volume 0.91175E-03 ppm1 7.612 ppm2 8.909 CV 1
OR { 57}
(( segid " " and resid 216 and name H ))
(( segid " " and resid 215 and name H ))
ASSI { 43}
(( segid " " and resid 410 and name H ))
(( segid " " and resid 411 and name H ))
2.700 0.900 0.900 peak 43 spectrum 1 weight 0.10000E+01 volume 0.16446E-02 ppm1 7.885 ppm2 7.719 CV 1
OR { 43}
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(( segid " " and resid 369 and name H ))
OR { 43}
(( segid " " and resid 410 and name H ))
(( segid " " and resid 414 and name H ))
ASSI { 37}
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(( segid " " and resid 283 and name H ))
5.100 3.300 0.900 peak 37 spectrum 1 weight 0.10000E+01 volume 0.24832E-03 ppm1 7.651 ppm2 7.333 CV 1
OR { 37}
(( segid " " and resid 280 and name H ))
(( segid " " and resid 314 and name HD21))
OR { 37}
(( segid " " and resid 280 and name H ))
(( segid " " and resid 314 and name H ))
ASSI { 212}
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(( segid " " and resid 350 and name H ))
2.500 0.800 0.800 peak 212 spectrum 1 weight 0.10000E+01 volume 0.16928E-02 ppm1 7.885 ppm2 7.615 CV 1
OR { 212}
(( segid " " and resid 351 and name H ))
(( segid " " and resid 351 and name HE22))
ASSI { 426}
(( segid " " and resid 306 and name H ))
(( segid " " and resid 307 and name H ))
2.300 0.700 0.700 peak 426 spectrum 1 weight 0.10000E+01 volume 0.16085E-02 ppm1 8.011 ppm2 8.723 CV 1
OR { 426}
(( segid " " and resid 302 and name H ))
(( segid " " and resid 303 and name H ))
OR { 426}
(( segid " " and resid 306 and name H ))
(( segid " " and resid 303 and name H ))
ASSI { 31}
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(( segid " " and resid 401 and name H ))
3.900 1.900 1.900 peak 31 spectrum 1 weight 0.10000E+01 volume 0.91637E-03 ppm1 7.551 ppm2 7.796 CV 1
OR { 31}
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(( segid " " and resid 444 and name H ))
OR { 31}
(( segid " " and resid 403 and name H ))
(( segid " " and resid 407 and name H ))
ASSI { 96}
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(( segid " " and resid 327 and name H ))
4.800 2.900 1.200 peak 96 spectrum 1 weight 0.10000E+01 volume 0.24739E-03 ppm1 8.491 ppm2 7.578 CV 1
OR { 96}
(( segid " " and resid 325 and name H ))
(( segid " " and resid 365 and name HE22))
OR { 96}
(( segid " " and resid 325 and name H ))
(( segid " " and resid 364 and name H ))
ASSI { 23}
(( segid " " and resid 350 and name H ))
(( segid " " and resid 349 and name H ))
2.600 0.800 0.800 peak 23 spectrum 1 weight 0.10000E+01 volume 0.15826E-02 ppm1 7.617 ppm2 7.088 CV 1
OR { 23}
(( segid " " and resid 350 and name H ))
(( segid " " and resid 352 and name H ))
ASSI { 505}
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(( segid " " and resid 185 and name HD22))
5.200 3.400 0.800 peak 505 spectrum 1 weight 0.10000E+01 volume 0.18531E-03 ppm1 8.056 ppm2 7.605 CV 1
OR { 505}
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(( segid " " and resid 200 and name H ))
ASSI { 49}
(( segid " " and resid 339 and name H ))
(( segid " " and resid 340 and name H ))
2.500 0.800 0.800 peak 49 spectrum 1 weight 0.10000E+01 volume 0.14121E-02 ppm1 8.360 ppm2 8.136 CV 1
OR { 49}
(( segid " " and resid 339 and name H ))
(( segid " " and resid 343 and name H ))
ASSI { 9}
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(( segid " " and resid 269 and name H ))
2.400 0.700 0.700 peak 9 spectrum 1 weight 0.10000E+01 volume 0.16706E-02 ppm1 7.865 ppm2 8.204 CV 1
OR { 9}
(( segid " " and resid 268 and name H ))
(( segid " " and resid 266 and name H ))
ASSI { 355}
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(( segid " " and resid 200 and name H ))
2.200 0.600 0.600 peak 355 spectrum 1 weight 0.10000E+01 volume 0.33431E-02 ppm1 7.772 ppm2 7.613 CV 1
OR { 355}
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(( segid " " and resid 443 and name H ))
ASSI { 28}
(( segid " " and resid 301 and name H ))
(( segid " " and resid 299 and name H ))
3.600 1.700 1.700 peak 28 spectrum 1 weight 0.10000E+01 volume 0.61246E-03 ppm1 8.053 ppm2 7.483 CV 1
OR { 28}
(( segid " " and resid 301 and name H ))
(( segid " " and resid 305 and name H ))
ASSI { 4}
(( segid " " and resid 305 and name H ))
(( segid " " and resid 308 and name H ))
6.000 4.500 0.000 peak 4 spectrum 1 weight 0.10000E+01 volume 0.17697E-03 ppm1 7.491 ppm2 7.060 CV 1
OR { 4}
(( segid " " and resid 305 and name H ))
(( segid " " and resid 304 and name HE22))
ASSI { 82}
(( segid " " and resid 289 and name H ))
(( segid " " and resid 290 and name H ))
2.200 0.600 0.600 peak 82 spectrum 1 weight 0.10000E+01 volume 0.51089E-02 ppm1 7.980 ppm2 7.790 CV 1
OR { 82}
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(( segid " " and resid 425 and name H ))
OR { 82}
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(( segid " " and resid 401 and name H ))
OR { 82}
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(( segid " " and resid 428 and name H ))
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(( segid " " and resid 417 and name H ))
OR { 82}
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(( segid " " and resid 292 and name H ))
OR { 82}
(( segid " " and resid 302 and name H ))
(( segid " " and resid 290 and name H ))
ASSI { 78}
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(( segid " " and resid 223 and name H ))
3.900 1.900 1.900 peak 78 spectrum 1 weight 0.10000E+01 volume 0.50775E-03 ppm1 7.787 ppm2 8.421 CV 1
OR { 78}
(( segid " " and resid 225 and name H ))
(( segid " " and resid 228 and name H ))
ASSI { 68}
(( segid " " and resid 399 and name H ))
(( segid " " and resid 398 and name H ))
2.400 0.700 0.700 peak 68 spectrum 1 weight 0.10000E+01 volume 0.26073E-02 ppm1 8.320 ppm2 8.685 CV 1
OR { 68}
(( segid " " and resid 315 and name H ))
(( segid " " and resid 316 and name H ))
OR { 68}
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(( segid " " and resid 402 and name H ))
ASSI { 21}
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(( segid " " and resid 262 and name H ))
3.900 1.900 1.900 peak 21 spectrum 1 weight 0.10000E+01 volume 0.60132E-03 ppm1 8.493 ppm2 7.879 CV 1
OR { 21}
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(( segid " " and resid 268 and name H ))
ASSI { 53}
(( segid " " and resid 241 and name H ))
(( segid " " and resid 240 and name H ))
2.700 0.900 0.900 peak 53 spectrum 1 weight 0.10000E+01 volume 0.14955E-02 ppm1 8.367 ppm2 8.000 CV 1
OR { 53}
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(( segid " " and resid 329 and name H ))
ASSI { 161}
(( segid " " and resid 330 and name H ))
(( segid " " and resid 332 and name H ))
3.700 1.700 1.700 peak 161 spectrum 1 weight 0.10000E+01 volume 0.82371E-03 ppm1 8.605 ppm2 7.438 CV 1
OR { 161}
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(( segid " " and resid 257 and name H ))
ASSI { 327}
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(( segid " " and resid 396 and name H ))
2.600 0.900 0.900 peak 327 spectrum 1 weight 0.10000E+01 volume 0.17614E-02 ppm1 8.072 ppm2 8.676 CV 1
OR { 327}
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(( segid " " and resid 398 and name H ))
ASSI { 93}
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(( segid " " and resid 280 and name H ))
3.800 1.800 1.800 peak 93 spectrum 1 weight 0.10000E+01 volume 0.57446E-03 ppm1 10.043 ppm2 7.658 CV 1
OR { 93}
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(( segid " " and resid 277 and name HD21))
ASSI { 107}
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(( segid " " and resid 287 and name H ))
2.300 0.700 0.700 peak 107 spectrum 1 weight 0.10000E+01 volume 0.24702E-02 ppm1 7.444 ppm2 7.988 CV 1
OR { 107}
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(( segid " " and resid 289 and name H ))
OR { 107}
(( segid " " and resid 288 and name H ))
(( segid " " and resid 287 and name H ))
OR { 107}
(( segid " " and resid 286 and name H ))
(( segid " " and resid 289 and name H ))
ASSI { 39}
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(( segid " " and resid 270 and name H ))
4.300 2.300 1.700 peak 39 spectrum 1 weight 0.10000E+01 volume 0.36877E-03 ppm1 7.859 ppm2 8.530 CV 1
OR { 39}
(( segid " " and resid 268 and name H ))
(( segid " " and resid 272 and name H ))
ASSI { 90}
(( segid " " and resid 342 and name H ))
(( segid " " and resid 343 and name H ))
2.600 0.900 0.900 peak 90 spectrum 1 weight 0.10000E+01 volume 0.90339E-03 ppm1 8.655 ppm2 8.159 CV 1
OR { 90}
(( segid " " and resid 342 and name H ))
(( segid " " and resid 340 and name H ))
ASSI { 948}
(( segid " " and resid 398 and name HG12))
( segid " " and resid 398 and name HG2%)
3.700 1.700 1.700 peak 948 spectrum 1 weight 0.10000E+01 volume 0.47084E-03 ppm1 0.561 ppm2 0.802 CV 1
OR { 948}
(( segid " " and resid 398 and name HG12))
( segid " " and resid 439 and name HD1%)
OR { 948}
(( segid " " and resid 398 and name HG12))
( segid " " and resid 443 and name HD1%)
ASSI { 452}
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(( segid " " and resid 322 and name H ))
3.900 1.900 1.900 peak 452 spectrum 1 weight 0.10000E+01 volume 0.17255E-02 ppm1 0.434 ppm2 8.225 CV 1
OR { 452}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 368 and name H ))
OR { 452}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 373 and name H ))
ASSI { 4609}
( segid " " and resid 352 and name HD1%)
( segid " " and resid 279 and name HD2%)
1.900 0.400 0.400 peak 4609 spectrum 1 weight 0.10000E+01 volume 0.10973E-01 ppm1 0.604 ppm2 0.376 CV 1
OR { 4609}
( segid " " and resid 352 and name HD1%)
( segid " " and resid 356 and name HG2%)
ASSI { 13}
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(( segid " " and resid 340 and name HG3 ))
3.800 1.800 1.800 peak 13 spectrum 1 weight 0.10000E+01 volume 0.13928E-02 ppm1 1.671 ppm2 2.357 CV 1
OR { 13}
(( segid " " and resid 344 and name HG12))
(( segid " " and resid 340 and name HG2 ))
OR { 13}
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(( segid " " and resid 282 and name HG2 ))
OR { 13}
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(( segid " " and resid 285 and name HB2 ))
ASSI { 1702}
( segid " " and resid 329 and name HD1%)
(( segid " " and resid 339 and name HG13))
3.400 1.400 1.400 peak 1702 spectrum 1 weight 0.10000E+01 volume 0.37498E-02 ppm1 0.118 ppm2 1.539 CV 1
OR { 1702}
( segid " " and resid 329 and name HD1%)
(( segid " " and resid 339 and name HB ))
OR { 1702}
( segid " " and resid 329 and name HD1%)
( segid " " and resid 330 and name HB% )
ASSI { 904}
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(( segid " " and resid 324 and name HD2 ))
3.600 1.600 1.600 peak 904 spectrum 1 weight 0.10000E+01 volume 0.18580E-02 ppm1 -0.195 ppm2 7.150 CV 1
OR { 904}
( segid " " and resid 373 and name HD1%)
( segid " " and resid 213 and name HE% )
ASSI { 1520}
( segid " " and resid 284 and name HE% )
( segid " " and resid 352 and name HG2%)
3.400 1.500 1.500 peak 1520 spectrum 1 weight 0.10000E+01 volume 0.77196E-02 ppm1 2.151 ppm2 0.906 CV 1
OR { 1520}
( segid " " and resid 284 and name HE% )
( segid " " and resid 357 and name HD2%)
ASSI { 1462}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 314 and name HB2 ))
3.000 1.100 1.100 peak 1462 spectrum 1 weight 0.10000E+01 volume 0.74153E-03 ppm1 0.348 ppm2 2.819 CV 1
OR { 1462}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 314 and name HB3 ))
OR { 1462}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 360 and name HB2 ))
OR { 1462}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 326 and name HB2 ))
ASSI { 755}
(( segid " " and resid 360 and name HZ ))
(( segid " " and resid 318 and name HB ))
3.200 3.200 2.800 peak 755 spectrum 1 weight 0.10000E+01 volume 0.29605E-03 ppm1 6.602 ppm2 1.337 CV 1
OR { 755}
(( segid " " and resid 360 and name HZ ))
(( segid " " and resid 322 and name HB ))
OR { 755}
(( segid " " and resid 360 and name HZ ))
(( segid " " and resid 306 and name HG ))
ASSI { 1259}
( segid " " and resid 321 and name HD2%)
(( segid " " and resid 318 and name HA ))
3.200 1.300 1.300 peak 1259 spectrum 1 weight 0.10000E+01 volume 0.31296E-02 ppm1 0.663 ppm2 3.365 CV 1
OR { 1259}
( segid " " and resid 278 and name HD1%)
(( segid " " and resid 318 and name HA ))
OR { 1259}
( segid " " and resid 321 and name HD2%)
(( segid " " and resid 322 and name HA ))
ASSI { 935}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 286 and name H ))
3.800 1.800 1.800 peak 935 spectrum 1 weight 0.10000E+01 volume 0.13082E-02 ppm1 2.585 ppm2 7.454 CV 1
OR { 935}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 286 and name H ))
OR { 935}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 288 and name H ))
OR { 935}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 288 and name H ))
ASSI { 391}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 321 and name HB2 ))
3.800 1.800 1.800 peak 391 spectrum 1 weight 0.10000E+01 volume 0.19595E-02 ppm1 -0.046 ppm2 1.928 CV 1
OR { 391}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 221 and name HB3 ))
OR { 391}
( segid " " and resid 217 and name HD1%)
( segid " " and resid 225 and name HE% )
OR { 391}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 375 and name HB2 ))
ASSI { 2599}
(( segid " " and resid 380 and name HB2 ))
( segid " " and resid 380 and name HD1%)
2.700 0.900 0.900 peak 2599 spectrum 1 weight 0.10000E+01 volume 0.57939E-02 ppm1 1.204 ppm2 0.758 CV 1
OR { 2599}
(( segid " " and resid 380 and name HB2 ))
( segid " " and resid 380 and name HD2%)
OR { 2599}
(( segid " " and resid 278 and name HB2 ))
( segid " " and resid 278 and name HD2%)
ASSI { 1181}
(( segid " " and resid 318 and name HG13))
(( segid " " and resid 368 and name HZ ))
4.700 2.700 1.300 peak 1181 spectrum 1 weight 0.10000E+01 volume 0.30169E-03 ppm1 0.608 ppm2 6.309 CV 1
OR { 1181}
(( segid " " and resid 318 and name HG13))
( segid " " and resid 287 and name HD% )
OR { 1181}
(( segid " " and resid 318 and name HG13))
(( segid " " and resid 213 and name HZ ))
ASSI { 547}
(( segid " " and resid 320 and name HD1 ))
( segid " " and resid 371 and name HG2%)
5.000 3.100 1.000 peak 547 spectrum 1 weight 0.10000E+01 volume 0.30169E-03 ppm1 7.255 ppm2 0.955 CV 1
OR { 547}
(( segid " " and resid 320 and name HD1 ))
( segid " " and resid 364 and name HG2%)
OR { 547}
(( segid " " and resid 320 and name HD1 ))
(( segid " " and resid 318 and name HG12))
ASSI { 1295}
(( segid " " and resid 430 and name HA ))
(( segid " " and resid 431 and name H ))
4.100 2.100 1.900 peak 1295 spectrum 1 weight 0.10000E+01 volume 0.42011E-03 ppm1 4.389 ppm2 7.960 CV 1
OR { 1295}
(( segid " " and resid 430 and name HA ))
(( segid " " and resid 434 and name H ))
ASSI { 1130}
(( segid " " and resid 422 and name HB2 ))
( segid " " and resid 420 and name HG2%)
3.300 1.400 1.400 peak 1130 spectrum 1 weight 0.10000E+01 volume 0.14633E-02 ppm1 2.422 ppm2 0.828 CV 1
OR { 1130}
(( segid " " and resid 422 and name HB2 ))
( segid " " and resid 416 and name HD1%)
OR { 1130}
(( segid " " and resid 422 and name HB2 ))
( segid " " and resid 423 and name HD2%)
OR { 1130}
(( segid " " and resid 422 and name HB2 ))
( segid " " and resid 423 and name HD1%)
ASSI { 47}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 214 and name HB3 ))
4.800 2.900 1.200 peak 47 spectrum 1 weight 0.10000E+01 volume 0.48776E-03 ppm1 0.890 ppm2 2.023 CV 1
OR { 47}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 376 and name HB ))
OR { 47}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 198 and name HB ))
ASSI { 1600}
( segid " " and resid 368 and name HE% )
( segid " " and resid 318 and name HG2%)
3.500 1.500 1.500 peak 1600 spectrum 1 weight 0.10000E+01 volume 0.13167E-02 ppm1 6.753 ppm2 0.379 CV 1
OR { 1600}
( segid " " and resid 368 and name HE% )
( segid " " and resid 323 and name HG2%)
ASSI { 177}
( segid " " and resid 211 and name HB% )
( segid " " and resid 189 and name HD1%)
3.700 1.700 1.700 peak 177 spectrum 1 weight 0.10000E+01 volume 0.10742E-02 ppm1 1.684 ppm2 0.754 CV 1
OR { 177}
( segid " " and resid 211 and name HB% )
( segid " " and resid 255 and name HD2%)
OR { 177}
( segid " " and resid 211 and name HB% )
(( segid " " and resid 209 and name HG ))
OR { 177}
( segid " " and resid 211 and name HB% )
( segid " " and resid 274 and name HD2%)
ASSI { 342}
( segid " " and resid 436 and name HD2%)
(( segid " " and resid 407 and name H ))
3.200 3.200 2.800 peak 342 spectrum 1 weight 0.10000E+01 volume 0.47648E-03 ppm1 0.855 ppm2 7.784 CV 1
OR { 342}
( segid " " and resid 436 and name HD2%)
(( segid " " and resid 444 and name H ))
OR { 342}
( segid " " and resid 436 and name HD2%)
(( segid " " and resid 395 and name HE21))
ASSI { 1547}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 440 and name HD3 ))
2.600 0.800 0.800 peak 1547 spectrum 1 weight 0.10000E+01 volume 0.63383E-02 ppm1 0.704 ppm2 1.618 CV 1
OR { 1547}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 443 and name HB2 ))
OR { 1547}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 443 and name HG ))
OR { 1547}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 399 and name HD3 ))
OR { 1547}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 440 and name HD2 ))
OR { 1547}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 443 and name HB3 ))
OR { 1547}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 399 and name HD2 ))
OR { 1547}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 436 and name HG ))
ASSI { 712}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 198 and name HA ))
4.100 2.100 1.900 peak 712 spectrum 1 weight 0.10000E+01 volume 0.81201E-03 ppm1 1.453 ppm2 2.868 CV 1
OR { 712}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 210 and name HD3 ))
OR { 712}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 313 and name HB2 ))
OR { 712}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 313 and name HB3 ))
ASSI { 2283}
(( segid " " and resid 415 and name HB3 ))
(( segid " " and resid 415 and name H ))
3.600 1.600 1.600 peak 2283 spectrum 1 weight 0.10000E+01 volume 0.11955E-02 ppm1 2.586 ppm2 7.961 CV 1
OR { 2283}
(( segid " " and resid 415 and name HB3 ))
(( segid " " and resid 416 and name H ))
ASSI { 1192}
( segid " " and resid 278 and name HD1%)
(( segid " " and resid 350 and name HA ))
3.800 1.800 1.800 peak 1192 spectrum 1 weight 0.10000E+01 volume 0.85996E-03 ppm1 0.658 ppm2 4.530 CV 1
OR { 1192}
( segid " " and resid 278 and name HD1%)
(( segid " " and resid 277 and name HA ))
ASSI { 4567}
(( segid " " and resid 412 and name HB3 ))
(( segid " " and resid 413 and name H ))
4.700 2.800 1.300 peak 4567 spectrum 1 weight 0.10000E+01 volume 0.24812E-03 ppm1 1.866 ppm2 8.452 CV 1
OR { 4567}
(( segid " " and resid 412 and name HB3 ))
(( segid " " and resid 412 and name H ))
ASSI { 1312}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 277 and name HD21))
2.900 2.900 3.100 peak 1312 spectrum 1 weight 0.10000E+01 volume 0.67384E-03 ppm1 0.605 ppm2 7.626 CV 1
OR { 1312}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 350 and name H ))
OR { 1312}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 280 and name H ))
ASSI { 1373}
( segid " " and resid 436 and name HD2%)
(( segid " " and resid 405 and name H ))
2.600 2.600 3.400 peak 1373 spectrum 1 weight 0.10000E+01 volume 0.10968E-02 ppm1 0.855 ppm2 8.313 CV 1
OR { 1373}
( segid " " and resid 436 and name HD2%)
(( segid " " and resid 433 and name H ))
ASSI { 381}
(( segid " " and resid 272 and name HD3 ))
(( segid " " and resid 349 and name HB ))
3.800 1.900 1.900 peak 381 spectrum 1 weight 0.10000E+01 volume 0.86278E-03 ppm1 3.229 ppm2 4.427 CV 1
OR { 381}
(( segid " " and resid 268 and name HE2 ))
(( segid " " and resid 349 and name HB ))
OR { 381}
(( segid " " and resid 272 and name HD2 ))
(( segid " " and resid 349 and name HB ))
ASSI { 1545}
( segid " " and resid 345 and name HG1%)
( segid " " and resid 337 and name HE% )
2.100 2.100 3.900 peak 1545 spectrum 1 weight 0.10000E+01 volume 0.10424E-01 ppm1 1.009 ppm2 1.802 CV 1
OR { 1545}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 357 and name HG ))
OR { 1545}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 357 and name HB3 ))
ASSI { 980}
(( segid " " and resid 331 and name HB2 ))
( segid " " and resid 335 and name HG2%)
4.600 2.600 1.400 peak 980 spectrum 1 weight 0.10000E+01 volume 0.50469E-03 ppm1 2.533 ppm2 1.248 CV 1
OR { 980}
(( segid " " and resid 331 and name HB2 ))
(( segid " " and resid 226 and name HG2 ))
OR { 980}
(( segid " " and resid 331 and name HB2 ))
(( segid " " and resid 226 and name HG3 ))
ASSI { 1351}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 303 and name HA ))
4.300 2.300 1.700 peak 1351 spectrum 1 weight 0.10000E+01 volume 0.16776E-02 ppm1 0.380 ppm2 3.822 CV 1
OR { 1351}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 305 and name HA ))
ASSI { 4473}
(( segid " " and resid 368 and name HB2 ))
( segid " " and resid 323 and name HG2%)
4.300 2.300 1.700 peak 4473 spectrum 1 weight 0.10000E+01 volume 0.32988E-03 ppm1 3.268 ppm2 0.413 CV 1
OR { 4473}
(( segid " " and resid 368 and name HB2 ))
( segid " " and resid 371 and name HG1%)
ASSI { 593}
( segid " " and resid 212 and name HG2%)
( segid " " and resid 270 and name HD% )
3.600 1.600 1.600 peak 593 spectrum 1 weight 0.10000E+01 volume 0.15789E-02 ppm1 -0.167 ppm2 7.145 CV 1
OR { 593}
( segid " " and resid 212 and name HG2%)
( segid " " and resid 190 and name HE% )
OR { 593}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 214 and name H ))
ASSI { 264}
(( segid " " and resid 239 and name HD2 ))
( segid " " and resid 236 and name HG2%)
3.000 3.000 3.000 peak 264 spectrum 1 weight 0.10000E+01 volume 0.18383E-02 ppm1 1.755 ppm2 0.977 CV 1
OR { 264}
(( segid " " and resid 239 and name HD2 ))
( segid " " and resid 240 and name HG1%)
ASSI { 1045}
(( segid " " and resid 429 and name HG ))
(( segid " " and resid 430 and name H ))
4.200 2.200 1.800 peak 1045 spectrum 1 weight 0.10000E+01 volume 0.93325E-03 ppm1 1.391 ppm2 7.760 CV 1
OR { 1045}
(( segid " " and resid 429 and name HG ))
(( segid " " and resid 428 and name H ))
ASSI { 274}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 283 and name HG ))
1.800 0.400 0.400 peak 274 spectrum 1 weight 0.10000E+01 volume 0.17937E-01 ppm1 0.906 ppm2 1.575 CV 1
OR { 274}
( segid " " and resid 267 and name HD2%)
(( segid " " and resid 267 and name HB2 ))
ASSI { 4034}
( segid " " and resid 233 and name HG1%)
(( segid " " and resid 233 and name HA ))
2.500 0.800 0.800 peak 4034 spectrum 1 weight 0.10000E+01 volume 0.71869E-02 ppm1 0.907 ppm2 3.875 CV 1
OR { 4034}
( segid " " and resid 376 and name HG2%)
(( segid " " and resid 376 and name HA ))
ASSI { 1271}
( segid " " and resid 230 and name HD1%)
(( segid " " and resid 220 and name HA ))
4.600 2.700 1.400 peak 1271 spectrum 1 weight 0.10000E+01 volume 0.61465E-03 ppm1 0.648 ppm2 3.275 CV 1
OR { 1271}
( segid " " and resid 339 and name HD1%)
(( segid " " and resid 358 and name HB2 ))
OR { 1271}
( segid " " and resid 339 and name HD1%)
(( segid " " and resid 359 and name HA ))
ASSI { 1443}
(( segid " " and resid 361 and name HZ ))
(( segid " " and resid 325 and name HB2 ))
4.600 2.700 1.400 peak 1443 spectrum 1 weight 0.10000E+01 volume 0.31860E-03 ppm1 6.614 ppm2 1.708 CV 1
OR { 1443}
(( segid " " and resid 361 and name HZ ))
(( segid " " and resid 342 and name HB ))
OR { 1443}
(( segid " " and resid 361 and name HZ ))
(( segid " " and resid 346 and name HB2 ))
OR { 1443}
(( segid " " and resid 361 and name HZ ))
(( segid " " and resid 346 and name HG ))
ASSI { 1517}
(( segid " " and resid 305 and name HD2 ))
(( segid " " and resid 302 and name HG2 ))
3.500 1.500 1.500 peak 1517 spectrum 1 weight 0.10000E+01 volume 0.21090E-02 ppm1 3.143 ppm2 2.228 CV 1
OR { 1517}
(( segid " " and resid 305 and name HD2 ))
(( segid " " and resid 304 and name HB2 ))
OR { 1517}
(( segid " " and resid 444 and name HD3 ))
(( segid " " and resid 445 and name HG3 ))
OR { 1517}
(( segid " " and resid 444 and name HD3 ))
(( segid " " and resid 445 and name HG2 ))
OR { 1517}
(( segid " " and resid 444 and name HD2 ))
(( segid " " and resid 445 and name HG3 ))
ASSI { 680}
( segid " " and resid 412 and name HD2%)
(( segid " " and resid 409 and name H ))
2.900 2.900 3.100 peak 680 spectrum 1 weight 0.10000E+01 volume 0.65978E-03 ppm1 0.641 ppm2 8.731 CV 1
OR { 680}
( segid " " and resid 429 and name HD2%)
(( segid " " and resid 409 and name H ))
OR { 680}
( segid " " and resid 429 and name HD2%)
(( segid " " and resid 439 and name H ))
ASSI { 1250}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 342 and name HA ))
3.100 1.200 1.200 peak 1250 spectrum 1 weight 0.10000E+01 volume 0.41249E-02 ppm1 1.803 ppm2 3.902 CV 1
OR { 1250}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 329 and name HA ))
OR { 1250}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 343 and name HB2 ))
OR { 1250}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 343 and name HB3 ))
ASSI { 801}
(( segid " " and resid 267 and name HA ))
( segid " " and resid 212 and name HG2%)
4.200 2.200 1.800 peak 801 spectrum 1 weight 0.10000E+01 volume 0.65696E-03 ppm1 3.993 ppm2 -0.158 CV 1
OR { 801}
(( segid " " and resid 321 and name HA ))
( segid " " and resid 322 and name HD1%)
OR { 801}
(( segid " " and resid 321 and name HA ))
( segid " " and resid 373 and name HD1%)
ASSI { 3345}
(( segid " " and resid 231 and name HB2 ))
( segid " " and resid 345 and name HG2%)
3.500 1.500 1.500 peak 3345 spectrum 1 weight 0.10000E+01 volume 0.75846E-03 ppm1 2.811 ppm2 0.941 CV 1
OR { 3345}
(( segid " " and resid 231 and name HB3 ))
( segid " " and resid 230 and name HG2%)
OR { 3345}
(( segid " " and resid 231 and name HB3 ))
( segid " " and resid 345 and name HG2%)
OR { 3345}
(( segid " " and resid 231 and name HB2 ))
( segid " " and resid 230 and name HG2%)
ASSI { 978}
(( segid " " and resid 426 and name HG2 ))
(( segid " " and resid 425 and name H ))
5.300 3.500 0.700 peak 978 spectrum 1 weight 0.10000E+01 volume 0.74435E-03 ppm1 2.255 ppm2 7.745 CV 1
OR { 978}
(( segid " " and resid 426 and name HG2 ))
(( segid " " and resid 428 and name H ))
OR { 978}
(( segid " " and resid 426 and name HG2 ))
(( segid " " and resid 430 and name H ))
ASSI { 1164}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 366 and name HG2 ))
3.400 1.400 1.400 peak 1164 spectrum 1 weight 0.10000E+01 volume 0.28843E-02 ppm1 0.075 ppm2 2.272 CV 1
OR { 1164}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 366 and name HG3 ))
OR { 1164}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 304 and name HG3 ))
OR { 1164}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 301 and name HG3 ))
ASSI { 1630}
( segid " " and resid 212 and name HG1%)
(( segid " " and resid 213 and name HB2 ))
4.000 2.000 2.000 peak 1630 spectrum 1 weight 0.10000E+01 volume 0.82893E-03 ppm1 -0.343 ppm2 2.237 CV 1
OR { 1630}
( segid " " and resid 212 and name HG1%)
(( segid " " and resid 267 and name HB3 ))
OR { 1630}
( segid " " and resid 212 and name HG1%)
( segid " " and resid 203 and name HE% )
OR { 1630}
( segid " " and resid 212 and name HG1%)
(( segid " " and resid 189 and name HB ))
ASSI { 809}
( segid " " and resid 339 and name HD1%)
(( segid " " and resid 358 and name HA ))
3.600 1.600 1.600 peak 809 spectrum 1 weight 0.10000E+01 volume 0.26277E-02 ppm1 0.645 ppm2 4.033 CV 1
OR { 809}
( segid " " and resid 339 and name HD1%)
(( segid " " and resid 340 and name HA ))
ASSI { 3349}
(( segid " " and resid 415 and name HB2 ))
(( segid " " and resid 415 and name H ))
3.200 1.300 1.300 peak 3349 spectrum 1 weight 0.10000E+01 volume 0.98117E-03 ppm1 2.755 ppm2 7.961 CV 1
OR { 3349}
(( segid " " and resid 415 and name HB2 ))
(( segid " " and resid 416 and name H ))
ASSI { 2770}
(( segid " " and resid 395 and name HB3 ))
(( segid " " and resid 395 and name HG2 ))
2.200 0.600 0.600 peak 2770 spectrum 1 weight 0.10000E+01 volume 0.11216E-01 ppm1 2.047 ppm2 2.314 CV 1
OR { 2770}
(( segid " " and resid 340 and name HB3 ))
(( segid " " and resid 340 and name HG2 ))
OR { 2770}
(( segid " " and resid 395 and name HB2 ))
(( segid " " and resid 395 and name HG2 ))
OR { 2770}
(( segid " " and resid 340 and name HB3 ))
(( segid " " and resid 340 and name HG3 ))
ASSI { 1082}
(( segid " " and resid 324 and name HE1 ))
( segid " " and resid 225 and name HE% )
4.100 2.100 1.900 peak 1082 spectrum 1 weight 0.10000E+01 volume 0.52443E-03 ppm1 7.249 ppm2 1.909 CV 1
OR { 1082}
(( segid " " and resid 324 and name HE1 ))
(( segid " " and resid 221 and name HB3 ))
ASSI { 1615}
(( segid " " and resid 222 and name HE2 ))
(( segid " " and resid 222 and name HB3 ))
2.200 0.600 0.600 peak 1615 spectrum 1 weight 0.10000E+01 volume 0.51992E-02 ppm1 2.683 ppm2 0.804 CV 1
OR { 1615}
(( segid " " and resid 222 and name HE3 ))
(( segid " " and resid 222 and name HB3 ))
OR { 1615}
(( segid " " and resid 422 and name HB3 ))
( segid " " and resid 420 and name HG2%)
ASSI { 4398}
(( segid " " and resid 285 and name HG3 ))
(( segid " " and resid 285 and name HD2 ))
2.500 0.800 0.800 peak 4398 spectrum 1 weight 0.10000E+01 volume 0.41954E-02 ppm1 1.961 ppm2 3.563 CV 1
OR { 4398}
(( segid " " and resid 348 and name HG3 ))
(( segid " " and resid 348 and name HD2 ))
OR { 4398}
(( segid " " and resid 285 and name HG2 ))
(( segid " " and resid 285 and name HD2 ))
ASSI { 1112}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 325 and name HG2 ))
4.500 2.500 1.500 peak 1112 spectrum 1 weight 0.10000E+01 volume 0.10263E-02 ppm1 -0.163 ppm2 2.406 CV 1
OR { 1112}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 365 and name HG2 ))
OR { 1112}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 365 and name HG3 ))
ASSI { 251}
(( segid " " and resid 285 and name HD3 ))
(( segid " " and resid 284 and name HB3 ))
2.100 0.600 0.600 peak 251 spectrum 1 weight 0.10000E+01 volume 0.44352E-02 ppm1 3.666 ppm2 2.216 CV 1
OR { 251}
(( segid " " and resid 285 and name HD3 ))
(( segid " " and resid 284 and name HB2 ))
OR { 251}
(( segid " " and resid 184 and name HD2 ))
(( segid " " and resid 184 and name HB2 ))
ASSI { 1294}
(( segid " " and resid 318 and name HB ))
(( segid " " and resid 317 and name HA ))
5.200 3.400 0.800 peak 1294 spectrum 1 weight 0.10000E+01 volume 0.36652E-03 ppm1 1.367 ppm2 3.137 CV 1
OR { 1294}
(( segid " " and resid 318 and name HB ))
(( segid " " and resid 319 and name HB3 ))
ASSI { 253}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 303 and name H ))
5.200 3.300 0.800 peak 253 spectrum 1 weight 0.10000E+01 volume 0.71051E-03 ppm1 0.076 ppm2 8.695 CV 1
OR { 253}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 304 and name H ))
ASSI { 3205}
( segid " " and resid 322 and name HD1%)
( segid " " and resid 360 and name HD% )
2.800 1.000 1.000 peak 3205 spectrum 1 weight 0.10000E+01 volume 0.61944E-02 ppm1 -0.166 ppm2 7.079 CV 1
OR { 3205}
( segid " " and resid 322 and name HD1%)
( segid " " and resid 361 and name HE% )
OR { 3205}
( segid " " and resid 322 and name HD1%)
( segid " " and resid 360 and name HE% )
ASSI { 416}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 279 and name HA ))
3.500 3.500 2.500 peak 416 spectrum 1 weight 0.10000E+01 volume 0.84021E-03 ppm1 0.351 ppm2 4.273 CV 1
OR { 416}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 360 and name HA ))
OR { 416}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 361 and name HA ))
ASSI { 636}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 270 and name HB3 ))
4.600 2.600 1.400 peak 636 spectrum 1 weight 0.10000E+01 volume 0.47930E-03 ppm1 -0.167 ppm2 2.603 CV 1
OR { 636}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 215 and name HG3 ))
ASSI { 540}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 214 and name HB3 ))
3.900 1.900 1.900 peak 540 spectrum 1 weight 0.10000E+01 volume 0.14802E-02 ppm1 0.463 ppm2 2.028 CV 1
OR { 540}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 221 and name HG2 ))
OR { 540}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 376 and name HB ))
OR { 540}
( segid " " and resid 207 and name HG2%)
(( segid " " and resid 214 and name HB3 ))
ASSI { 622}
( segid " " and resid 220 and name HG1%)
(( segid " " and resid 220 and name H ))
2.400 0.700 0.700 peak 622 spectrum 1 weight 0.10000E+01 volume 0.48269E-02 ppm1 1.116 ppm2 8.687 CV 1
OR { 622}
( segid " " and resid 220 and name HG1%)
(( segid " " and resid 221 and name H ))
OR { 622}
( segid " " and resid 220 and name HG2%)
(( segid " " and resid 220 and name H ))
OR { 622}
( segid " " and resid 220 and name HG2%)
(( segid " " and resid 221 and name H ))
ASSI { 1039}
( segid " " and resid 316 and name HD1%)
(( segid " " and resid 317 and name HA ))
3.700 1.700 1.700 peak 1039 spectrum 1 weight 0.10000E+01 volume 0.26926E-02 ppm1 0.819 ppm2 3.098 CV 1
OR { 1039}
( segid " " and resid 316 and name HD1%)
(( segid " " and resid 319 and name HB3 ))
ASSI { 609}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 368 and name HB3 ))
4.400 2.500 1.600 peak 609 spectrum 1 weight 0.10000E+01 volume 0.60055E-03 ppm1 0.440 ppm2 2.682 CV 1
OR { 609}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 326 and name HB3 ))
ASSI { 1966}
( segid " " and resid 303 and name HE% )
( segid " " and resid 303 and name HD% )
2.400 0.700 0.700 peak 1966 spectrum 1 weight 0.10000E+01 volume 0.51399E-02 ppm1 6.805 ppm2 7.077 CV 1
OR { 1966}
( segid " " and resid 303 and name HE% )
( segid " " and resid 360 and name HD% )
ASSI { 682}
( segid " " and resid 439 and name HD2%)
(( segid " " and resid 439 and name HB2 ))
2.600 0.800 0.800 peak 682 spectrum 1 weight 0.10000E+01 volume 0.91041E-02 ppm1 0.882 ppm2 2.206 CV 1
OR { 682}
( segid " " and resid 266 and name HD1%)
(( segid " " and resid 269 and name HB2 ))
ASSI { 673}
( segid " " and resid 219 and name HD% )
(( segid " " and resid 219 and name HA ))
3.700 1.800 1.800 peak 673 spectrum 1 weight 0.10000E+01 volume 0.49622E-03 ppm1 6.873 ppm2 4.104 CV 1
OR { 673}
( segid " " and resid 219 and name HD% )
(( segid " " and resid 256 and name HA ))
ASSI { 1582}
(( segid " " and resid 217 and name HG12))
( segid " " and resid 267 and name HD1%)
4.400 2.400 1.600 peak 1582 spectrum 1 weight 0.10000E+01 volume 0.12406E-02 ppm1 0.527 ppm2 0.913 CV 1
OR { 1582}
(( segid " " and resid 217 and name HG12))
( segid " " and resid 267 and name HD2%)
OR { 1582}
(( segid " " and resid 217 and name HG12))
( segid " " and resid 325 and name HE% )
OR { 1582}
(( segid " " and resid 217 and name HG12))
( segid " " and resid 321 and name HD1%)
ASSI { 2468}
(( segid " " and resid 312 and name HG2 ))
(( segid " " and resid 312 and name H ))
4.800 2.800 1.200 peak 2468 spectrum 1 weight 0.10000E+01 volume 0.69077E-03 ppm1 2.340 ppm2 8.732 CV 1
OR { 2468}
(( segid " " and resid 221 and name HG3 ))
(( segid " " and resid 221 and name H ))
ASSI { 1014}
(( segid " " and resid 288 and name HB3 ))
(( segid " " and resid 285 and name HA ))
3.900 1.900 1.900 peak 1014 spectrum 1 weight 0.10000E+01 volume 0.24558E-02 ppm1 2.064 ppm2 4.366 CV 1
OR { 1014}
(( segid " " and resid 199 and name HB3 ))
(( segid " " and resid 196 and name HA ))
ASSI { 1166}
( segid " " and resid 279 and name HD2%)
( segid " " and resid 360 and name HE% )
3.500 1.500 1.500 peak 1166 spectrum 1 weight 0.10000E+01 volume 0.19285E-02 ppm1 0.365 ppm2 7.067 CV 1
OR { 1166}
( segid " " and resid 279 and name HD2%)
( segid " " and resid 360 and name HD% )
OR { 1166}
( segid " " and resid 279 and name HD2%)
(( segid " " and resid 352 and name H ))
ASSI { 173}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 302 and name HA ))
4.500 2.500 1.500 peak 173 spectrum 1 weight 0.10000E+01 volume 0.71333E-03 ppm1 0.379 ppm2 4.312 CV 1
OR { 173}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 279 and name HA ))
OR { 173}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 310 and name HA ))
ASSI { 84}
( segid " " and resid 420 and name HD1%)
(( segid " " and resid 417 and name H ))
2.700 2.700 3.300 peak 84 spectrum 1 weight 0.10000E+01 volume 0.89659E-03 ppm1 0.770 ppm2 7.769 CV 1
OR { 84}
( segid " " and resid 420 and name HD1%)
(( segid " " and resid 425 and name H ))
ASSI { 844}
( segid " " and resid 367 and name HD2%)
(( segid " " and resid 367 and name HB3 ))
2.600 0.800 0.800 peak 844 spectrum 1 weight 0.10000E+01 volume 0.48607E-02 ppm1 0.787 ppm2 0.020 CV 1
OR { 844}
( segid " " and resid 255 and name HD2%)
( segid " " and resid 263 and name HG1%)
ASSI { 826}
(( segid " " and resid 302 and name HG3 ))
(( segid " " and resid 302 and name H ))
3.800 1.800 1.800 peak 826 spectrum 1 weight 0.10000E+01 volume 0.20131E-02 ppm1 2.076 ppm2 7.996 CV 1
OR { 826}
(( segid " " and resid 302 and name HG3 ))
(( segid " " and resid 306 and name H ))
ASSI { 687}
(( segid " " and resid 354 and name HB3 ))
(( segid " " and resid 355 and name HA ))
4.300 2.300 1.700 peak 687 spectrum 1 weight 0.10000E+01 volume 0.85150E-03 ppm1 2.683 ppm2 4.016 CV 1
OR { 687}
(( segid " " and resid 354 and name HB3 ))
(( segid " " and resid 353 and name HB3 ))
OR { 687}
(( segid " " and resid 354 and name HB3 ))
(( segid " " and resid 353 and name HB2 ))
OR { 687}
(( segid " " and resid 354 and name HB3 ))
(( segid " " and resid 343 and name HA ))
ASSI { 1246}
(( segid " " and resid 360 and name HB3 ))
( segid " " and resid 360 and name HD% )
3.400 1.500 1.500 peak 1246 spectrum 1 weight 0.10000E+01 volume 0.98399E-03 ppm1 3.055 ppm2 7.091 CV 1
OR { 1246}
(( segid " " and resid 360 and name HB3 ))
( segid " " and resid 361 and name HD% )
OR { 1246}
(( segid " " and resid 360 and name HB3 ))
( segid " " and resid 360 and name HE% )
ASSI { 785}
( segid " " and resid 230 and name HG2%)
(( segid " " and resid 225 and name HA ))
3.800 1.800 1.800 peak 785 spectrum 1 weight 0.10000E+01 volume 0.79791E-03 ppm1 0.952 ppm2 4.364 CV 1
OR { 785}
( segid " " and resid 230 and name HG2%)
(( segid " " and resid 226 and name HA ))
OR { 785}
( segid " " and resid 230 and name HG2%)
(( segid " " and resid 260 and name HA ))
OR { 785}
( segid " " and resid 230 and name HG2%)
(( segid " " and resid 341 and name HA ))
ASSI { 1523}
( segid " " and resid 225 and name HE% )
( segid " " and resid 230 and name HG2%)
3.400 1.500 1.500 peak 1523 spectrum 1 weight 0.10000E+01 volume 0.48579E-02 ppm1 1.914 ppm2 0.932 CV 1
OR { 1523}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 230 and name HG13))
OR { 1523}
( segid " " and resid 225 and name HE% )
( segid " " and resid 325 and name HE% )
OR { 1523}
( segid " " and resid 225 and name HE% )
( segid " " and resid 264 and name HB% )
OR { 1523}
( segid " " and resid 225 and name HE% )
( segid " " and resid 345 and name HG2%)
OR { 1523}
( segid " " and resid 225 and name HE% )
( segid " " and resid 267 and name HD2%)
ASSI { 658}
(( segid " " and resid 324 and name HB3 ))
(( segid " " and resid 324 and name HD2 ))
4.700 2.700 1.300 peak 658 spectrum 1 weight 0.10000E+01 volume 0.39190E-03 ppm1 3.276 ppm2 7.187 CV 1
OR { 658}
(( segid " " and resid 324 and name HB3 ))
(( segid " " and resid 328 and name H ))
OR { 658}
(( segid " " and resid 324 and name HB3 ))
( segid " " and resid 361 and name HD% )
ASSI { 2}
( segid " " and resid 359 and name HG1%)
( segid " " and resid 300 and name HG1%)
4.400 2.400 1.600 peak 2 spectrum 1 weight 0.10000E+01 volume 0.98963E-03 ppm1 0.892 ppm2 0.082 CV 1
OR { 2}
( segid " " and resid 359 and name HG1%)
( segid " " and resid 329 and name HD1%)
ASSI { 850}
( segid " " and resid 373 and name HD2%)
(( segid " " and resid 371 and name HB ))
2.400 2.400 3.600 peak 850 spectrum 1 weight 0.10000E+01 volume 0.17481E-02 ppm1 0.514 ppm2 1.932 CV 1
OR { 850}
( segid " " and resid 373 and name HD2%)
( segid " " and resid 225 and name HE% )
OR { 850}
( segid " " and resid 373 and name HD2%)
(( segid " " and resid 221 and name HB3 ))
OR { 850}
( segid " " and resid 373 and name HD2%)
(( segid " " and resid 321 and name HB2 ))
ASSI { 1053}
(( segid " " and resid 354 and name HB2 ))
(( segid " " and resid 355 and name HA ))
4.800 2.800 1.200 peak 1053 spectrum 1 weight 0.10000E+01 volume 0.91633E-03 ppm1 2.738 ppm2 4.010 CV 1
OR { 1053}
(( segid " " and resid 354 and name HB2 ))
(( segid " " and resid 353 and name HB3 ))
OR { 1053}
(( segid " " and resid 354 and name HB2 ))
(( segid " " and resid 353 and name HB2 ))
OR { 1053}
(( segid " " and resid 354 and name HB2 ))
(( segid " " and resid 343 and name HA ))
ASSI { 992}
( segid " " and resid 202 and name HE% )
(( segid " " and resid 198 and name H ))
5.400 3.600 0.600 peak 992 spectrum 1 weight 0.10000E+01 volume 0.52161E-03 ppm1 1.868 ppm2 8.576 CV 1
OR { 992}
( segid " " and resid 202 and name HE% )
(( segid " " and resid 313 and name H ))
ASSI { 1254}
(( segid " " and resid 374 and name HE2 ))
(( segid " " and resid 374 and name HG2 ))
1.900 0.400 0.400 peak 1254 spectrum 1 weight 0.10000E+01 volume 0.42243E-01 ppm1 2.971 ppm2 1.395 CV 1
OR { 1254}
(( segid " " and resid 281 and name HE2 ))
(( segid " " and resid 281 and name HG3 ))
OR { 1254}
(( segid " " and resid 378 and name HE2 ))
(( segid " " and resid 378 and name HG3 ))
OR { 1254}
(( segid " " and resid 374 and name HE2 ))
(( segid " " and resid 374 and name HG3 ))
OR { 1254}
(( segid " " and resid 378 and name HE3 ))
(( segid " " and resid 378 and name HG3 ))
OR { 1254}
(( segid " " and resid 281 and name HE3 ))
(( segid " " and resid 281 and name HG2 ))
OR { 1254}
(( segid " " and resid 374 and name HE3 ))
(( segid " " and resid 374 and name HG3 ))
OR { 1254}
(( segid " " and resid 281 and name HE3 ))
(( segid " " and resid 281 and name HG3 ))
OR { 1254}
(( segid " " and resid 374 and name HE3 ))
(( segid " " and resid 374 and name HG2 ))
ASSI { 1116}
( segid " " and resid 303 and name HD% )
(( segid " " and resid 301 and name HB3 ))
4.500 2.600 1.500 peak 1116 spectrum 1 weight 0.10000E+01 volume 0.44831E-03 ppm1 7.084 ppm2 1.934 CV 1
OR { 1116}
( segid " " and resid 303 and name HD% )
(( segid " " and resid 304 and name HB3 ))
OR { 1116}
( segid " " and resid 303 and name HD% )
(( segid " " and resid 283 and name HB3 ))
OR { 1116}
( segid " " and resid 303 and name HD% )
(( segid " " and resid 356 and name HB ))
ASSI { 1260}
(( segid " " and resid 424 and name HB2 ))
(( segid " " and resid 423 and name HB3 ))
3.800 1.800 1.800 peak 1260 spectrum 1 weight 0.10000E+01 volume 0.21823E-02 ppm1 3.902 ppm2 1.618 CV 1
OR { 1260}
(( segid " " and resid 424 and name HB3 ))
(( segid " " and resid 425 and name HD3 ))
OR { 1260}
(( segid " " and resid 424 and name HB2 ))
(( segid " " and resid 425 and name HD3 ))
OR { 1260}
(( segid " " and resid 424 and name HB3 ))
(( segid " " and resid 423 and name HB3 ))
OR { 1260}
(( segid " " and resid 424 and name HB2 ))
(( segid " " and resid 425 and name HB2 ))
OR { 1260}
(( segid " " and resid 424 and name HB3 ))
(( segid " " and resid 425 and name HB2 ))
OR { 1260}
(( segid " " and resid 424 and name HB2 ))
(( segid " " and resid 425 and name HD2 ))
OR { 1260}
(( segid " " and resid 424 and name HB3 ))
(( segid " " and resid 425 and name HD2 ))
OR { 1260}
(( segid " " and resid 424 and name HB2 ))
(( segid " " and resid 423 and name HG ))
ASSI { 1486}
(( segid " " and resid 278 and name HG ))
( segid " " and resid 317 and name HD1%)
4.500 2.500 1.500 peak 1486 spectrum 1 weight 0.10000E+01 volume 0.10094E-02 ppm1 1.727 ppm2 0.170 CV 1
OR { 1486}
(( segid " " and resid 278 and name HG ))
( segid " " and resid 279 and name HD1%)
OR { 1486}
(( segid " " and resid 278 and name HG ))
(( segid " " and resid 322 and name HG13))
ASSI { 4540}
(( segid " " and resid 241 and name HB3 ))
(( segid " " and resid 241 and name H ))
4.100 2.100 1.900 peak 4540 spectrum 1 weight 0.10000E+01 volume 0.75282E-03 ppm1 2.568 ppm2 8.371 CV 1
OR { 4540}
(( segid " " and resid 361 and name HB3 ))
(( segid " " and resid 361 and name H ))
ASSI { 2505}
(( segid " " and resid 308 and name HE2 ))
(( segid " " and resid 308 and name HG3 ))
2.100 0.500 0.500 peak 2505 spectrum 1 weight 0.10000E+01 volume 0.19906E-01 ppm1 2.852 ppm2 1.367 CV 1
OR { 2505}
(( segid " " and resid 308 and name HE3 ))
(( segid " " and resid 308 and name HG3 ))
OR { 2505}
(( segid " " and resid 399 and name HE3 ))
(( segid " " and resid 399 and name HG2 ))
OR { 2505}
(( segid " " and resid 399 and name HE2 ))
(( segid " " and resid 399 and name HG2 ))
OR { 2505}
(( segid " " and resid 440 and name HE2 ))
(( segid " " and resid 440 and name HG2 ))
OR { 2505}
(( segid " " and resid 440 and name HE2 ))
(( segid " " and resid 440 and name HG3 ))
ASSI { 16}
( segid " " and resid 356 and name HG2%)
(( segid " " and resid 287 and name HB3 ))
3.500 1.500 1.500 peak 16 spectrum 1 weight 0.10000E+01 volume 0.85150E-03 ppm1 0.380 ppm2 2.450 CV 1
OR { 16}
( segid " " and resid 356 and name HG2%)
(( segid " " and resid 350 and name HB ))
ASSI { 3972}
( segid " " and resid 346 and name HD2%)
(( segid " " and resid 346 and name HA ))
2.800 1.000 1.000 peak 3972 spectrum 1 weight 0.10000E+01 volume 0.71051E-02 ppm1 0.749 ppm2 4.044 CV 1
OR { 3972}
( segid " " and resid 346 and name HD2%)
(( segid " " and resid 343 and name HA ))
ASSI { 1160}
(( segid " " and resid 319 and name HB3 ))
( segid " " and resid 371 and name HG1%)
3.900 1.900 1.900 peak 1160 spectrum 1 weight 0.10000E+01 volume 0.52161E-03 ppm1 3.074 ppm2 0.361 CV 1
OR { 1160}
(( segid " " and resid 319 and name HB3 ))
( segid " " and resid 318 and name HG2%)
OR { 1160}
(( segid " " and resid 319 and name HB3 ))
( segid " " and resid 318 and name HD1%)
ASSI { 1330}
( segid " " and resid 300 and name HG2%)
(( segid " " and resid 303 and name H ))
4.200 2.200 1.800 peak 1330 spectrum 1 weight 0.10000E+01 volume 0.14126E-02 ppm1 0.539 ppm2 8.691 CV 1
OR { 1330}
( segid " " and resid 300 and name HG2%)
(( segid " " and resid 304 and name H ))
ASSI { 295}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 232 and name HA ))
4.000 2.000 2.000 peak 295 spectrum 1 weight 0.10000E+01 volume 0.19962E-02 ppm1 1.804 ppm2 4.424 CV 1
OR { 295}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 341 and name HA ))
ASSI { 678}
( segid " " and resid 271 and name HD2%)
( segid " " and resid 213 and name HD% )
4.200 2.200 1.800 peak 678 spectrum 1 weight 0.10000E+01 volume 0.60337E-03 ppm1 0.736 ppm2 6.711 CV 1
OR { 678}
( segid " " and resid 271 and name HD2%)
(( segid " " and resid 351 and name HE21))
ASSI { 1127}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 280 and name HA ))
3.000 1.200 1.200 peak 1127 spectrum 1 weight 0.10000E+01 volume 0.49115E-02 ppm1 2.151 ppm2 3.984 CV 1
OR { 1127}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 281 and name HA ))
OR { 1127}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 353 and name HB2 ))
ASSI { 1217}
(( segid " " and resid 415 and name HB2 ))
(( segid " " and resid 416 and name HB3 ))
5.100 3.300 0.900 peak 1217 spectrum 1 weight 0.10000E+01 volume 0.55827E-03 ppm1 2.754 ppm2 1.608 CV 1
OR { 1217}
(( segid " " and resid 415 and name HB2 ))
(( segid " " and resid 416 and name HG ))
OR { 1217}
(( segid " " and resid 415 and name HB2 ))
(( segid " " and resid 425 and name HD2 ))
OR { 1217}
(( segid " " and resid 415 and name HB2 ))
(( segid " " and resid 425 and name HD3 ))
ASSI { 450}
(( segid " " and resid 234 and name HB3 ))
(( segid " " and resid 234 and name H ))
4.000 2.000 2.000 peak 450 spectrum 1 weight 0.10000E+01 volume 0.58080E-03 ppm1 3.866 ppm2 8.647 CV 1
OR { 450}
(( segid " " and resid 329 and name HA ))
(( segid " " and resid 330 and name H ))
OR { 450}
(( segid " " and resid 329 and name HA ))
(( segid " " and resid 333 and name H ))
ASSI { 370}
(( segid " " and resid 210 and name HD2 ))
( segid " " and resid 198 and name HG2%)
4.900 2.900 1.100 peak 370 spectrum 1 weight 0.10000E+01 volume 0.47930E-03 ppm1 3.329 ppm2 0.611 CV 1
OR { 370}
(( segid " " and resid 210 and name HD2 ))
( segid " " and resid 194 and name HD2%)
OR { 370}
(( segid " " and resid 210 and name HD2 ))
( segid " " and resid 198 and name HG1%)
ASSI { 56}
(( segid " " and resid 304 and name HB3 ))
(( segid " " and resid 304 and name HG2 ))
2.600 0.900 0.900 peak 56 spectrum 1 weight 0.10000E+01 volume 0.29125E-02 ppm1 1.884 ppm2 2.451 CV 1
OR { 56}
(( segid " " and resid 301 and name HB3 ))
(( segid " " and resid 301 and name HG2 ))
ASSI { 45}
( segid " " and resid 246 and name HB% )
( segid " " and resid 266 and name HD2%)
4.300 2.300 1.700 peak 45 spectrum 1 weight 0.10000E+01 volume 0.12406E-02 ppm1 1.179 ppm2 0.801 CV 1
OR { 45}
( segid " " and resid 246 and name HB% )
( segid " " and resid 255 and name HD2%)
ASSI { 820}
(( segid " " and resid 305 and name HG2 ))
(( segid " " and resid 305 and name H ))
4.000 2.000 2.000 peak 820 spectrum 1 weight 0.10000E+01 volume 0.16325E-02 ppm1 1.649 ppm2 7.443 CV 1
OR { 820}
(( segid " " and resid 210 and name HG2 ))
(( segid " " and resid 211 and name H ))
OR { 820}
(( segid " " and resid 305 and name HG2 ))
(( segid " " and resid 309 and name H ))
ASSI { 1461}
(( segid " " and resid 307 and name HB2 ))
( segid " " and resid 307 and name HD2%)
3.300 1.400 1.400 peak 1461 spectrum 1 weight 0.10000E+01 volume 0.93890E-03 ppm1 1.591 ppm2 1.083 CV 1
OR { 1461}
(( segid " " and resid 307 and name HB2 ))
( segid " " and resid 310 and name HD1%)
ASSI { 17}
(( segid " " and resid 283 and name HB2 ))
( segid " " and resid 310 and name HD2%)
3.600 1.600 1.600 peak 17 spectrum 1 weight 0.10000E+01 volume 0.48494E-03 ppm1 2.326 ppm2 1.113 CV 1
OR { 17}
(( segid " " and resid 283 and name HB2 ))
( segid " " and resid 310 and name HD1%)
OR { 17}
(( segid " " and resid 283 and name HB2 ))
( segid " " and resid 280 and name HG2%)
ASSI { 364}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 443 and name HA ))
3.000 1.100 1.100 peak 364 spectrum 1 weight 0.10000E+01 volume 0.25573E-02 ppm1 0.559 ppm2 4.095 CV 1
OR { 364}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 446 and name HA ))
ASSI { 509}
(( segid " " and resid 283 and name HB3 ))
( segid " " and resid 310 and name HD2%)
4.100 2.100 1.900 peak 509 spectrum 1 weight 0.10000E+01 volume 0.11391E-02 ppm1 1.921 ppm2 1.091 CV 1
OR { 509}
(( segid " " and resid 409 and name HB3 ))
( segid " " and resid 432 and name HG2%)
OR { 509}
(( segid " " and resid 283 and name HB3 ))
( segid " " and resid 310 and name HD1%)
OR { 509}
(( segid " " and resid 408 and name HB2 ))
( segid " " and resid 432 and name HG2%)
OR { 509}
(( segid " " and resid 409 and name HB3 ))
( segid " " and resid 432 and name HG1%)
OR { 509}
(( segid " " and resid 283 and name HB3 ))
( segid " " and resid 280 and name HG2%)
ASSI { 3010}
(( segid " " and resid 346 and name HB3 ))
(( segid " " and resid 346 and name HA ))
2.900 1.000 1.000 peak 3010 spectrum 1 weight 0.10000E+01 volume 0.18637E-02 ppm1 1.480 ppm2 4.049 CV 1
OR { 3010}
(( segid " " and resid 346 and name HB3 ))
(( segid " " and resid 343 and name HA ))
ASSI { 598}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 316 and name HB2 ))
3.200 1.200 1.200 peak 598 spectrum 1 weight 0.10000E+01 volume 0.18552E-02 ppm1 0.190 ppm2 1.592 CV 1
OR { 598}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 316 and name HG ))
OR { 598}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 316 and name HB3 ))
OR { 598}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 210 and name HG3 ))
OR { 598}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 207 and name HB ))
OR { 598}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 210 and name HB2 ))
ASSI { 1186}
(( segid " " and resid 319 and name HA ))
( segid " " and resid 323 and name HG1%)
5.300 3.500 0.700 peak 1186 spectrum 1 weight 0.10000E+01 volume 0.45395E-03 ppm1 2.280 ppm2 0.793 CV 1
OR { 1186}
(( segid " " and resid 319 and name HA ))
( segid " " and resid 367 and name HD2%)
OR { 1186}
(( segid " " and resid 319 and name HA ))
( segid " " and resid 316 and name HD1%)
OR { 1186}
(( segid " " and resid 319 and name HA ))
( segid " " and resid 278 and name HD2%)
OR { 1186}
(( segid " " and resid 319 and name HA ))
( segid " " and resid 316 and name HD2%)
ASSI { 246}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 321 and name HB2 ))
4.000 2.000 2.000 peak 246 spectrum 1 weight 0.10000E+01 volume 0.14520E-02 ppm1 0.380 ppm2 1.951 CV 1
OR { 246}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 356 and name HB ))
ASSI { 3426}
( segid " " and resid 247 and name HD% )
( segid " " and resid 253 and name HG2%)
4.500 2.500 1.500 peak 3426 spectrum 1 weight 0.10000E+01 volume 0.43421E-03 ppm1 7.329 ppm2 0.602 CV 1
OR { 3426}
( segid " " and resid 247 and name HD% )
( segid " " and resid 255 and name HD1%)
ASSI { 640}
( segid " " and resid 246 and name HB% )
(( segid " " and resid 246 and name HA ))
2.400 0.700 0.700 peak 640 spectrum 1 weight 0.10000E+01 volume 0.81906E-02 ppm1 1.176 ppm2 3.845 CV 1
OR { 640}
( segid " " and resid 246 and name HB% )
(( segid " " and resid 243 and name HA ))
ASSI { 138}
( segid " " and resid 212 and name HG1%)
(( segid " " and resid 210 and name HB3 ))
3.800 1.800 1.800 peak 138 spectrum 1 weight 0.10000E+01 volume 0.12152E-02 ppm1 -0.341 ppm2 1.405 CV 1
OR { 138}
( segid " " and resid 212 and name HG1%)
( segid " " and resid 197 and name HB% )
ASSI { 905}
(( segid " " and resid 317 and name HB3 ))
(( segid " " and resid 317 and name HG ))
3.500 1.500 1.500 peak 905 spectrum 1 weight 0.10000E+01 volume 0.72461E-03 ppm1 1.135 ppm2 0.372 CV 1
OR { 905}
(( segid " " and resid 317 and name HB3 ))
( segid " " and resid 317 and name HD2%)
OR { 905}
(( segid " " and resid 352 and name HB ))
( segid " " and resid 356 and name HG2%)
OR { 905}
(( segid " " and resid 317 and name HB3 ))
( segid " " and resid 318 and name HG2%)
OR { 905}
(( segid " " and resid 352 and name HB ))
( segid " " and resid 279 and name HD2%)
ASSI { 1159}
(( segid " " and resid 318 and name HB ))
( segid " " and resid 279 and name HD1%)
3.400 1.400 1.400 peak 1159 spectrum 1 weight 0.10000E+01 volume 0.16043E-02 ppm1 1.357 ppm2 0.171 CV 1
OR { 1159}
(( segid " " and resid 318 and name HB ))
(( segid " " and resid 322 and name HG13))
ASSI { 2411}
(( segid " " and resid 333 and name HB2 ))
(( segid " " and resid 333 and name HA ))
2.500 0.800 0.800 peak 2411 spectrum 1 weight 0.10000E+01 volume 0.75846E-02 ppm1 1.620 ppm2 4.006 CV 1
OR { 2411}
(( segid " " and resid 423 and name HB3 ))
(( segid " " and resid 423 and name HA ))
ASSI { 1718}
( segid " " and resid 310 and name HD1%)
( segid " " and resid 315 and name HD% )
3.200 1.300 1.300 peak 1718 spectrum 1 weight 0.10000E+01 volume 0.57037E-02 ppm1 1.072 ppm2 7.043 CV 1
OR { 1718}
( segid " " and resid 310 and name HD1%)
(( segid " " and resid 310 and name H ))
ASSI { 231}
( segid " " and resid 266 and name HD1%)
(( segid " " and resid 263 and name HA ))
3.600 1.700 1.700 peak 231 spectrum 1 weight 0.10000E+01 volume 0.27575E-02 ppm1 0.887 ppm2 3.182 CV 1
OR { 231}
( segid " " and resid 266 and name HD1%)
(( segid " " and resid 240 and name HA ))
ASSI { 1282}
(( segid " " and resid 300 and name HB ))
( segid " " and resid 300 and name HG2%)
2.500 0.800 0.800 peak 1282 spectrum 1 weight 0.10000E+01 volume 0.35216E-02 ppm1 1.742 ppm2 0.531 CV 1
OR { 1282}
(( segid " " and resid 323 and name HB ))
( segid " " and resid 373 and name HD2%)
ASSI { 856}
( segid " " and resid 376 and name HG1%)
(( segid " " and resid 377 and name HA ))
3.500 1.500 1.500 peak 856 spectrum 1 weight 0.10000E+01 volume 0.10235E-02 ppm1 0.955 ppm2 4.696 CV 1
OR { 856}
( segid " " and resid 376 and name HG1%)
(( segid " " and resid 375 and name HA ))
ASSI { 1038}
(( segid " " and resid 363 and name HB3 ))
( segid " " and resid 300 and name HG1%)
4.400 2.400 1.600 peak 1038 spectrum 1 weight 0.10000E+01 volume 0.26221E-03 ppm1 2.631 ppm2 0.060 CV 1
OR { 1038}
(( segid " " and resid 363 and name HB3 ))
(( segid " " and resid 367 and name HB3 ))
ASSI { 223}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 232 and name HG3 ))
2.700 0.900 0.900 peak 223 spectrum 1 weight 0.10000E+01 volume 0.66090E-02 ppm1 1.008 ppm2 1.490 CV 1
OR { 223}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 232 and name HG2 ))
OR { 223}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 232 and name HB2 ))
OR { 223}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 346 and name HB3 ))
ASSI { 178}
(( segid " " and resid 420 and name HB ))
(( segid " " and resid 416 and name H ))
4.600 2.700 1.400 peak 178 spectrum 1 weight 0.10000E+01 volume 0.75282E-03 ppm1 1.762 ppm2 7.960 CV 1
OR { 178}
(( segid " " and resid 420 and name HB ))
(( segid " " and resid 419 and name H ))
OR { 178}
(( segid " " and resid 398 and name HB ))
(( segid " " and resid 400 and name H ))
ASSI { 1047}
( segid " " and resid 396 and name HB% )
(( segid " " and resid 397 and name H ))
2.900 1.100 1.100 peak 1047 spectrum 1 weight 0.10000E+01 volume 0.35046E-02 ppm1 1.352 ppm2 8.054 CV 1
OR { 1047}
( segid " " and resid 195 and name HB% )
(( segid " " and resid 197 and name H ))
ASSI { 1226}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 325 and name H ))
4.900 3.000 1.100 peak 1226 spectrum 1 weight 0.10000E+01 volume 0.12970E-02 ppm1 0.514 ppm2 8.515 CV 1
OR { 1226}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 341 and name H ))
ASSI { 1450}
( segid " " and resid 283 and name HD1%)
(( segid " " and resid 309 and name H ))
4.100 2.100 1.900 peak 1450 spectrum 1 weight 0.10000E+01 volume 0.26701E-02 ppm1 0.717 ppm2 7.460 CV 1
OR { 1450}
( segid " " and resid 283 and name HD1%)
(( segid " " and resid 286 and name H ))
ASSI { 3788}
(( segid " " and resid 444 and name HA ))
(( segid " " and resid 444 and name HB2 ))
2.400 0.700 0.700 peak 3788 spectrum 1 weight 0.10000E+01 volume 0.13818E-01 ppm1 4.229 ppm2 1.866 CV 1
OR { 3788}
(( segid " " and resid 445 and name HA ))
(( segid " " and resid 445 and name HB3 ))
ASSI { 1209}
( segid " " and resid 429 and name HD2%)
(( segid " " and resid 426 and name HA ))
2.700 0.900 0.900 peak 1209 spectrum 1 weight 0.10000E+01 volume 0.93777E-02 ppm1 0.643 ppm2 3.740 CV 1
OR { 1209}
( segid " " and resid 429 and name HD2%)
(( segid " " and resid 429 and name HA ))
ASSI { 742}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 315 and name HA ))
3.700 1.700 1.700 peak 742 spectrum 1 weight 0.10000E+01 volume 0.24022E-02 ppm1 0.379 ppm2 3.808 CV 1
OR { 742}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 357 and name HA ))
OR { 742}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 320 and name HA ))
ASSI { 1286}
(( segid " " and resid 352 and name HB ))
( segid " " and resid 350 and name HG2%)
2.500 0.800 0.800 peak 1286 spectrum 1 weight 0.10000E+01 volume 0.36483E-02 ppm1 1.137 ppm2 0.717 CV 1
OR { 1286}
(( segid " " and resid 352 and name HB ))
( segid " " and resid 357 and name HD1%)
OR { 1286}
(( segid " " and resid 352 and name HB ))
( segid " " and resid 350 and name HG1%)
ASSI { 1570}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 322 and name HB ))
2.200 0.600 0.600 peak 1570 spectrum 1 weight 0.10000E+01 volume 0.42265E-02 ppm1 0.390 ppm2 1.351 CV 1
OR { 1570}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 322 and name HG12))
OR { 1570}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 325 and name HB3 ))
ASSI { 1015}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 194 and name HB3 ))
3.000 1.100 1.100 peak 1015 spectrum 1 weight 0.10000E+01 volume 0.22669E-02 ppm1 0.553 ppm2 1.475 CV 1
OR { 1015}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 194 and name HB2 ))
OR { 1015}
( segid " " and resid 194 and name HD2%)
( segid " " and resid 197 and name HB% )
ASSI { 2412}
( segid " " and resid 362 and name HG2%)
( segid " " and resid 359 and name HG2%)
4.900 3.000 1.100 peak 2412 spectrum 1 weight 0.10000E+01 volume 0.75846E-03 ppm1 0.551 ppm2 -0.459 CV 1
OR { 2412}
( segid " " and resid 300 and name HG2%)
( segid " " and resid 359 and name HG2%)
ASSI { 749}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 316 and name HA ))
4.400 2.400 1.600 peak 749 spectrum 1 weight 0.10000E+01 volume 0.77816E-03 ppm1 0.185 ppm2 3.590 CV 1
OR { 749}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 214 and name HA ))
OR { 749}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 213 and name HA ))
ASSI { 37}
( segid " " and resid 367 and name HD1%)
(( segid " " and resid 303 and name HB3 ))
3.100 1.200 1.200 peak 37 spectrum 1 weight 0.10000E+01 volume 0.16127E-02 ppm1 0.668 ppm2 2.590 CV 1
OR { 37}
( segid " " and resid 367 and name HD1%)
(( segid " " and resid 363 and name HB3 ))
OR { 37}
( segid " " and resid 274 and name HD1%)
(( segid " " and resid 273 and name HB2 ))
ASSI { 1225}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 318 and name HG13))
3.200 1.300 1.300 peak 1225 spectrum 1 weight 0.10000E+01 volume 0.67046E-02 ppm1 0.169 ppm2 0.621 CV 1
OR { 1225}
( segid " " and resid 279 and name HD1%)
( segid " " and resid 352 and name HD1%)
OR { 1225}
( segid " " and resid 279 and name HD1%)
( segid " " and resid 278 and name HD1%)
ASSI { 131}
(( segid " " and resid 302 and name HG2 ))
(( segid " " and resid 305 and name HD3 ))
4.400 2.400 1.600 peak 131 spectrum 1 weight 0.10000E+01 volume 0.58080E-03 ppm1 2.250 ppm2 3.067 CV 1
OR { 131}
(( segid " " and resid 302 and name HG2 ))
(( segid " " and resid 286 and name HD3 ))
OR { 131}
(( segid " " and resid 302 and name HG2 ))
(( segid " " and resid 287 and name HB2 ))
ASSI { 1497}
(( segid " " and resid 222 and name HG3 ))
( segid " " and resid 223 and name HD% )
5.800 4.100 0.200 peak 1497 spectrum 1 weight 0.10000E+01 volume 0.38908E-03 ppm1 0.975 ppm2 6.441 CV 1
OR { 1497}
(( segid " " and resid 222 and name HG3 ))
( segid " " and resid 219 and name HE% )
ASSI { 3037}
( segid " " and resid 194 and name HD1%)
( segid " " and resid 317 and name HD1%)
2.600 0.800 0.800 peak 3037 spectrum 1 weight 0.10000E+01 volume 0.65526E-02 ppm1 0.745 ppm2 0.164 CV 1
OR { 3037}
( segid " " and resid 194 and name HD1%)
( segid " " and resid 209 and name HD1%)
ASSI { 400}
( segid " " and resid 240 and name HG2%)
(( segid " " and resid 242 and name H ))
4.900 3.100 1.100 peak 400 spectrum 1 weight 0.10000E+01 volume 0.98117E-03 ppm1 0.777 ppm2 7.545 CV 1
OR { 400}
( segid " " and resid 240 and name HG2%)
(( segid " " and resid 245 and name H ))
ASSI { 1445}
(( segid " " and resid 302 and name HG3 ))
( segid " " and resid 290 and name HB% )
3.200 1.300 1.300 peak 1445 spectrum 1 weight 0.10000E+01 volume 0.43336E-02 ppm1 2.073 ppm2 1.540 CV 1
OR { 1445}
(( segid " " and resid 332 and name HG2 ))
(( segid " " and resid 337 and name HB3 ))
OR { 1445}
(( segid " " and resid 332 and name HG2 ))
(( segid " " and resid 333 and name HB3 ))
OR { 1445}
(( segid " " and resid 332 and name HG2 ))
(( segid " " and resid 339 and name HG13))
ASSI { 463}
(( segid " " and resid 251 and name HB2 ))
(( segid " " and resid 251 and name H ))
3.100 1.200 1.200 peak 463 spectrum 1 weight 0.10000E+01 volume 0.23486E-02 ppm1 1.748 ppm2 7.903 CV 1
OR { 463}
(( segid " " and resid 300 and name HB ))
(( segid " " and resid 300 and name H ))
ASSI { 3260}
( segid " " and resid 274 and name HD1%)
(( segid " " and resid 274 and name HA ))
2.400 0.700 0.700 peak 3260 spectrum 1 weight 0.10000E+01 volume 0.83345E-02 ppm1 0.668 ppm2 4.008 CV 1
OR { 3260}
( segid " " and resid 367 and name HD1%)
(( segid " " and resid 367 and name HA ))
ASSI { 1106}
( segid " " and resid 436 and name HD1%)
(( segid " " and resid 439 and name H ))
4.100 2.100 1.900 peak 1106 spectrum 1 weight 0.10000E+01 volume 0.12096E-02 ppm1 1.010 ppm2 8.728 CV 1
OR { 1106}
( segid " " and resid 436 and name HD1%)
(( segid " " and resid 402 and name H ))
ASSI { 1455}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 216 and name HG ))
3.500 1.500 1.500 peak 1455 spectrum 1 weight 0.10000E+01 volume 0.34144E-02 ppm1 -0.167 ppm2 2.763 CV 1
OR { 1455}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 216 and name HB3 ))
OR { 1455}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 213 and name HB3 ))
ASSI { 261}
( segid " " and resid 243 and name HD1%)
(( segid " " and resid 266 and name HB3 ))
3.700 1.700 1.700 peak 261 spectrum 1 weight 0.10000E+01 volume 0.90505E-03 ppm1 0.012 ppm2 1.549 CV 1
OR { 261}
( segid " " and resid 243 and name HD1%)
(( segid " " and resid 266 and name HB2 ))
OR { 261}
( segid " " and resid 243 and name HD1%)
(( segid " " and resid 263 and name HB ))
OR { 261}
( segid " " and resid 243 and name HD1%)
(( segid " " and resid 239 and name HG3 ))
OR { 261}
( segid " " and resid 243 and name HD1%)
(( segid " " and resid 244 and name HB3 ))
ASSI { 4626}
(( segid " " and resid 417 and name HB3 ))
(( segid " " and resid 417 and name HA ))
2.400 0.700 0.700 peak 4626 spectrum 1 weight 0.10000E+01 volume 0.69838E-02 ppm1 2.058 ppm2 4.110 CV 1
OR { 4626}
(( segid " " and resid 428 and name HB2 ))
(( segid " " and resid 428 and name HA ))
OR { 4626}
(( segid " " and resid 428 and name HB3 ))
(( segid " " and resid 428 and name HA ))
OR { 4626}
(( segid " " and resid 417 and name HB2 ))
(( segid " " and resid 417 and name HA ))
ASSI { 15}
( segid " " and resid 300 and name HG2%)
(( segid " " and resid 301 and name H ))
2.500 0.800 0.800 peak 15 spectrum 1 weight 0.10000E+01 volume 0.31888E-02 ppm1 0.538 ppm2 8.047 CV 1
OR { 15}
( segid " " and resid 300 and name HG2%)
(( segid " " and resid 302 and name H ))
ASSI { 851}
(( segid " " and resid 272 and name HG3 ))
( segid " " and resid 349 and name HG2%)
2.700 0.900 0.900 peak 851 spectrum 1 weight 0.10000E+01 volume 0.50412E-02 ppm1 1.800 ppm2 1.251 CV 1
OR { 851}
(( segid " " and resid 272 and name HG3 ))
(( segid " " and resid 271 and name HB2 ))
OR { 851}
(( segid " " and resid 272 and name HG2 ))
( segid " " and resid 349 and name HG2%)
OR { 851}
(( segid " " and resid 272 and name HG2 ))
(( segid " " and resid 271 and name HB2 ))
ASSI { 969}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 433 and name HG3 ))
3.500 1.600 1.600 peak 969 spectrum 1 weight 0.10000E+01 volume 0.18665E-02 ppm1 0.780 ppm2 2.544 CV 1
OR { 969}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 406 and name HG2 ))
ASSI { 1231}
(( segid " " and resid 372 and name HB ))
( segid " " and resid 371 and name HG1%)
4.500 2.500 1.500 peak 1231 spectrum 1 weight 0.10000E+01 volume 0.12039E-02 ppm1 1.706 ppm2 0.375 CV 1
OR { 1231}
(( segid " " and resid 372 and name HB ))
(( segid " " and resid 373 and name HB2 ))
ASSI { 207}
( segid " " and resid 345 and name HG1%)
( segid " " and resid 342 and name HD1%)
3.100 1.200 1.200 peak 207 spectrum 1 weight 0.10000E+01 volume 0.67384E-02 ppm1 1.009 ppm2 0.663 CV 1
OR { 207}
( segid " " and resid 345 and name HG1%)
( segid " " and resid 357 and name HD1%)
ASSI { 143}
( segid " " and resid 192 and name HD1%)
(( segid " " and resid 193 and name HA ))
4.800 2.900 1.200 peak 143 spectrum 1 weight 0.10000E+01 volume 0.82611E-03 ppm1 0.868 ppm2 4.095 CV 1
OR { 143}
( segid " " and resid 192 and name HD1%)
(( segid " " and resid 191 and name HA2 ))
OR { 143}
( segid " " and resid 192 and name HD1%)
(( segid " " and resid 200 and name HA ))
ASSI { 307}
( segid " " and resid 322 and name HD1%)
( segid " " and resid 321 and name HD2%)
2.400 0.700 0.700 peak 307 spectrum 1 weight 0.10000E+01 volume 0.79622E-02 ppm1 -0.166 ppm2 0.679 CV 1
OR { 307}
( segid " " and resid 322 and name HD1%)
( segid " " and resid 357 and name HD1%)
OR { 307}
( segid " " and resid 322 and name HD1%)
( segid " " and resid 350 and name HG1%)
OR { 307}
( segid " " and resid 322 and name HD1%)
( segid " " and resid 350 and name HG2%)
OR { 307}
( segid " " and resid 322 and name HD1%)
( segid " " and resid 278 and name HD1%)
ASSI { 1405}
(( segid " " and resid 213 and name HZ ))
(( segid " " and resid 317 and name HG ))
4.200 2.300 1.800 peak 1405 spectrum 1 weight 0.10000E+01 volume 0.80637E-03 ppm1 6.326 ppm2 0.433 CV 1
OR { 1405}
(( segid " " and resid 213 and name HZ ))
(( segid " " and resid 217 and name HG13))
OR { 1405}
(( segid " " and resid 213 and name HZ ))
( segid " " and resid 217 and name HG2%)
OR { 1405}
(( segid " " and resid 213 and name HZ ))
( segid " " and resid 318 and name HD1%)
OR { 1405}
(( segid " " and resid 213 and name HZ ))
( segid " " and resid 322 and name HG2%)
ASSI { 1616}
(( segid " " and resid 408 and name HB2 ))
( segid " " and resid 408 and name HD2%)
2.900 1.100 1.100 peak 1616 spectrum 1 weight 0.10000E+01 volume 0.33806E-02 ppm1 1.920 ppm2 0.877 CV 1
OR { 1616}
(( segid " " and resid 283 and name HB3 ))
( segid " " and resid 283 and name HD2%)
OR { 1616}
(( segid " " and resid 409 and name HB3 ))
( segid " " and resid 436 and name HD2%)
ASSI { 6}
( segid " " and resid 443 and name HD2%)
(( segid " " and resid 440 and name HA ))
2.700 0.900 0.900 peak 6 spectrum 1 weight 0.10000E+01 volume 0.76773E-02 ppm1 0.782 ppm2 3.771 CV 1
OR { 6}
( segid " " and resid 443 and name HD2%)
(( segid " " and resid 399 and name HA ))
OR { 6}
( segid " " and resid 443 and name HD2%)
(( segid " " and resid 395 and name HA ))
ASSI { 412}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 346 and name H ))
4.200 2.200 1.800 peak 412 spectrum 1 weight 0.10000E+01 volume 0.74717E-03 ppm1 0.516 ppm2 8.970 CV 1
OR { 412}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 326 and name H ))
OR { 412}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 347 and name H ))
ASSI { 1149}
( segid " " and resid 203 and name HE% )
( segid " " and resid 217 and name HG2%)
5.000 3.100 1.000 peak 1149 spectrum 1 weight 0.10000E+01 volume 0.98117E-03 ppm1 2.220 ppm2 0.466 CV 1
OR { 1149}
( segid " " and resid 203 and name HE% )
( segid " " and resid 207 and name HG2%)
OR { 1149}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 217 and name HG12))
OR { 1149}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 217 and name HG13))
ASSI { 1593}
( segid " " and resid 344 and name HD1%)
(( segid " " and resid 343 and name H ))
2.500 2.500 3.500 peak 1593 spectrum 1 weight 0.10000E+01 volume 0.15564E-02 ppm1 0.819 ppm2 8.169 CV 1
OR { 1593}
( segid " " and resid 344 and name HD1%)
(( segid " " and resid 340 and name H ))
ASSI { 4344}
(( segid " " and resid 359 and name HB ))
(( segid " " and resid 359 and name H ))
3.400 1.400 1.400 peak 4344 spectrum 1 weight 0.10000E+01 volume 0.82329E-03 ppm1 1.606 ppm2 7.213 CV 1
OR { 4344}
(( segid " " and resid 359 and name HB ))
(( segid " " and resid 360 and name H ))
ASSI { 2398}
(( segid " " and resid 287 and name HB2 ))
(( segid " " and resid 287 and name H ))
3.400 1.400 1.400 peak 2398 spectrum 1 weight 0.10000E+01 volume 0.38062E-03 ppm1 3.040 ppm2 8.000 CV 1
OR { 2398}
(( segid " " and resid 287 and name HB2 ))
(( segid " " and resid 289 and name H ))
ASSI { 521}
( segid " " and resid 230 and name HG2%)
( segid " " and resid 335 and name HG2%)
3.000 1.100 1.100 peak 521 spectrum 1 weight 0.10000E+01 volume 0.39783E-02 ppm1 0.950 ppm2 1.248 CV 1
OR { 521}
( segid " " and resid 230 and name HG2%)
(( segid " " and resid 342 and name HG13))
OR { 521}
( segid " " and resid 230 and name HG2%)
(( segid " " and resid 268 and name HG2 ))
ASSI { 366}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 360 and name HB3 ))
2.900 1.100 1.100 peak 366 spectrum 1 weight 0.10000E+01 volume 0.12998E-02 ppm1 0.395 ppm2 3.086 CV 1
OR { 366}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 361 and name HB2 ))
ASSI { 311}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 296 and name HG2 ))
3.200 1.300 1.300 peak 311 spectrum 1 weight 0.10000E+01 volume 0.25855E-02 ppm1 0.076 ppm2 2.438 CV 1
OR { 311}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 296 and name HG3 ))
OR { 311}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 301 and name HG2 ))
OR { 311}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 304 and name HG2 ))
ASSI { 662}
( segid " " and resid 246 and name HB% )
(( segid " " and resid 244 and name HA ))
4.900 3.000 1.100 peak 662 spectrum 1 weight 0.10000E+01 volume 0.51315E-03 ppm1 1.174 ppm2 3.244 CV 1
OR { 662}
( segid " " and resid 246 and name HB% )
(( segid " " and resid 240 and name HA ))
ASSI { 449}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 346 and name HB3 ))
3.600 1.600 1.600 peak 449 spectrum 1 weight 0.10000E+01 volume 0.13703E-02 ppm1 0.730 ppm2 1.466 CV 1
OR { 449}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 279 and name HG ))
ASSI { 877}
(( segid " " and resid 359 and name HB ))
( segid " " and resid 358 and name HD% )
4.300 2.300 1.700 peak 877 spectrum 1 weight 0.10000E+01 volume 0.59491E-03 ppm1 1.592 ppm2 7.068 CV 1
OR { 877}
(( segid " " and resid 359 and name HB ))
(( segid " " and resid 363 and name HD2 ))
OR { 877}
(( segid " " and resid 359 and name HB ))
( segid " " and resid 360 and name HD% )
OR { 877}
(( segid " " and resid 359 and name HB ))
( segid " " and resid 303 and name HD% )
ASSI { 387}
(( segid " " and resid 297 and name HB ))
(( segid " " and resid 293 and name HB3 ))
5.400 3.600 0.600 peak 387 spectrum 1 weight 0.10000E+01 volume 0.93043E-03 ppm1 3.942 ppm2 1.717 CV 1
OR { 387}
(( segid " " and resid 297 and name HB ))
(( segid " " and resid 293 and name HB2 ))
OR { 387}
(( segid " " and resid 297 and name HB ))
(( segid " " and resid 300 and name HB ))
OR { 387}
(( segid " " and resid 297 and name HB ))
(( segid " " and resid 299 and name HB3 ))
ASSI { 3640}
( segid " " and resid 197 and name HB% )
( segid " " and resid 192 and name HD1%)
3.000 1.100 1.100 peak 3640 spectrum 1 weight 0.10000E+01 volume 0.34680E-02 ppm1 1.456 ppm2 0.902 CV 1
OR { 3640}
( segid " " and resid 197 and name HB% )
( segid " " and resid 189 and name HG2%)
ASSI { 233}
(( segid " " and resid 240 and name HA ))
( segid " " and resid 240 and name HG2%)
2.800 1.000 1.000 peak 233 spectrum 1 weight 0.10000E+01 volume 0.33834E-02 ppm1 3.239 ppm2 0.780 CV 1
OR { 233}
(( segid " " and resid 240 and name HA ))
( segid " " and resid 266 and name HD2%)
ASSI { 31}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 317 and name H ))
5.500 3.700 0.500 peak 31 spectrum 1 weight 0.10000E+01 volume 0.52443E-03 ppm1 0.381 ppm2 7.513 CV 1
OR { 31}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 364 and name H ))
ASSI { 169}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 403 and name HA ))
3.200 1.300 1.300 peak 169 spectrum 1 weight 0.10000E+01 volume 0.19567E-02 ppm1 0.768 ppm2 4.085 CV 1
OR { 169}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 406 and name HA ))
OR { 169}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 443 and name HA ))
ASSI { 316}
( segid " " and resid 344 and name HD1%)
(( segid " " and resid 345 and name H ))
2.200 2.200 3.800 peak 316 spectrum 1 weight 0.10000E+01 volume 0.29774E-02 ppm1 0.819 ppm2 6.993 CV 1
OR { 316}
( segid " " and resid 344 and name HD1%)
(( segid " " and resid 341 and name HD21))
ASSI { 462}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 198 and name HB ))
4.200 2.200 1.800 peak 462 spectrum 1 weight 0.10000E+01 volume 0.14182E-02 ppm1 1.460 ppm2 2.069 CV 1
OR { 462}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 200 and name HB2 ))
OR { 462}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 200 and name HB3 ))
OR { 462}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 199 and name HB3 ))
ASSI { 1513}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 225 and name HA ))
3.100 1.200 1.200 peak 1513 spectrum 1 weight 0.10000E+01 volume 0.29294E-02 ppm1 1.914 ppm2 4.356 CV 1
OR { 1513}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 326 and name HA ))
ASSI { 705}
(( segid " " and resid 351 and name HG3 ))
(( segid " " and resid 272 and name HG2 ))
3.400 1.500 1.500 peak 705 spectrum 1 weight 0.10000E+01 volume 0.14943E-02 ppm1 2.063 ppm2 1.755 CV 1
OR { 705}
(( segid " " and resid 351 and name HG3 ))
(( segid " " and resid 272 and name HG3 ))
OR { 705}
(( segid " " and resid 351 and name HG3 ))
(( segid " " and resid 352 and name HG12))
ASSI { 4154}
(( segid " " and resid 236 and name HA ))
(( segid " " and resid 236 and name HB ))
2.500 0.800 0.800 peak 4154 spectrum 1 weight 0.10000E+01 volume 0.57460E-02 ppm1 3.979 ppm2 1.758 CV 1
OR { 4154}
(( segid " " and resid 420 and name HA ))
(( segid " " and resid 420 and name HB ))
ASSI { 729}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 339 and name HG13))
2.700 0.900 0.900 peak 729 spectrum 1 weight 0.10000E+01 volume 0.56109E-02 ppm1 0.748 ppm2 1.544 CV 1
OR { 729}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 339 and name HB ))
OR { 729}
( segid " " and resid 329 and name HG2%)
( segid " " and resid 330 and name HB% )
ASSI { 1916}
(( segid " " and resid 287 and name HB2 ))
( segid " " and resid 356 and name HG2%)
4.300 2.300 1.700 peak 1916 spectrum 1 weight 0.10000E+01 volume 0.62311E-03 ppm1 3.024 ppm2 0.382 CV 1
OR { 1916}
(( segid " " and resid 287 and name HB2 ))
( segid " " and resid 279 and name HD2%)
ASSI { 1167}
(( segid " " and resid 302 and name HB3 ))
( segid " " and resid 290 and name HB% )
2.200 0.600 0.600 peak 1167 spectrum 1 weight 0.10000E+01 volume 0.30366E-02 ppm1 2.080 ppm2 1.543 CV 1
OR { 1167}
(( segid " " and resid 302 and name HB3 ))
(( segid " " and resid 293 and name HG2 ))
ASSI { 579}
( segid " " and resid 271 and name HD1%)
( segid " " and resid 213 and name HD% )
3.600 1.600 1.600 peak 579 spectrum 1 weight 0.10000E+01 volume 0.97271E-03 ppm1 0.841 ppm2 6.714 CV 1
OR { 579}
( segid " " and resid 271 and name HD1%)
(( segid " " and resid 351 and name HE21))
ASSI { 1617}
(( segid " " and resid 373 and name HA ))
(( segid " " and resid 373 and name HB2 ))
3.500 1.500 1.500 peak 1617 spectrum 1 weight 0.10000E+01 volume 0.11842E-02 ppm1 2.341 ppm2 0.464 CV 1
OR { 1617}
(( segid " " and resid 373 and name HA ))
( segid " " and resid 373 and name HD2%)
OR { 1617}
(( segid " " and resid 373 and name HA ))
( segid " " and resid 217 and name HG2%)
ASSI { 490}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 365 and name HE22))
2.900 1.100 1.100 peak 490 spectrum 1 weight 0.10000E+01 volume 0.82893E-03 ppm1 0.434 ppm2 7.544 CV 1
OR { 490}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 371 and name H ))
OR { 490}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 364 and name H ))
ASSI { 1307}
(( segid " " and resid 426 and name HG3 ))
( segid " " and resid 416 and name HD1%)
3.100 1.200 1.200 peak 1307 spectrum 1 weight 0.10000E+01 volume 0.33834E-02 ppm1 1.992 ppm2 0.848 CV 1
OR { 1307}
(( segid " " and resid 426 and name HG3 ))
( segid " " and resid 423 and name HD2%)
OR { 1307}
(( segid " " and resid 426 and name HG3 ))
( segid " " and resid 423 and name HD1%)
ASSI { 478}
( segid " " and resid 361 and name HD% )
(( segid " " and resid 357 and name HA ))
4.400 2.500 1.600 peak 478 spectrum 1 weight 0.10000E+01 volume 0.28195E-03 ppm1 7.139 ppm2 3.854 CV 1
OR { 478}
( segid " " and resid 361 and name HD% )
(( segid " " and resid 343 and name HB3 ))
OR { 478}
( segid " " and resid 361 and name HD% )
(( segid " " and resid 365 and name HA ))
OR { 478}
( segid " " and resid 361 and name HD% )
(( segid " " and resid 369 and name HA2 ))
ASSI { 212}
( segid " " and resid 264 and name HB% )
( segid " " and resid 263 and name HG1%)
3.900 1.900 1.900 peak 212 spectrum 1 weight 0.10000E+01 volume 0.79227E-03 ppm1 0.958 ppm2 0.055 CV 1
OR { 212}
( segid " " and resid 264 and name HB% )
( segid " " and resid 243 and name HD1%)
OR { 212}
( segid " " and resid 236 and name HG2%)
( segid " " and resid 243 and name HD1%)
ASSI { 4187}
(( segid " " and resid 269 and name HA ))
(( segid " " and resid 272 and name H ))
3.600 1.600 1.600 peak 4187 spectrum 1 weight 0.10000E+01 volume 0.63721E-03 ppm1 3.815 ppm2 8.504 CV 1
OR { 4187}
(( segid " " and resid 269 and name HA ))
(( segid " " and resid 270 and name H ))
ASSI { 2712}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 278 and name HB2 ))
2.500 0.800 0.800 peak 2712 spectrum 1 weight 0.10000E+01 volume 0.55602E-02 ppm1 0.380 ppm2 1.194 CV 1
OR { 2712}
( segid " " and resid 318 and name HD1%)
( segid " " and resid 307 and name HD1%)
ASSI { 2957}
( segid " " and resid 204 and name HE% )
(( segid " " and resid 408 and name HB2 ))
3.800 1.800 1.800 peak 2957 spectrum 1 weight 0.10000E+01 volume 0.13364E-02 ppm1 6.859 ppm2 1.948 CV 1
OR { 2957}
( segid " " and resid 204 and name HE% )
(( segid " " and resid 377 and name HB2 ))
OR { 2957}
( segid " " and resid 204 and name HE% )
(( segid " " and resid 377 and name HB3 ))
ASSI { 1580}
( segid " " and resid 207 and name HG2%)
( segid " " and resid 316 and name HD2%)
3.200 1.200 1.200 peak 1580 spectrum 1 weight 0.10000E+01 volume 0.66651E-02 ppm1 0.460 ppm2 0.764 CV 1
OR { 1580}
( segid " " and resid 207 and name HG2%)
( segid " " and resid 316 and name HD1%)
OR { 1580}
( segid " " and resid 217 and name HG2%)
( segid " " and resid 328 and name HG2%)
OR { 1580}
( segid " " and resid 207 and name HG2%)
(( segid " " and resid 209 and name HG ))
OR { 1580}
( segid " " and resid 217 and name HG2%)
( segid " " and resid 323 and name HG1%)
OR { 1580}
( segid " " and resid 217 and name HG2%)
( segid " " and resid 372 and name HG2%)
ASSI { 414}
( segid " " and resid 203 and name HE% )
( segid " " and resid 198 and name HG1%)
4.300 2.300 1.700 peak 414 spectrum 1 weight 0.10000E+01 volume 0.90223E-03 ppm1 2.221 ppm2 0.619 CV 1
OR { 414}
( segid " " and resid 203 and name HE% )
( segid " " and resid 255 and name HD1%)
OR { 414}
( segid " " and resid 203 and name HE% )
( segid " " and resid 198 and name HG2%)
OR { 414}
( segid " " and resid 203 and name HE% )
( segid " " and resid 253 and name HG2%)
OR { 414}
( segid " " and resid 203 and name HE% )
( segid " " and resid 372 and name HG1%)
ASSI { 1743}
( segid " " and resid 212 and name HG1%)
( segid " " and resid 267 and name HD2%)
3.200 1.300 1.300 peak 1743 spectrum 1 weight 0.10000E+01 volume 0.32593E-02 ppm1 -0.343 ppm2 0.920 CV 1
OR { 1743}
( segid " " and resid 212 and name HG1%)
( segid " " and resid 189 and name HG2%)
OR { 1743}
( segid " " and resid 212 and name HG1%)
( segid " " and resid 267 and name HD1%)
ASSI { 951}
( segid " " and resid 287 and name HE% )
( segid " " and resid 279 and name HD2%)
4.700 2.800 1.300 peak 951 spectrum 1 weight 0.10000E+01 volume 0.64285E-03 ppm1 6.957 ppm2 0.377 CV 1
OR { 951}
( segid " " and resid 287 and name HE% )
( segid " " and resid 306 and name HD1%)
OR { 951}
( segid " " and resid 287 and name HE% )
( segid " " and resid 318 and name HD1%)
OR { 951}
( segid " " and resid 287 and name HE% )
( segid " " and resid 356 and name HG2%)
ASSI { 1048}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 351 and name HA ))
4.300 2.400 1.700 peak 1048 spectrum 1 weight 0.10000E+01 volume 0.11870E-02 ppm1 0.725 ppm2 3.835 CV 1
OR { 1048}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 347 and name HB3 ))
OR { 1048}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 357 and name HA ))
OR { 1048}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 347 and name HB2 ))
ASSI { 1595}
( segid " " and resid 295 and name HG2%)
(( segid " " and resid 298 and name HB2 ))
4.000 2.000 2.000 peak 1595 spectrum 1 weight 0.10000E+01 volume 0.33890E-02 ppm1 1.185 ppm2 1.882 CV 1
OR { 1595}
( segid " " and resid 437 and name HG2%)
( segid " " and resid 388 and name HE% )
OR { 1595}
( segid " " and resid 437 and name HG2%)
(( segid " " and resid 439 and name HB3 ))
OR { 1595}
( segid " " and resid 295 and name HG2%)
(( segid " " and resid 301 and name HB3 ))
OR { 1595}
( segid " " and resid 437 and name HG2%)
(( segid " " and resid 439 and name HG ))
ASSI { 688}
( segid " " and resid 315 and name HE% )
(( segid " " and resid 310 and name HB2 ))
4.200 2.200 1.800 peak 688 spectrum 1 weight 0.10000E+01 volume 0.61465E-03 ppm1 6.870 ppm2 1.368 CV 1
OR { 688}
( segid " " and resid 315 and name HE% )
(( segid " " and resid 318 and name HB ))
OR { 688}
( segid " " and resid 315 and name HE% )
(( segid " " and resid 322 and name HB ))
OR { 688}
( segid " " and resid 315 and name HE% )
(( segid " " and resid 322 and name HG12))
ASSI { 922}
(( segid " " and resid 324 and name HD2 ))
(( segid " " and resid 217 and name HB ))
3.900 1.900 1.900 peak 922 spectrum 1 weight 0.10000E+01 volume 0.42857E-03 ppm1 7.154 ppm2 1.616 CV 1
OR { 922}
(( segid " " and resid 324 and name HD2 ))
(( segid " " and resid 374 and name HB2 ))
OR { 922}
(( segid " " and resid 324 and name HD2 ))
(( segid " " and resid 331 and name HD3 ))
OR { 922}
(( segid " " and resid 324 and name HD2 ))
(( segid " " and resid 331 and name HD2 ))
OR { 922}
(( segid " " and resid 324 and name HD2 ))
(( segid " " and resid 374 and name HD2 ))
OR { 922}
(( segid " " and resid 324 and name HD2 ))
(( segid " " and resid 374 and name HD3 ))
ASSI { 200}
(( segid " " and resid 227 and name HB3 ))
( segid " " and resid 230 and name HD1%)
2.600 0.900 0.900 peak 200 spectrum 1 weight 0.10000E+01 volume 0.22189E-02 ppm1 2.826 ppm2 0.630 CV 1
OR { 200}
(( segid " " and resid 313 and name HB2 ))
( segid " " and resid 198 and name HG2%)
ASSI { 3244}
(( segid " " and resid 324 and name HB2 ))
(( segid " " and resid 324 and name H ))
3.400 1.400 1.400 peak 3244 spectrum 1 weight 0.10000E+01 volume 0.62593E-03 ppm1 2.893 ppm2 8.505 CV 1
OR { 3244}
(( segid " " and resid 324 and name HB2 ))
(( segid " " and resid 325 and name H ))
ASSI { 986}
(( segid " " and resid 255 and name HA ))
(( segid " " and resid 257 and name H ))
3.300 1.400 1.400 peak 986 spectrum 1 weight 0.10000E+01 volume 0.12096E-02 ppm1 3.970 ppm2 7.469 CV 1
OR { 986}
(( segid " " and resid 308 and name HA ))
(( segid " " and resid 309 and name H ))
OR { 986}
(( segid " " and resid 255 and name HA ))
(( segid " " and resid 254 and name HD21))
ASSI { 1083}
(( segid " " and resid 376 and name HA ))
(( segid " " and resid 377 and name H ))
2.600 0.800 0.800 peak 1083 spectrum 1 weight 0.10000E+01 volume 0.36877E-02 ppm1 3.871 ppm2 8.201 CV 1
OR { 1083}
(( segid " " and resid 343 and name HB2 ))
(( segid " " and resid 343 and name H ))
OR { 1083}
(( segid " " and resid 343 and name HB3 ))
(( segid " " and resid 343 and name H ))
OR { 1083}
(( segid " " and resid 390 and name HA ))
(( segid " " and resid 391 and name H ))
ASSI { 777}
(( segid " " and resid 308 and name HD3 ))
(( segid " " and resid 306 and name H ))
2.900 2.900 3.100 peak 777 spectrum 1 weight 0.10000E+01 volume 0.83739E-03 ppm1 1.533 ppm2 8.009 CV 1
OR { 777}
(( segid " " and resid 308 and name HD2 ))
(( segid " " and resid 306 and name H ))
OR { 777}
(( segid " " and resid 308 and name HD2 ))
(( segid " " and resid 318 and name H ))
ASSI { 150}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 394 and name H ))
3.400 1.500 1.500 peak 150 spectrum 1 weight 0.10000E+01 volume 0.16127E-02 ppm1 0.557 ppm2 7.577 CV 1
OR { 150}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 442 and name H ))
OR { 150}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 441 and name H ))
ASSI { 3359}
( segid " " and resid 386 and name HB% )
(( segid " " and resid 387 and name H ))
2.900 1.000 1.000 peak 3359 spectrum 1 weight 0.10000E+01 volume 0.46294E-02 ppm1 1.450 ppm2 7.958 CV 1
OR { 3359}
( segid " " and resid 386 and name HB% )
(( segid " " and resid 386 and name H ))
ASSI { 420}
( segid " " and resid 372 and name HG2%)
(( segid " " and resid 371 and name H ))
3.000 3.000 3.000 peak 420 spectrum 1 weight 0.10000E+01 volume 0.13985E-02 ppm1 0.747 ppm2 7.534 CV 1
OR { 420}
( segid " " and resid 372 and name HG2%)
(( segid " " and resid 365 and name HE22))
OR { 420}
( segid " " and resid 372 and name HG2%)
(( segid " " and resid 375 and name HE22))
ASSI { 567}
(( segid " " and resid 415 and name HB3 ))
(( segid " " and resid 412 and name HA ))
4.400 2.400 1.600 peak 567 spectrum 1 weight 0.10000E+01 volume 0.45959E-03 ppm1 2.590 ppm2 3.979 CV 1
OR { 567}
(( segid " " and resid 415 and name HB3 ))
(( segid " " and resid 418 and name HA3 ))
OR { 567}
(( segid " " and resid 415 and name HB3 ))
(( segid " " and resid 414 and name HA ))
ASSI { 3815}
( segid " " and resid 212 and name HG1%)
( segid " " and resid 270 and name HD% )
3.600 1.600 1.600 peak 3815 spectrum 1 weight 0.10000E+01 volume 0.10404E-02 ppm1 -0.341 ppm2 7.174 CV 1
OR { 3815}
( segid " " and resid 212 and name HG1%)
(( segid " " and resid 214 and name H ))
ASSI { 3460}
( segid " " and resid 352 and name HG2%)
( segid " " and resid 356 and name HG2%)
2.100 0.600 0.600 peak 3460 spectrum 1 weight 0.10000E+01 volume 0.94087E-02 ppm1 0.919 ppm2 0.380 CV 1
OR { 3460}
( segid " " and resid 352 and name HG2%)
( segid " " and resid 279 and name HD2%)
ASSI { 36}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 432 and name H ))
4.200 2.200 1.800 peak 36 spectrum 1 weight 0.10000E+01 volume 0.11757E-02 ppm1 0.782 ppm2 8.480 CV 1
OR { 36}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 413 and name H ))
OR { 36}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 412 and name H ))
ASSI { 1575}
( segid " " and resid 201 and name HG2%)
(( segid " " and resid 202 and name HG3 ))
5.100 3.300 0.900 peak 1575 spectrum 1 weight 0.10000E+01 volume 0.57516E-03 ppm1 1.292 ppm2 2.768 CV 1
OR { 1575}
( segid " " and resid 201 and name HG2%)
(( segid " " and resid 213 and name HB3 ))
ASSI { 641}
(( segid " " and resid 321 and name HA ))
( segid " " and resid 321 and name HD1%)
2.100 0.600 0.600 peak 641 spectrum 1 weight 0.10000E+01 volume 0.12603E-01 ppm1 3.993 ppm2 0.872 CV 1
OR { 641}
(( segid " " and resid 267 and name HA ))
( segid " " and resid 267 and name HD2%)
OR { 641}
(( segid " " and resid 321 and name HA ))
( segid " " and resid 325 and name HE% )
OR { 641}
(( segid " " and resid 267 and name HA ))
( segid " " and resid 266 and name HD1%)
OR { 641}
(( segid " " and resid 267 and name HA ))
( segid " " and resid 267 and name HD1%)
ASSI { 4672}
(( segid " " and resid 358 and name HB3 ))
(( segid " " and resid 358 and name HA ))
3.200 1.300 1.300 peak 4672 spectrum 1 weight 0.10000E+01 volume 0.17058E-02 ppm1 2.946 ppm2 4.004 CV 1
OR { 4672}
(( segid " " and resid 358 and name HB3 ))
(( segid " " and resid 355 and name HA ))
ASSI { 843}
(( segid " " and resid 426 and name HG3 ))
(( segid " " and resid 425 and name H ))
4.600 2.700 1.400 peak 843 spectrum 1 weight 0.10000E+01 volume 0.56109E-03 ppm1 1.992 ppm2 7.749 CV 1
OR { 843}
(( segid " " and resid 426 and name HG3 ))
(( segid " " and resid 428 and name H ))
OR { 843}
(( segid " " and resid 426 and name HG3 ))
(( segid " " and resid 430 and name H ))
ASSI { 68}
( segid " " and resid 438 and name HB% )
(( segid " " and resid 441 and name HD3 ))
4.100 2.100 1.900 peak 68 spectrum 1 weight 0.10000E+01 volume 0.13252E-02 ppm1 1.599 ppm2 3.131 CV 1
OR { 68}
( segid " " and resid 438 and name HB% )
(( segid " " and resid 441 and name HD2 ))
OR { 68}
( segid " " and resid 438 and name HB% )
(( segid " " and resid 392 and name HD2 ))
ASSI { 1507}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 361 and name H ))
4.700 2.800 1.300 peak 1507 spectrum 1 weight 0.10000E+01 volume 0.85150E-03 ppm1 -0.166 ppm2 8.376 CV 1
OR { 1507}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 365 and name H ))
ASSI { 4512}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 210 and name HD3 ))
3.700 1.700 1.700 peak 4512 spectrum 1 weight 0.10000E+01 volume 0.11109E-02 ppm1 0.190 ppm2 2.880 CV 1
OR { 4512}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 320 and name HB2 ))
ASSI { 616}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 361 and name HA ))
2.600 0.900 0.900 peak 616 spectrum 1 weight 0.10000E+01 volume 0.16268E-02 ppm1 0.399 ppm2 4.233 CV 1
OR { 616}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 360 and name HA ))
ASSI { 683}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 346 and name HD2%)
3.900 1.900 1.900 peak 683 spectrum 1 weight 0.10000E+01 volume 0.34341E-02 ppm1 0.400 ppm2 0.764 CV 1
OR { 683}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 323 and name HG1%)
OR { 683}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 350 and name HG1%)
OR { 683}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 356 and name HG1%)
OR { 683}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 339 and name HG2%)
OR { 683}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 367 and name HD2%)
ASSI { 136}
( segid " " and resid 240 and name HG2%)
(( segid " " and resid 265 and name HB3 ))
2.900 1.000 1.000 peak 136 spectrum 1 weight 0.10000E+01 volume 0.44154E-02 ppm1 0.773 ppm2 4.003 CV 1
OR { 136}
( segid " " and resid 240 and name HG2%)
(( segid " " and resid 265 and name HB2 ))
OR { 136}
( segid " " and resid 240 and name HG2%)
(( segid " " and resid 266 and name HA ))
OR { 136}
( segid " " and resid 240 and name HG2%)
(( segid " " and resid 242 and name HA ))
ASSI { 1555}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 395 and name HG2 ))
4.100 2.100 1.900 peak 1555 spectrum 1 weight 0.10000E+01 volume 0.14690E-02 ppm1 0.558 ppm2 2.295 CV 1
OR { 1555}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 401 and name HG3 ))
OR { 1555}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 401 and name HG2 ))
OR { 1555}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 445 and name HG3 ))
ASSI { 533}
( segid " " and resid 220 and name HG2%)
(( segid " " and resid 225 and name HG2 ))
3.300 1.400 1.400 peak 533 spectrum 1 weight 0.10000E+01 volume 0.16184E-02 ppm1 1.122 ppm2 2.807 CV 1
OR { 533}
( segid " " and resid 220 and name HG1%)
(( segid " " and resid 216 and name HB3 ))
OR { 533}
( segid " " and resid 220 and name HG2%)
(( segid " " and resid 227 and name HB3 ))
OR { 533}
( segid " " and resid 220 and name HG1%)
(( segid " " and resid 225 and name HG2 ))
OR { 533}
( segid " " and resid 220 and name HG1%)
(( segid " " and resid 227 and name HB3 ))
OR { 533}
( segid " " and resid 220 and name HG2%)
(( segid " " and resid 216 and name HB3 ))
OR { 533}
( segid " " and resid 220 and name HG2%)
(( segid " " and resid 216 and name HG ))
OR { 533}
( segid " " and resid 220 and name HG1%)
(( segid " " and resid 231 and name HB3 ))
OR { 533}
( segid " " and resid 220 and name HG1%)
(( segid " " and resid 231 and name HB2 ))
ASSI { 1138}
(( segid " " and resid 357 and name HB2 ))
( segid " " and resid 357 and name HD2%)
3.200 1.300 1.300 peak 1138 spectrum 1 weight 0.10000E+01 volume 0.78663E-03 ppm1 2.007 ppm2 0.859 CV 1
OR { 1138}
(( segid " " and resid 357 and name HB2 ))
( segid " " and resid 346 and name HD1%)
OR { 1138}
(( segid " " and resid 357 and name HB2 ))
( segid " " and resid 359 and name HG1%)
ASSI { 1525}
( segid " " and resid 255 and name HD1%)
(( segid " " and resid 258 and name HB2 ))
3.900 1.900 1.900 peak 1525 spectrum 1 weight 0.10000E+01 volume 0.12096E-02 ppm1 0.602 ppm2 2.652 CV 1
OR { 1525}
( segid " " and resid 255 and name HD1%)
(( segid " " and resid 258 and name HB3 ))
OR { 1525}
( segid " " and resid 255 and name HD1%)
(( segid " " and resid 254 and name HB2 ))
ASSI { 39}
( segid " " and resid 278 and name HD1%)
(( segid " " and resid 350 and name HB ))
3.200 1.200 1.200 peak 39 spectrum 1 weight 0.10000E+01 volume 0.39247E-02 ppm1 0.646 ppm2 2.484 CV 1
OR { 39}
( segid " " and resid 429 and name HD2%)
(( segid " " and resid 433 and name HG3 ))
ASSI { 4026}
( segid " " and resid 207 and name HG2%)
( segid " " and resid 209 and name HD2%)
3.900 1.900 1.900 peak 4026 spectrum 1 weight 0.10000E+01 volume 0.32170E-02 ppm1 0.459 ppm2 -0.905 CV 1
OR { 4026}
( segid " " and resid 217 and name HG2%)
( segid " " and resid 209 and name HD2%)
ASSI { 718}
( segid " " and resid 367 and name HD2%)
( segid " " and resid 318 and name HG2%)
3.500 1.500 1.500 peak 718 spectrum 1 weight 0.10000E+01 volume 0.17453E-02 ppm1 0.777 ppm2 0.386 CV 1
OR { 718}
( segid " " and resid 367 and name HD2%)
( segid " " and resid 323 and name HG2%)
OR { 718}
( segid " " and resid 367 and name HD2%)
( segid " " and resid 371 and name HG1%)
ASSI { 908}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 197 and name H ))
5.300 3.500 0.700 peak 908 spectrum 1 weight 0.10000E+01 volume 0.36652E-03 ppm1 0.549 ppm2 8.036 CV 1
OR { 908}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 318 and name H ))
ASSI { 282}
( segid " " and resid 266 and name HD1%)
(( segid " " and resid 265 and name H ))
3.700 1.700 1.700 peak 282 spectrum 1 weight 0.10000E+01 volume 0.31184E-02 ppm1 0.883 ppm2 7.743 CV 1
OR { 282}
( segid " " and resid 266 and name HD1%)
(( segid " " and resid 273 and name H ))
ASSI { 543}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 357 and name HA ))
4.100 2.100 1.900 peak 543 spectrum 1 weight 0.10000E+01 volume 0.11193E-02 ppm1 -0.165 ppm2 3.853 CV 1
OR { 543}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 325 and name HA ))
OR { 543}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 320 and name HA ))
OR { 543}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 343 and name HB3 ))
OR { 543}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 365 and name HA ))
ASSI { 875}
(( segid " " and resid 200 and name HD2 ))
(( segid " " and resid 200 and name H ))
3.700 1.800 1.800 peak 875 spectrum 1 weight 0.10000E+01 volume 0.24699E-02 ppm1 3.233 ppm2 7.567 CV 1
OR { 875}
(( segid " " and resid 403 and name HD2 ))
(( segid " " and resid 403 and name H ))
OR { 875}
(( segid " " and resid 403 and name HD3 ))
(( segid " " and resid 403 and name H ))
OR { 875}
(( segid " " and resid 272 and name HD3 ))
(( segid " " and resid 351 and name HE22))
OR { 875}
(( segid " " and resid 272 and name HD2 ))
(( segid " " and resid 351 and name HE22))
OR { 875}
(( segid " " and resid 272 and name HD2 ))
(( segid " " and resid 350 and name H ))
ASSI { 96}
(( segid " " and resid 210 and name HD2 ))
(( segid " " and resid 209 and name HG ))
3.500 1.500 1.500 peak 96 spectrum 1 weight 0.10000E+01 volume 0.54135E-03 ppm1 3.318 ppm2 0.746 CV 1
OR { 96}
(( segid " " and resid 210 and name HD2 ))
( segid " " and resid 194 and name HD1%)
OR { 96}
(( segid " " and resid 210 and name HD2 ))
( segid " " and resid 316 and name HD2%)
ASSI { 4506}
( segid " " and resid 373 and name HD2%)
(( segid " " and resid 324 and name HB3 ))
2.600 2.600 3.400 peak 4506 spectrum 1 weight 0.10000E+01 volume 0.10996E-02 ppm1 0.514 ppm2 3.277 CV 1
OR { 4506}
( segid " " and resid 373 and name HD2%)
(( segid " " and resid 320 and name HB3 ))
ASSI { 1490}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 357 and name HD1%)
3.800 1.800 1.800 peak 1490 spectrum 1 weight 0.10000E+01 volume 0.28787E-02 ppm1 0.390 ppm2 0.675 CV 1
OR { 1490}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 321 and name HD2%)
OR { 1490}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 350 and name HG1%)
OR { 1490}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 339 and name HG2%)
OR { 1490}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 350 and name HG2%)
OR { 1490}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 367 and name HD1%)
ASSI { 860}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 271 and name HB3 ))
2.900 2.900 3.100 peak 860 spectrum 1 weight 0.10000E+01 volume 0.27687E-02 ppm1 0.181 ppm2 1.081 CV 1
OR { 860}
( segid " " and resid 317 and name HD1%)
( segid " " and resid 310 and name HD1%)
OR { 860}
( segid " " and resid 317 and name HD1%)
( segid " " and resid 307 and name HD2%)
ASSI { 2851}
(( segid " " and resid 287 and name HB2 ))
(( segid " " and resid 288 and name H ))
4.300 2.300 1.700 peak 2851 spectrum 1 weight 0.10000E+01 volume 0.28195E-03 ppm1 3.038 ppm2 7.470 CV 1
OR { 2851}
(( segid " " and resid 287 and name HB2 ))
(( segid " " and resid 286 and name H ))
ASSI { 382}
(( segid " " and resid 303 and name HA ))
(( segid " " and resid 302 and name HG2 ))
4.600 2.700 1.400 peak 382 spectrum 1 weight 0.10000E+01 volume 0.67102E-03 ppm1 3.823 ppm2 2.272 CV 1
OR { 382}
(( segid " " and resid 303 and name HA ))
(( segid " " and resid 304 and name HG3 ))
OR { 382}
(( segid " " and resid 233 and name HA ))
(( segid " " and resid 261 and name HB2 ))
OR { 382}
(( segid " " and resid 303 and name HA ))
(( segid " " and resid 304 and name HB2 ))
OR { 382}
(( segid " " and resid 303 and name HA ))
(( segid " " and resid 283 and name HB2 ))
ASSI { 100}
(( segid " " and resid 319 and name HA ))
( segid " " and resid 371 and name HG2%)
5.200 3.300 0.800 peak 100 spectrum 1 weight 0.10000E+01 volume 0.35527E-03 ppm1 2.285 ppm2 0.981 CV 1
OR { 100}
(( segid " " and resid 319 and name HA ))
(( segid " " and resid 318 and name HG12))
OR { 100}
(( segid " " and resid 319 and name HA ))
( segid " " and resid 307 and name HD2%)
ASSI { 217}
( segid " " and resid 189 and name HG2%)
( segid " " and resid 197 and name HB% )
3.100 1.200 1.200 peak 217 spectrum 1 weight 0.10000E+01 volume 0.44549E-02 ppm1 0.940 ppm2 1.449 CV 1
OR { 217}
( segid " " and resid 189 and name HG2%)
(( segid " " and resid 210 and name HB3 ))
ASSI { 1280}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 284 and name HA ))
3.700 1.700 1.700 peak 1280 spectrum 1 weight 0.10000E+01 volume 0.81483E-03 ppm1 0.599 ppm2 4.290 CV 1
OR { 1280}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 360 and name HA ))
ASSI { 1040}
(( segid " " and resid 364 and name HA ))
(( segid " " and resid 368 and name H ))
4.400 2.500 1.600 peak 1040 spectrum 1 weight 0.10000E+01 volume 0.36934E-03 ppm1 3.657 ppm2 8.202 CV 1
OR { 1040}
(( segid " " and resid 364 and name HA ))
(( segid " " and resid 322 and name H ))
ASSI { 1584}
(( segid " " and resid 309 and name HG2 ))
( segid " " and resid 306 and name HD1%)
3.700 1.700 1.700 peak 1584 spectrum 1 weight 0.10000E+01 volume 0.18806E-02 ppm1 2.298 ppm2 0.379 CV 1
OR { 1584}
(( segid " " and resid 288 and name HG2 ))
( segid " " and resid 356 and name HG2%)
ASSI { 2124}
(( segid " " and resid 309 and name HG2 ))
(( segid " " and resid 309 and name H ))
2.100 0.600 0.600 peak 2124 spectrum 1 weight 0.10000E+01 volume 0.53684E-02 ppm1 2.296 ppm2 7.495 CV 1
OR { 2124}
(( segid " " and resid 288 and name HG2 ))
(( segid " " and resid 288 and name H ))
ASSI { 3877}
(( segid " " and resid 444 and name HG3 ))
(( segid " " and resid 444 and name HA ))
3.000 1.200 1.200 peak 3877 spectrum 1 weight 0.10000E+01 volume 0.72433E-02 ppm1 1.660 ppm2 4.236 CV 1
OR { 3877}
(( segid " " and resid 389 and name HG3 ))
(( segid " " and resid 389 and name HA ))
ASSI { 1210}
( segid " " and resid 267 and name HD2%)
(( segid " " and resid 217 and name H ))
3.500 1.500 1.500 peak 1210 spectrum 1 weight 0.10000E+01 volume 0.35244E-02 ppm1 0.903 ppm2 7.497 CV 1
OR { 1210}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 309 and name H ))
OR { 1210}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 286 and name H ))
ASSI { 1283}
(( segid " " and resid 343 and name HA ))
(( segid " " and resid 346 and name HB3 ))
3.700 1.700 1.700 peak 1283 spectrum 1 weight 0.10000E+01 volume 0.71333E-03 ppm1 4.018 ppm2 1.472 CV 1
OR { 1283}
(( segid " " and resid 280 and name HA ))
(( segid " " and resid 279 and name HB3 ))
OR { 1283}
(( segid " " and resid 345 and name HA ))
(( segid " " and resid 346 and name HB3 ))
OR { 1283}
(( segid " " and resid 345 and name HA ))
(( segid " " and resid 232 and name HG3 ))
OR { 1283}
(( segid " " and resid 280 and name HA ))
(( segid " " and resid 278 and name HB3 ))
OR { 1283}
(( segid " " and resid 280 and name HA ))
(( segid " " and resid 279 and name HG ))
ASSI { 237}
(( segid " " and resid 358 and name HB3 ))
(( segid " " and resid 359 and name H ))
2.800 1.000 1.000 peak 237 spectrum 1 weight 0.10000E+01 volume 0.60619E-03 ppm1 2.953 ppm2 7.178 CV 1
OR { 237}
(( segid " " and resid 358 and name HB3 ))
( segid " " and resid 361 and name HD% )
ASSI { 1175}
(( segid " " and resid 331 and name HB2 ))
( segid " " and resid 328 and name HG1%)
3.800 1.800 1.800 peak 1175 spectrum 1 weight 0.10000E+01 volume 0.43985E-03 ppm1 2.534 ppm2 0.761 CV 1
OR { 1175}
(( segid " " and resid 331 and name HB2 ))
( segid " " and resid 329 and name HG2%)
ASSI { 343}
( segid " " and resid 420 and name HG2%)
(( segid " " and resid 425 and name HE3 ))
3.600 1.600 1.600 peak 343 spectrum 1 weight 0.10000E+01 volume 0.17848E-02 ppm1 0.805 ppm2 2.888 CV 1
OR { 343}
( segid " " and resid 420 and name HG2%)
(( segid " " and resid 425 and name HE2 ))
OR { 343}
( segid " " and resid 420 and name HG2%)
(( segid " " and resid 421 and name HE3 ))
ASSI { 473}
( segid " " and resid 371 and name HG2%)
(( segid " " and resid 370 and name HD21))
3.400 1.400 1.400 peak 473 spectrum 1 weight 0.10000E+01 volume 0.13195E-02 ppm1 0.960 ppm2 6.856 CV 1
OR { 473}
( segid " " and resid 376 and name HG1%)
( segid " " and resid 204 and name HE% )
ASSI { 288}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 214 and name HD2 ))
2.900 1.100 1.100 peak 288 spectrum 1 weight 0.10000E+01 volume 0.26306E-02 ppm1 0.886 ppm2 2.948 CV 1
OR { 288}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 374 and name HE3 ))
OR { 288}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 374 and name HE2 ))
OR { 288}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 210 and name HD3 ))
ASSI { 298}
(( segid " " and resid 334 and name HG3 ))
(( segid " " and resid 331 and name HE3 ))
3.000 3.000 3.000 peak 298 spectrum 1 weight 0.10000E+01 volume 0.12603E-02 ppm1 2.145 ppm2 2.902 CV 1
OR { 298}
(( segid " " and resid 334 and name HG3 ))
(( segid " " and resid 331 and name HE2 ))
OR { 298}
(( segid " " and resid 334 and name HG3 ))
(( segid " " and resid 336 and name HE2 ))
OR { 298}
(( segid " " and resid 334 and name HG3 ))
(( segid " " and resid 336 and name HE3 ))
ASSI { 941}
( segid " " and resid 330 and name HB% )
( segid " " and resid 329 and name HG2%)
3.500 1.500 1.500 peak 941 spectrum 1 weight 0.10000E+01 volume 0.47874E-02 ppm1 1.554 ppm2 0.751 CV 1
OR { 941}
( segid " " and resid 330 and name HB% )
( segid " " and resid 328 and name HG1%)
ASSI { 1692}
(( segid " " and resid 183 and name HG2 ))
(( segid " " and resid 183 and name HA ))
3.100 1.200 1.200 peak 1692 spectrum 1 weight 0.10000E+01 volume 0.26503E-02 ppm1 2.522 ppm2 4.702 CV 1
OR { 1692}
(( segid " " and resid 377 and name HG2 ))
(( segid " " and resid 377 and name HA ))
ASSI { 1495}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 351 and name HA ))
3.800 1.800 1.800 peak 1495 spectrum 1 weight 0.10000E+01 volume 0.24671E-02 ppm1 2.151 ppm2 3.826 CV 1
OR { 1495}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 357 and name HA ))
ASSI { 4706}
( segid " " and resid 297 and name HG2%)
(( segid " " and resid 298 and name H ))
3.100 1.200 1.200 peak 4706 spectrum 1 weight 0.10000E+01 volume 0.87515E-02 ppm1 1.116 ppm2 7.348 CV 1
OR { 4706}
( segid " " and resid 297 and name HG2%)
(( segid " " and resid 301 and name HE22))
ASSI { 390}
(( segid " " and resid 398 and name HB ))
(( segid " " and resid 395 and name HA ))
3.700 1.700 1.700 peak 390 spectrum 1 weight 0.10000E+01 volume 0.79791E-03 ppm1 1.770 ppm2 3.755 CV 1
OR { 390}
(( segid " " and resid 398 and name HB ))
(( segid " " and resid 399 and name HA ))
OR { 390}
(( segid " " and resid 398 and name HB ))
(( segid " " and resid 397 and name HA2 ))
OR { 390}
(( segid " " and resid 420 and name HB ))
(( segid " " and resid 419 and name HA2 ))
OR { 390}
(( segid " " and resid 398 and name HB ))
(( segid " " and resid 397 and name HA3 ))
ASSI { 3204}
(( segid " " and resid 436 and name HB3 ))
(( segid " " and resid 437 and name H ))
3.600 1.600 1.600 peak 3204 spectrum 1 weight 0.10000E+01 volume 0.39754E-03 ppm1 2.015 ppm2 8.195 CV 1
OR { 3204}
(( segid " " and resid 436 and name HB3 ))
(( segid " " and resid 435 and name H ))
ASSI { 3104}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 278 and name HG ))
4.100 2.100 1.900 peak 3104 spectrum 1 weight 0.10000E+01 volume 0.16184E-02 ppm1 0.169 ppm2 1.728 CV 1
OR { 3104}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 321 and name HG ))
ASSI { 192}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 214 and name HA ))
4.100 2.100 1.900 peak 192 spectrum 1 weight 0.10000E+01 volume 0.60055E-03 ppm1 0.460 ppm2 3.567 CV 1
OR { 192}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 213 and name HA ))
ASSI { 996}
(( segid " " and resid 300 and name HA ))
( segid " " and resid 303 and name HD% )
4.000 2.000 2.000 peak 996 spectrum 1 weight 0.10000E+01 volume 0.62029E-03 ppm1 2.910 ppm2 7.085 CV 1
OR { 996}
(( segid " " and resid 300 and name HA ))
(( segid " " and resid 363 and name HD2 ))
ASSI { 1608}
( segid " " and resid 344 and name HG2%)
(( segid " " and resid 341 and name HB3 ))
4.100 2.200 1.900 peak 1608 spectrum 1 weight 0.10000E+01 volume 0.13111E-02 ppm1 0.896 ppm2 2.812 CV 1
OR { 1608}
( segid " " and resid 344 and name HG2%)
(( segid " " and resid 231 and name HB2 ))
OR { 1608}
( segid " " and resid 344 and name HG2%)
(( segid " " and resid 231 and name HB3 ))
ASSI { 822}
( segid " " and resid 364 and name HG1%)
(( segid " " and resid 323 and name H ))
3.400 1.400 1.400 peak 822 spectrum 1 weight 0.10000E+01 volume 0.18919E-02 ppm1 1.049 ppm2 7.786 CV 1
OR { 822}
( segid " " and resid 364 and name HG1%)
(( segid " " and resid 369 and name H ))
ASSI { 1238}
( segid " " and resid 361 and name HD% )
( segid " " and resid 322 and name HG2%)
2.900 1.100 1.100 peak 1238 spectrum 1 weight 0.10000E+01 volume 0.12631E-02 ppm1 7.149 ppm2 0.395 CV 1
OR { 1238}
( segid " " and resid 368 and name HD% )
( segid " " and resid 323 and name HG2%)
OR { 1238}
( segid " " and resid 368 and name HD% )
( segid " " and resid 371 and name HG1%)
OR { 1238}
( segid " " and resid 361 and name HD% )
( segid " " and resid 323 and name HG2%)
ASSI { 728}
( segid " " and resid 219 and name HE% )
(( segid " " and resid 256 and name HB2 ))
5.100 3.300 0.900 peak 728 spectrum 1 weight 0.10000E+01 volume 0.80073E-03 ppm1 6.399 ppm2 1.998 CV 1
OR { 728}
( segid " " and resid 219 and name HE% )
(( segid " " and resid 259 and name HB2 ))
ASSI { 1063}
(( segid " " and resid 318 and name HG12))
( segid " " and resid 360 and name HE% )
3.400 1.500 1.500 peak 1063 spectrum 1 weight 0.10000E+01 volume 0.93890E-03 ppm1 0.990 ppm2 7.062 CV 1
OR { 1063}
(( segid " " and resid 318 and name HG12))
( segid " " and resid 360 and name HD% )
OR { 1063}
(( segid " " and resid 318 and name HG12))
( segid " " and resid 315 and name HD% )
ASSI { 3984}
(( segid " " and resid 428 and name HA ))
(( segid " " and resid 428 and name H ))
2.700 0.900 0.900 peak 3984 spectrum 1 weight 0.10000E+01 volume 0.34201E-02 ppm1 4.117 ppm2 7.769 CV 1
OR { 3984}
(( segid " " and resid 417 and name HA ))
(( segid " " and resid 417 and name H ))
ASSI { 1013}
( segid " " and resid 267 and name HD2%)
( segid " " and resid 317 and name HD1%)
4.100 2.100 1.900 peak 1013 spectrum 1 weight 0.10000E+01 volume 0.17453E-02 ppm1 0.905 ppm2 0.189 CV 1
OR { 1013}
( segid " " and resid 283 and name HD2%)
( segid " " and resid 279 and name HD1%)
ASSI { 63}
( segid " " and resid 300 and name HG2%)
(( segid " " and resid 301 and name HG2 ))
2.500 0.800 0.800 peak 63 spectrum 1 weight 0.10000E+01 volume 0.45170E-02 ppm1 0.538 ppm2 2.461 CV 1
OR { 63}
( segid " " and resid 300 and name HG2%)
(( segid " " and resid 304 and name HG2 ))
ASSI { 907}
( segid " " and resid 439 and name HD1%)
(( segid " " and resid 398 and name HA ))
3.700 1.700 1.700 peak 907 spectrum 1 weight 0.10000E+01 volume 0.77252E-03 ppm1 0.810 ppm2 3.407 CV 1
OR { 907}
( segid " " and resid 439 and name HD1%)
(( segid " " and resid 402 and name HA ))
ASSI { 340}
( segid " " and resid 207 and name HG2%)
( segid " " and resid 209 and name HD1%)
4.400 2.500 1.600 peak 340 spectrum 1 weight 0.10000E+01 volume 0.14661E-02 ppm1 0.463 ppm2 0.193 CV 1
OR { 340}
( segid " " and resid 217 and name HG2%)
( segid " " and resid 209 and name HD1%)
ASSI { 32}
( segid " " and resid 236 and name HG2%)
(( segid " " and resid 239 and name HG3 ))
3.000 1.100 1.100 peak 32 spectrum 1 weight 0.10000E+01 volume 0.96992E-02 ppm1 0.961 ppm2 1.577 CV 1
OR { 32}
( segid " " and resid 236 and name HG2%)
(( segid " " and resid 236 and name HG13))
OR { 32}
( segid " " and resid 264 and name HB% )
(( segid " " and resid 267 and name HB2 ))
OR { 32}
( segid " " and resid 264 and name HB% )
(( segid " " and resid 263 and name HB ))
ASSI { 1431}
( segid " " and resid 225 and name HE% )
( segid " " and resid 217 and name HG2%)
3.300 1.400 1.400 peak 1431 spectrum 1 weight 0.10000E+01 volume 0.47987E-02 ppm1 1.913 ppm2 0.470 CV 1
OR { 1431}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 217 and name HG13))
OR { 1431}
( segid " " and resid 225 and name HE% )
( segid " " and resid 373 and name HD2%)
OR { 1431}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 217 and name HG12))
OR { 1431}
( segid " " and resid 225 and name HE% )
( segid " " and resid 342 and name HG2%)
ASSI { 1642}
( segid " " and resid 373 and name HD2%)
(( segid " " and resid 323 and name H ))
3.000 3.000 3.000 peak 1642 spectrum 1 weight 0.10000E+01 volume 0.44831E-03 ppm1 0.515 ppm2 7.775 CV 1
OR { 1642}
( segid " " and resid 373 and name HD2%)
(( segid " " and resid 369 and name H ))
ASSI { 476}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 310 and name HG ))
4.100 2.100 1.900 peak 476 spectrum 1 weight 0.10000E+01 volume 0.20526E-02 ppm1 0.168 ppm2 2.159 CV 1
OR { 476}
( segid " " and resid 279 and name HD1%)
( segid " " and resid 284 and name HE% )
ASSI { 1928}
(( segid " " and resid 415 and name HA ))
(( segid " " and resid 415 and name H ))
3.400 1.400 1.400 peak 1928 spectrum 1 weight 0.10000E+01 volume 0.11729E-02 ppm1 4.396 ppm2 7.972 CV 1
OR { 1928}
(( segid " " and resid 415 and name HA ))
(( segid " " and resid 416 and name H ))
ASSI { 1603}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 439 and name HA ))
3.000 1.100 1.100 peak 1603 spectrum 1 weight 0.10000E+01 volume 0.31240E-02 ppm1 0.807 ppm2 3.778 CV 1
OR { 1603}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 399 and name HA ))
OR { 1603}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 440 and name HA ))
OR { 1603}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 395 and name HA ))
OR { 1603}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 397 and name HA3 ))
ASSI { 363}
(( segid " " and resid 307 and name HA ))
(( segid " " and resid 308 and name H ))
3.600 1.600 1.600 peak 363 spectrum 1 weight 0.10000E+01 volume 0.90223E-03 ppm1 4.157 ppm2 7.046 CV 1
OR { 363}
(( segid " " and resid 307 and name HA ))
(( segid " " and resid 310 and name H ))
OR { 363}
(( segid " " and resid 307 and name HA ))
( segid " " and resid 315 and name HD% )
ASSI { 859}
(( segid " " and resid 293 and name HG3 ))
(( segid " " and resid 293 and name HG2 ))
1.900 0.500 0.500 peak 859 spectrum 1 weight 0.10000E+01 volume 0.25545E-02 ppm1 2.023 ppm2 1.542 CV 1
OR { 859}
(( segid " " and resid 293 and name HG3 ))
( segid " " and resid 290 and name HB% )
OR { 859}
(( segid " " and resid 293 and name HG3 ))
(( segid " " and resid 299 and name HD3 ))
ASSI { 1243}
( segid " " and resid 346 and name HD2%)
( segid " " and resid 361 and name HE% )
3.200 1.200 1.200 peak 1243 spectrum 1 weight 0.10000E+01 volume 0.44916E-02 ppm1 0.748 ppm2 7.065 CV 1
OR { 1243}
( segid " " and resid 346 and name HD2%)
( segid " " and resid 360 and name HD% )
OR { 1243}
( segid " " and resid 346 and name HD2%)
(( segid " " and resid 349 and name H ))
ASSI { 1241}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 351 and name HA ))
5.000 3.200 1.000 peak 1241 spectrum 1 weight 0.10000E+01 volume 0.47648E-03 ppm1 2.587 ppm2 3.819 CV 1
OR { 1241}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 351 and name HA ))
OR { 1241}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 357 and name HA ))
OR { 1241}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 357 and name HA ))
ASSI { 668}
( segid " " and resid 394 and name HG2%)
(( segid " " and resid 396 and name H ))
4.200 2.200 1.800 peak 668 spectrum 1 weight 0.10000E+01 volume 0.10601E-02 ppm1 1.230 ppm2 8.676 CV 1
OR { 668}
( segid " " and resid 394 and name HG2%)
(( segid " " and resid 398 and name H ))
ASSI { 145}
(( segid " " and resid 320 and name HE3 ))
(( segid " " and resid 209 and name HG ))
3.900 1.900 1.900 peak 145 spectrum 1 weight 0.10000E+01 volume 0.48494E-03 ppm1 6.057 ppm2 0.754 CV 1
OR { 145}
(( segid " " and resid 320 and name HE3 ))
( segid " " and resid 372 and name HG2%)
OR { 145}
(( segid " " and resid 320 and name HE3 ))
( segid " " and resid 323 and name HG1%)
OR { 145}
(( segid " " and resid 320 and name HE3 ))
( segid " " and resid 328 and name HG2%)
OR { 145}
(( segid " " and resid 320 and name HE3 ))
( segid " " and resid 346 and name HD2%)
ASSI { 314}
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(( segid " " and resid 376 and name HA ))
3.400 1.400 1.400 peak 314 spectrum 1 weight 0.10000E+01 volume 0.93325E-03 ppm1 2.420 ppm2 3.871 CV 1
OR { 314}
(( segid " " and resid 183 and name HG3 ))
(( segid " " and resid 182 and name HA ))
OR { 314}
(( segid " " and resid 377 and name HG3 ))
(( segid " " and resid 405 and name HA ))
OR { 314}
(( segid " " and resid 377 and name HG3 ))
(( segid " " and resid 401 and name HA ))
ASSI { 3054}
(( segid " " and resid 444 and name HG2 ))
(( segid " " and resid 444 and name HA ))
2.800 1.000 1.000 peak 3054 spectrum 1 weight 0.10000E+01 volume 0.73392E-02 ppm1 1.599 ppm2 4.233 CV 1
OR { 3054}
(( segid " " and resid 389 and name HG2 ))
(( segid " " and resid 389 and name HA ))
ASSI { 1261}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 307 and name HA ))
3.700 1.700 1.700 peak 1261 spectrum 1 weight 0.10000E+01 volume 0.16184E-02 ppm1 0.379 ppm2 4.138 CV 1
OR { 1261}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 309 and name HA ))
ASSI { 959}
( segid " " and resid 361 and name HD% )
( segid " " and resid 364 and name HG1%)
3.600 1.600 1.600 peak 959 spectrum 1 weight 0.10000E+01 volume 0.11363E-02 ppm1 7.149 ppm2 1.044 CV 1
OR { 959}
( segid " " and resid 368 and name HD% )
( segid " " and resid 364 and name HG1%)
OR { 959}
( segid " " and resid 368 and name HD% )
(( segid " " and resid 367 and name HB2 ))
OR { 959}
( segid " " and resid 368 and name HD% )
( segid " " and resid 307 and name HD2%)
ASSI { 349}
(( segid " " and resid 309 and name HG3 ))
( segid " " and resid 283 and name HD1%)
2.500 0.800 0.800 peak 349 spectrum 1 weight 0.10000E+01 volume 0.27180E-02 ppm1 2.175 ppm2 0.718 CV 1
OR { 349}
(( segid " " and resid 192 and name HB ))
( segid " " and resid 192 and name HG2%)
ASSI { 672}
(( segid " " and resid 393 and name HG3 ))
( segid " " and resid 394 and name HG2%)
4.100 2.100 1.900 peak 672 spectrum 1 weight 0.10000E+01 volume 0.24699E-02 ppm1 2.271 ppm2 1.257 CV 1
OR { 672}
(( segid " " and resid 393 and name HG3 ))
( segid " " and resid 446 and name HB% )
ASSI { 23}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 401 and name H ))
4.300 2.300 1.700 peak 23 spectrum 1 weight 0.10000E+01 volume 0.88813E-03 ppm1 0.806 ppm2 7.768 CV 1
OR { 23}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 395 and name HE21))
OR { 23}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 444 and name H ))
ASSI { 167}
( segid " " and resid 373 and name HD2%)
(( segid " " and resid 374 and name H ))
2.800 2.800 3.200 peak 167 spectrum 1 weight 0.10000E+01 volume 0.70487E-03 ppm1 0.512 ppm2 6.322 CV 1
OR { 167}
( segid " " and resid 373 and name HD2%)
(( segid " " and resid 213 and name HZ ))
ASSI { 493}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 310 and name HG ))
3.000 3.000 3.000 peak 493 spectrum 1 weight 0.10000E+01 volume 0.16720E-02 ppm1 0.350 ppm2 2.142 CV 1
OR { 493}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 364 and name HB ))
ASSI { 335}
( segid " " and resid 278 and name HD1%)
(( segid " " and resid 278 and name HG ))
2.100 0.500 0.500 peak 335 spectrum 1 weight 0.10000E+01 volume 0.14780E-01 ppm1 0.647 ppm2 1.759 CV 1
OR { 335}
( segid " " and resid 429 and name HD2%)
(( segid " " and resid 429 and name HB3 ))
OR { 335}
( segid " " and resid 412 and name HD2%)
(( segid " " and resid 412 and name HB2 ))
ASSI { 2369}
(( segid " " and resid 445 and name HA ))
(( segid " " and resid 446 and name H ))
2.700 0.900 0.900 peak 2369 spectrum 1 weight 0.10000E+01 volume 0.72630E-02 ppm1 4.227 ppm2 7.636 CV 1
OR { 2369}
(( segid " " and resid 444 and name HA ))
(( segid " " and resid 446 and name H ))
ASSI { 2709}
(( segid " " and resid 361 and name HB2 ))
(( segid " " and resid 361 and name H ))
3.400 1.400 1.400 peak 2709 spectrum 1 weight 0.10000E+01 volume 0.46802E-03 ppm1 3.083 ppm2 8.375 CV 1
OR { 2709}
(( segid " " and resid 338 and name HB3 ))
(( segid " " and resid 339 and name H ))
ASSI { 249}
( segid " " and resid 279 and name HD2%)
(( segid " " and resid 280 and name H ))
5.200 3.400 0.800 peak 249 spectrum 1 weight 0.10000E+01 volume 0.37780E-03 ppm1 0.372 ppm2 7.632 CV 1
OR { 249}
( segid " " and resid 279 and name HD2%)
(( segid " " and resid 277 and name HD21))
ASSI { 190}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 302 and name HG2 ))
3.100 1.200 1.200 peak 190 spectrum 1 weight 0.10000E+01 volume 0.19144E-02 ppm1 -0.357 ppm2 2.253 CV 1
OR { 190}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 304 and name HB2 ))
OR { 190}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 309 and name HG2 ))
OR { 190}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 304 and name HG3 ))
ASSI { 1342}
( segid " " and resid 307 and name HD2%)
(( segid " " and resid 304 and name HA ))
2.800 1.000 1.000 peak 1342 spectrum 1 weight 0.10000E+01 volume 0.29971E-02 ppm1 1.028 ppm2 3.950 CV 1
OR { 1342}
( segid " " and resid 307 and name HD2%)
(( segid " " and resid 308 and name HA ))
ASSI { 488}
(( segid " " and resid 358 and name HB2 ))
(( segid " " and resid 359 and name H ))
4.300 2.300 1.700 peak 488 spectrum 1 weight 0.10000E+01 volume 0.82329E-03 ppm1 3.271 ppm2 7.180 CV 1
OR { 488}
(( segid " " and resid 358 and name HB2 ))
( segid " " and resid 361 and name HD% )
ASSI { 71}
( segid " " and resid 315 and name HE% )
(( segid " " and resid 308 and name HA ))
3.900 1.900 1.900 peak 71 spectrum 1 weight 0.10000E+01 volume 0.69077E-03 ppm1 6.879 ppm2 4.000 CV 1
OR { 71}
( segid " " and resid 315 and name HE% )
(( segid " " and resid 304 and name HA ))
OR { 71}
( segid " " and resid 315 and name HE% )
(( segid " " and resid 367 and name HA ))
ASSI { 484}
(( segid " " and resid 327 and name HD2 ))
( segid " " and resid 323 and name HG1%)
4.600 2.700 1.400 peak 484 spectrum 1 weight 0.10000E+01 volume 0.40600E-03 ppm1 7.218 ppm2 0.750 CV 1
OR { 484}
(( segid " " and resid 327 and name HD2 ))
( segid " " and resid 372 and name HG2%)
ASSI { 1139}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 440 and name HE2 ))
3.700 1.700 1.700 peak 1139 spectrum 1 weight 0.10000E+01 volume 0.14774E-02 ppm1 0.700 ppm2 2.841 CV 1
OR { 1139}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 399 and name HE2 ))
OR { 1139}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 399 and name HE3 ))
ASSI { 727}
(( segid " " and resid 306 and name HG ))
(( segid " " and resid 287 and name H ))
3.800 1.800 1.800 peak 727 spectrum 1 weight 0.10000E+01 volume 0.81483E-03 ppm1 1.349 ppm2 8.007 CV 1
OR { 727}
(( segid " " and resid 306 and name HG ))
(( segid " " and resid 306 and name H ))
ASSI { 389}
(( segid " " and resid 430 and name HD1 ))
(( segid " " and resid 431 and name H ))
5.300 3.500 0.700 peak 389 spectrum 1 weight 0.10000E+01 volume 0.42575E-03 ppm1 7.181 ppm2 8.003 CV 1
OR { 389}
(( segid " " and resid 430 and name HD1 ))
(( segid " " and resid 427 and name H ))
ASSI { 48}
(( segid " " and resid 267 and name HA ))
( segid " " and resid 270 and name HD% )
4.400 2.500 1.600 peak 48 spectrum 1 weight 0.10000E+01 volume 0.59208E-03 ppm1 3.996 ppm2 7.187 CV 1
OR { 48}
(( segid " " and resid 267 and name HA ))
( segid " " and resid 190 and name HE% )
OR { 48}
(( segid " " and resid 321 and name HA ))
(( segid " " and resid 324 and name HD2 ))
OR { 48}
(( segid " " and resid 321 and name HA ))
( segid " " and resid 361 and name HD% )
ASSI { 1418}
(( segid " " and resid 207 and name HG13))
(( segid " " and resid 207 and name HA ))
3.800 1.800 1.800 peak 1418 spectrum 1 weight 0.10000E+01 volume 0.16494E-02 ppm1 1.029 ppm2 3.791 CV 1
OR { 1418}
( segid " " and resid 307 and name HD2%)
(( segid " " and resid 315 and name HA ))
OR { 1418}
(( segid " " and resid 207 and name HG13))
(( segid " " and resid 206 and name HA3 ))
ASSI { 1081}
(( segid " " and resid 305 and name HD2 ))
(( segid " " and resid 305 and name HB2 ))
2.100 0.500 0.500 peak 1081 spectrum 1 weight 0.10000E+01 volume 0.22717E-01 ppm1 3.135 ppm2 1.837 CV 1
OR { 1081}
(( segid " " and resid 305 and name HD2 ))
(( segid " " and resid 305 and name HB3 ))
OR { 1081}
(( segid " " and resid 444 and name HD2 ))
(( segid " " and resid 444 and name HB2 ))
OR { 1081}
(( segid " " and resid 444 and name HD3 ))
(( segid " " and resid 444 and name HB2 ))
OR { 1081}
(( segid " " and resid 305 and name HD2 ))
(( segid " " and resid 309 and name HB2 ))
ASSI { 1614}
(( segid " " and resid 299 and name HD2 ))
(( segid " " and resid 296 and name HA ))
2.200 0.600 0.600 peak 1614 spectrum 1 weight 0.10000E+01 volume 0.45875E-02 ppm1 1.604 ppm2 3.778 CV 1
OR { 1614}
(( segid " " and resid 399 and name HD3 ))
(( segid " " and resid 399 and name HA ))
OR { 1614}
(( segid " " and resid 399 and name HD2 ))
(( segid " " and resid 399 and name HA ))
OR { 1614}
(( segid " " and resid 299 and name HD3 ))
(( segid " " and resid 296 and name HA ))
OR { 1614}
(( segid " " and resid 299 and name HD3 ))
(( segid " " and resid 299 and name HA ))
ASSI { 148}
(( segid " " and resid 272 and name HD2 ))
(( segid " " and resid 269 and name HG2 ))
3.600 1.600 1.600 peak 148 spectrum 1 weight 0.10000E+01 volume 0.85996E-03 ppm1 3.231 ppm2 2.534 CV 1
OR { 148}
(( segid " " and resid 272 and name HD3 ))
(( segid " " and resid 269 and name HG2 ))
OR { 148}
(( segid " " and resid 272 and name HD3 ))
(( segid " " and resid 269 and name HG3 ))
OR { 148}
(( segid " " and resid 268 and name HE2 ))
(( segid " " and resid 269 and name HG2 ))
OR { 148}
(( segid " " and resid 272 and name HD2 ))
(( segid " " and resid 350 and name HB ))
ASSI { 1068}
(( segid " " and resid 219 and name HB3 ))
(( segid " " and resid 255 and name HB3 ))
4.700 2.700 1.300 peak 1068 spectrum 1 weight 0.10000E+01 volume 0.31014E-03 ppm1 3.194 ppm2 1.075 CV 1
OR { 1068}
(( segid " " and resid 219 and name HB2 ))
(( segid " " and resid 255 and name HB3 ))
OR { 1068}
(( segid " " and resid 219 and name HB3 ))
( segid " " and resid 220 and name HG1%)
OR { 1068}
(( segid " " and resid 219 and name HB2 ))
( segid " " and resid 220 and name HG2%)
OR { 1068}
(( segid " " and resid 219 and name HB3 ))
( segid " " and resid 220 and name HG2%)
ASSI { 824}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 319 and name HG ))
3.100 3.100 2.900 peak 824 spectrum 1 weight 0.10000E+01 volume 0.89095E-03 ppm1 0.365 ppm2 4.068 CV 1
OR { 824}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 374 and name HA ))
ASSI { 1564}
( segid " " and resid 360 and name HD% )
( segid " " and resid 356 and name HG1%)
2.400 0.700 0.700 peak 1564 spectrum 1 weight 0.10000E+01 volume 0.46464E-02 ppm1 7.076 ppm2 0.758 CV 1
OR { 1564}
( segid " " and resid 360 and name HE% )
( segid " " and resid 356 and name HG1%)
OR { 1564}
( segid " " and resid 303 and name HD% )
( segid " " and resid 367 and name HD2%)
OR { 1564}
( segid " " and resid 303 and name HD% )
( segid " " and resid 356 and name HG1%)
ASSI { 692}
( segid " " and resid 318 and name HD1%)
( segid " " and resid 279 and name HD1%)
2.200 0.600 0.600 peak 692 spectrum 1 weight 0.10000E+01 volume 0.99922E-02 ppm1 0.379 ppm2 0.187 CV 1
OR { 692}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 322 and name HG13))
ASSI { 500}
(( segid " " and resid 285 and name HD3 ))
(( segid " " and resid 285 and name HA ))
3.800 1.800 1.800 peak 500 spectrum 1 weight 0.10000E+01 volume 0.16325E-02 ppm1 3.666 ppm2 4.314 CV 1
OR { 500}
(( segid " " and resid 184 and name HD2 ))
(( segid " " and resid 184 and name HA ))
OR { 500}
(( segid " " and resid 285 and name HD3 ))
(( segid " " and resid 284 and name HA ))
ASSI { 280}
( segid " " and resid 211 and name HB% )
(( segid " " and resid 203 and name HB3 ))
4.000 2.000 2.000 peak 280 spectrum 1 weight 0.10000E+01 volume 0.16240E-02 ppm1 1.690 ppm2 1.856 CV 1
OR { 280}
( segid " " and resid 211 and name HB% )
(( segid " " and resid 215 and name HB2 ))
ASSI { 2865}
(( segid " " and resid 254 and name HB3 ))
( segid " " and resid 255 and name HD1%)
5.100 3.200 0.900 peak 2865 spectrum 1 weight 0.10000E+01 volume 0.97553E-03 ppm1 2.946 ppm2 0.624 CV 1
OR { 2865}
(( segid " " and resid 254 and name HB3 ))
( segid " " and resid 253 and name HG2%)
ASSI { 4617}
( segid " " and resid 202 and name HE% )
(( segid " " and resid 208 and name HD3 ))
2.700 0.900 0.900 peak 4617 spectrum 1 weight 0.10000E+01 volume 0.48720E-02 ppm1 1.869 ppm2 2.903 CV 1
OR { 4617}
( segid " " and resid 202 and name HE% )
(( segid " " and resid 198 and name HA ))
ASSI { 1479}
( segid " " and resid 372 and name HG1%)
(( segid " " and resid 320 and name HH2 ))
5.500 3.800 0.500 peak 1479 spectrum 1 weight 0.10000E+01 volume 0.42857E-03 ppm1 0.647 ppm2 7.168 CV 1
OR { 1479}
( segid " " and resid 372 and name HG1%)
(( segid " " and resid 324 and name HD2 ))
ASSI { 1340}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 373 and name HA ))
3.800 1.800 1.800 peak 1340 spectrum 1 weight 0.10000E+01 volume 0.21908E-02 ppm1 0.463 ppm2 2.280 CV 1
OR { 1340}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 220 and name HB ))
OR { 1340}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 375 and name HG2 ))
OR { 1340}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 216 and name HB2 ))
OR { 1340}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 375 and name HG3 ))
OR { 1340}
( segid " " and resid 217 and name HG2%)
( segid " " and resid 203 and name HE% )
OR { 1340}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 213 and name HB2 ))
OR { 1340}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 267 and name HB3 ))
ASSI { 915}
(( segid " " and resid 364 and name HA ))
(( segid " " and resid 365 and name H ))
3.700 1.700 1.700 peak 915 spectrum 1 weight 0.10000E+01 volume 0.67384E-03 ppm1 3.652 ppm2 8.337 CV 1
OR { 915}
(( segid " " and resid 364 and name HA ))
(( segid " " and resid 366 and name H ))
ASSI { 260}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 296 and name HB2 ))
3.400 1.500 1.500 peak 260 spectrum 1 weight 0.10000E+01 volume 0.14182E-02 ppm1 0.075 ppm2 2.070 CV 1
OR { 260}
( segid " " and resid 263 and name HG1%)
(( segid " " and resid 259 and name HB2 ))
OR { 260}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 302 and name HB3 ))
OR { 260}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 293 and name HG3 ))
OR { 260}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 364 and name HB ))
OR { 260}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 302 and name HG3 ))
ASSI { 787}
( segid " " and resid 407 and name HE% )
(( segid " " and resid 403 and name HD3 ))
4.200 2.200 1.800 peak 787 spectrum 1 weight 0.10000E+01 volume 0.55263E-03 ppm1 6.888 ppm2 3.236 CV 1
OR { 787}
( segid " " and resid 407 and name HE% )
(( segid " " and resid 403 and name HD2 ))
OR { 787}
( segid " " and resid 407 and name HE% )
(( segid " " and resid 407 and name HB2 ))
ASSI { 124}
(( segid " " and resid 371 and name HA ))
(( segid " " and resid 372 and name HB ))
4.100 2.100 1.900 peak 124 spectrum 1 weight 0.10000E+01 volume 0.11250E-02 ppm1 3.729 ppm2 1.712 CV 1
OR { 124}
(( segid " " and resid 371 and name HA ))
(( segid " " and resid 323 and name HB ))
ASSI { 4374}
( segid " " and resid 329 and name HD1%)
(( segid " " and resid 339 and name HG12))
2.300 0.700 0.700 peak 4374 spectrum 1 weight 0.10000E+01 volume 0.47705E-02 ppm1 0.118 ppm2 0.529 CV 1
OR { 4374}
( segid " " and resid 329 and name HD1%)
( segid " " and resid 342 and name HG2%)
ASSI { 911}
( segid " " and resid 435 and name HD1%)
(( segid " " and resid 435 and name HA ))
2.600 0.800 0.800 peak 911 spectrum 1 weight 0.10000E+01 volume 0.31127E-02 ppm1 0.870 ppm2 3.877 CV 1
OR { 911}
( segid " " and resid 192 and name HD1%)
(( segid " " and resid 197 and name HA ))
OR { 911}
( segid " " and resid 192 and name HD1%)
(( segid " " and resid 193 and name HD2 ))
ASSI { 695}
( segid " " and resid 439 and name HD1%)
(( segid " " and resid 401 and name H ))
3.000 3.000 3.000 peak 695 spectrum 1 weight 0.10000E+01 volume 0.45959E-03 ppm1 0.812 ppm2 7.782 CV 1
OR { 695}
( segid " " and resid 439 and name HD1%)
(( segid " " and resid 444 and name H ))
ASSI { 1088}
(( segid " " and resid 364 and name HB ))
( segid " " and resid 364 and name HG1%)
2.200 0.600 0.600 peak 1088 spectrum 1 weight 0.10000E+01 volume 0.78098E-02 ppm1 2.124 ppm2 1.067 CV 1
OR { 1088}
(( segid " " and resid 432 and name HB ))
( segid " " and resid 432 and name HG1%)
OR { 1088}
(( segid " " and resid 432 and name HB ))
( segid " " and resid 432 and name HG2%)
ASSI { 2001}
(( segid " " and resid 234 and name HB3 ))
(( segid " " and resid 234 and name HA ))
3.200 1.300 1.300 peak 2001 spectrum 1 weight 0.10000E+01 volume 0.19370E-02 ppm1 3.863 ppm2 4.204 CV 1
OR { 2001}
(( segid " " and resid 383 and name HB2 ))
(( segid " " and resid 383 and name HA ))
ASSI { 367}
( segid " " and resid 310 and name HD1%)
( segid " " and resid 318 and name HG2%)
2.400 0.700 0.700 peak 367 spectrum 1 weight 0.10000E+01 volume 0.83542E-02 ppm1 1.071 ppm2 0.345 CV 1
OR { 367}
( segid " " and resid 310 and name HD1%)
( segid " " and resid 279 and name HD2%)
OR { 367}
( segid " " and resid 310 and name HD1%)
( segid " " and resid 318 and name HD1%)
ASSI { 1344}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 373 and name HA ))
4.400 2.400 1.600 peak 1344 spectrum 1 weight 0.10000E+01 volume 0.96710E-03 ppm1 0.888 ppm2 2.309 CV 1
OR { 1344}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 213 and name HB2 ))
OR { 1344}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 375 and name HG3 ))
OR { 1344}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 375 and name HG2 ))
ASSI { 4}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 352 and name HB ))
3.600 1.700 1.700 peak 4 spectrum 1 weight 0.10000E+01 volume 0.37893E-02 ppm1 2.151 ppm2 1.123 CV 1
OR { 4}
( segid " " and resid 284 and name HE% )
( segid " " and resid 310 and name HD2%)
OR { 4}
( segid " " and resid 284 and name HE% )
( segid " " and resid 310 and name HD1%)
ASSI { 59}
(( segid " " and resid 261 and name HA ))
( segid " " and resid 264 and name HB% )
3.700 1.700 1.700 peak 59 spectrum 1 weight 0.10000E+01 volume 0.54981E-03 ppm1 4.483 ppm2 0.936 CV 1
OR { 59}
(( segid " " and resid 261 and name HA ))
( segid " " and resid 233 and name HG1%)
OR { 59}
(( segid " " and resid 261 and name HA ))
( segid " " and resid 233 and name HG2%)
ASSI { 1594}
(( segid " " and resid 239 and name HA ))
( segid " " and resid 262 and name HG2%)
4.900 3.000 1.100 peak 1594 spectrum 1 weight 0.10000E+01 volume 0.68230E-03 ppm1 4.288 ppm2 1.063 CV 1
OR { 1594}
(( segid " " and resid 239 and name HA ))
( segid " " and resid 240 and name HG1%)
OR { 1594}
(( segid " " and resid 239 and name HA ))
(( segid " " and resid 236 and name HG12))
ASSI { 615}
( segid " " and resid 409 and name HD2%)
(( segid " " and resid 409 and name HG ))
2.100 0.600 0.600 peak 615 spectrum 1 weight 0.10000E+01 volume 0.13993E-01 ppm1 0.741 ppm2 1.397 CV 1
OR { 615}
( segid " " and resid 278 and name HD2%)
(( segid " " and resid 318 and name HB ))
OR { 615}
( segid " " and resid 409 and name HD2%)
(( segid " " and resid 436 and name HB2 ))
OR { 615}
( segid " " and resid 278 and name HD2%)
(( segid " " and resid 317 and name HB2 ))
ASSI { 1204}
( segid " " and resid 211 and name HB% )
(( segid " " and resid 214 and name H ))
4.900 3.000 1.100 peak 1204 spectrum 1 weight 0.10000E+01 volume 0.57516E-03 ppm1 1.689 ppm2 7.192 CV 1
OR { 1204}
( segid " " and resid 211 and name HB% )
( segid " " and resid 270 and name HD% )
ASSI { 1227}
(( segid " " and resid 324 and name HB3 ))
(( segid " " and resid 217 and name HG13))
4.400 2.400 1.600 peak 1227 spectrum 1 weight 0.10000E+01 volume 0.64003E-03 ppm1 3.284 ppm2 0.475 CV 1
OR { 1227}
(( segid " " and resid 324 and name HB3 ))
(( segid " " and resid 217 and name HG12))
OR { 1227}
(( segid " " and resid 324 and name HB3 ))
( segid " " and resid 373 and name HD2%)
OR { 1227}
(( segid " " and resid 324 and name HB3 ))
( segid " " and resid 217 and name HG2%)
OR { 1227}
(( segid " " and resid 324 and name HB3 ))
(( segid " " and resid 373 and name HB2 ))
ASSI { 836}
( segid " " and resid 315 and name HD% )
( segid " " and resid 316 and name HD1%)
3.600 1.700 1.700 peak 836 spectrum 1 weight 0.10000E+01 volume 0.19878E-02 ppm1 7.030 ppm2 0.793 CV 1
OR { 836}
( segid " " and resid 315 and name HD% )
( segid " " and resid 316 and name HD2%)
OR { 836}
( segid " " and resid 315 and name HD% )
( segid " " and resid 367 and name HD2%)
ASSI { 72}
(( segid " " and resid 356 and name HA ))
( segid " " and resid 360 and name HD% )
4.700 2.700 1.300 peak 72 spectrum 1 weight 0.10000E+01 volume 0.86278E-03 ppm1 3.628 ppm2 7.030 CV 1
OR { 72}
(( segid " " and resid 356 and name HA ))
( segid " " and resid 360 and name HE% )
OR { 72}
(( segid " " and resid 356 and name HA ))
( segid " " and resid 358 and name HD% )
OR { 72}
(( segid " " and resid 356 and name HA ))
( segid " " and resid 303 and name HD% )
ASSI { 954}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 343 and name H ))
5.300 3.500 0.700 peak 954 spectrum 1 weight 0.10000E+01 volume 0.58080E-03 ppm1 1.804 ppm2 8.180 CV 1
OR { 954}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 340 and name H ))
ASSI { 352}
(( segid " " and resid 240 and name HA ))
(( segid " " and resid 239 and name H ))
5.000 3.100 1.000 peak 352 spectrum 1 weight 0.10000E+01 volume 0.47930E-03 ppm1 3.241 ppm2 7.098 CV 1
OR { 352}
(( segid " " and resid 240 and name HA ))
( segid " " and resid 258 and name HD% )
OR { 352}
(( segid " " and resid 240 and name HA ))
( segid " " and resid 190 and name HE% )
ASSI { 1481}
( segid " " and resid 278 and name HD2%)
( segid " " and resid 317 and name HD1%)
3.100 1.200 1.200 peak 1481 spectrum 1 weight 0.10000E+01 volume 0.83373E-02 ppm1 0.746 ppm2 0.166 CV 1
OR { 1481}
( segid " " and resid 278 and name HD2%)
( segid " " and resid 279 and name HD1%)
OR { 1481}
( segid " " and resid 278 and name HD2%)
(( segid " " and resid 322 and name HG13))
ASSI { 1722}
(( segid " " and resid 426 and name HG2 ))
(( segid " " and resid 426 and name H ))
3.700 1.700 1.700 peak 1722 spectrum 1 weight 0.10000E+01 volume 0.22979E-02 ppm1 2.261 ppm2 7.995 CV 1
OR { 1722}
(( segid " " and resid 426 and name HG2 ))
(( segid " " and resid 427 and name H ))
ASSI { 589}
( segid " " and resid 230 and name HG2%)
(( segid " " and resid 230 and name HG12))
2.200 0.600 0.600 peak 589 spectrum 1 weight 0.10000E+01 volume 0.88192E-02 ppm1 0.950 ppm2 0.773 CV 1
OR { 589}
( segid " " and resid 230 and name HG2%)
( segid " " and resid 328 and name HG1%)
ASSI { 1619}
( segid " " and resid 380 and name HD1%)
(( segid " " and resid 382 and name HB2 ))
3.400 1.400 1.400 peak 1619 spectrum 1 weight 0.10000E+01 volume 0.25911E-02 ppm1 0.766 ppm2 3.152 CV 1
OR { 1619}
( segid " " and resid 380 and name HD1%)
(( segid " " and resid 381 and name HD2 ))
ASSI { 3117}
( segid " " and resid 443 and name HD1%)
(( segid " " and resid 395 and name HE21))
3.500 1.500 1.500 peak 3117 spectrum 1 weight 0.10000E+01 volume 0.37639E-02 ppm1 0.846 ppm2 7.754 CV 1
OR { 3117}
( segid " " and resid 443 and name HD1%)
(( segid " " and resid 444 and name H ))
ASSI { 1258}
(( segid " " and resid 210 and name HB2 ))
(( segid " " and resid 209 and name HG ))
3.600 1.600 1.600 peak 1258 spectrum 1 weight 0.10000E+01 volume 0.30535E-02 ppm1 1.610 ppm2 0.773 CV 1
OR { 1258}
(( segid " " and resid 210 and name HB2 ))
( segid " " and resid 274 and name HD2%)
OR { 1258}
(( segid " " and resid 210 and name HB2 ))
( segid " " and resid 194 and name HD1%)
OR { 1258}
(( segid " " and resid 210 and name HB2 ))
( segid " " and resid 271 and name HD2%)
ASSI { 95}
(( segid " " and resid 366 and name HB3 ))
( segid " " and resid 300 and name HG1%)
3.800 1.800 1.800 peak 95 spectrum 1 weight 0.10000E+01 volume 0.62311E-03 ppm1 1.819 ppm2 0.065 CV 1
OR { 95}
(( segid " " and resid 366 and name HB3 ))
(( segid " " and resid 367 and name HB3 ))
ASSI { 2757}
(( segid " " and resid 301 and name HG2 ))
(( segid " " and resid 301 and name HE21))
2.500 0.800 0.800 peak 2757 spectrum 1 weight 0.10000E+01 volume 0.25545E-02 ppm1 2.474 ppm2 6.679 CV 1
OR { 2757}
(( segid " " and resid 304 and name HG2 ))
(( segid " " and resid 304 and name HE21))
ASSI { 98}
( segid " " and resid 212 and name HG1%)
(( segid " " and resid 215 and name HB2 ))
4.500 2.600 1.500 peak 98 spectrum 1 weight 0.10000E+01 volume 0.72179E-03 ppm1 -0.344 ppm2 1.844 CV 1
OR { 98}
( segid " " and resid 212 and name HG1%)
(( segid " " and resid 269 and name HB3 ))
OR { 98}
( segid " " and resid 212 and name HG1%)
(( segid " " and resid 243 and name HB2 ))
OR { 98}
( segid " " and resid 212 and name HG1%)
(( segid " " and resid 209 and name HB3 ))
OR { 98}
( segid " " and resid 212 and name HG1%)
(( segid " " and resid 274 and name HB3 ))
OR { 98}
( segid " " and resid 212 and name HG1%)
(( segid " " and resid 268 and name HB3 ))
ASSI { 1874}
( segid " " and resid 197 and name HB% )
( segid " " and resid 189 and name HD1%)
3.000 1.100 1.100 peak 1874 spectrum 1 weight 0.10000E+01 volume 0.50666E-02 ppm1 1.456 ppm2 0.729 CV 1
OR { 1874}
( segid " " and resid 197 and name HB% )
( segid " " and resid 194 and name HD1%)
ASSI { 710}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 357 and name HA ))
4.200 2.200 1.800 peak 710 spectrum 1 weight 0.10000E+01 volume 0.73025E-03 ppm1 0.604 ppm2 3.836 CV 1
OR { 710}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 288 and name HA ))
OR { 710}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 347 and name HB3 ))
OR { 710}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 347 and name HB2 ))
OR { 710}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 343 and name HB3 ))
ASSI { 1561}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 365 and name HG2 ))
5.800 4.200 0.200 peak 1561 spectrum 1 weight 0.10000E+01 volume 0.51033E-03 ppm1 0.391 ppm2 2.394 CV 1
OR { 1561}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 325 and name HG2 ))
OR { 1561}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 365 and name HG3 ))
ASSI { 4228}
(( segid " " and resid 426 and name HA ))
(( segid " " and resid 426 and name H ))
3.200 1.300 1.300 peak 4228 spectrum 1 weight 0.10000E+01 volume 0.11222E-02 ppm1 3.688 ppm2 7.999 CV 1
OR { 4228}
(( segid " " and resid 426 and name HA ))
(( segid " " and resid 427 and name H ))
ASSI { 4603}
(( segid " " and resid 379 and name HB3 ))
(( segid " " and resid 379 and name HA ))
3.200 1.300 1.300 peak 4603 spectrum 1 weight 0.10000E+01 volume 0.10009E-02 ppm1 1.611 ppm2 4.422 CV 1
OR { 4603}
(( segid " " and resid 378 and name HB2 ))
(( segid " " and resid 378 and name HA ))
OR { 4603}
(( segid " " and resid 378 and name HB3 ))
(( segid " " and resid 378 and name HA ))
ASSI { 776}
(( segid " " and resid 413 and name HD2 ))
(( segid " " and resid 429 and name HG ))
3.700 1.700 1.700 peak 776 spectrum 1 weight 0.10000E+01 volume 0.12547E-02 ppm1 6.800 ppm2 1.405 CV 1
OR { 776}
(( segid " " and resid 413 and name HD2 ))
(( segid " " and resid 409 and name HG ))
OR { 776}
(( segid " " and resid 413 and name HD2 ))
(( segid " " and resid 429 and name HB2 ))
ASSI { 697}
(( segid " " and resid 325 and name HG3 ))
(( segid " " and resid 325 and name HB2 ))
4.300 2.300 1.700 peak 697 spectrum 1 weight 0.10000E+01 volume 0.37216E-03 ppm1 2.697 ppm2 1.734 CV 1
OR { 697}
(( segid " " and resid 325 and name HG3 ))
(( segid " " and resid 342 and name HB ))
OR { 697}
(( segid " " and resid 325 and name HG3 ))
(( segid " " and resid 346 and name HB2 ))
OR { 697}
(( segid " " and resid 325 and name HG3 ))
(( segid " " and resid 346 and name HG ))
OR { 697}
(( segid " " and resid 325 and name HG3 ))
(( segid " " and resid 321 and name HG ))
ASSI { 1750}
(( segid " " and resid 409 and name HB3 ))
(( segid " " and resid 409 and name H ))
3.600 1.600 1.600 peak 1750 spectrum 1 weight 0.10000E+01 volume 0.57798E-03 ppm1 1.920 ppm2 8.738 CV 1
OR { 1750}
(( segid " " and resid 408 and name HB2 ))
(( segid " " and resid 409 and name H ))
ASSI { 684}
( segid " " and resid 367 and name HD1%)
(( segid " " and resid 366 and name H ))
3.300 1.400 1.400 peak 684 spectrum 1 weight 0.10000E+01 volume 0.62875E-03 ppm1 0.668 ppm2 8.318 CV 1
OR { 684}
( segid " " and resid 274 and name HD1%)
(( segid " " and resid 314 and name HD22))
ASSI { 1480}
( segid " " and resid 274 and name HD2%)
(( segid " " and resid 197 and name H ))
2.700 2.700 3.300 peak 1480 spectrum 1 weight 0.10000E+01 volume 0.87120E-03 ppm1 0.781 ppm2 8.045 CV 1
OR { 1480}
( segid " " and resid 274 and name HD2%)
(( segid " " and resid 269 and name HE21))
OR { 1480}
( segid " " and resid 255 and name HD2%)
(( segid " " and resid 267 and name H ))
ASSI { 1213}
( segid " " and resid 230 and name HD1%)
(( segid " " and resid 225 and name H ))
4.000 2.000 2.000 peak 1213 spectrum 1 weight 0.10000E+01 volume 0.56388E-03 ppm1 0.651 ppm2 7.762 CV 1
OR { 1213}
( segid " " and resid 230 and name HD1%)
(( segid " " and resid 265 and name H ))
OR { 1213}
( segid " " and resid 230 and name HD1%)
(( segid " " and resid 338 and name H ))
ASSI { 872}
(( segid " " and resid 355 and name HG3 ))
(( segid " " and resid 355 and name HA ))
2.700 0.900 0.900 peak 872 spectrum 1 weight 0.10000E+01 volume 0.50835E-02 ppm1 1.733 ppm2 4.004 CV 1
OR { 872}
(( segid " " and resid 321 and name HG ))
(( segid " " and resid 321 and name HA ))
OR { 872}
(( segid " " and resid 355 and name HG2 ))
(( segid " " and resid 355 and name HA ))
OR { 872}
(( segid " " and resid 355 and name HG3 ))
(( segid " " and resid 353 and name HB3 ))
ASSI { 3587}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 306 and name H ))
2.600 0.900 0.900 peak 3587 spectrum 1 weight 0.10000E+01 volume 0.38965E-02 ppm1 0.379 ppm2 8.008 CV 1
OR { 3587}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 287 and name H ))
ASSI { 1134}
( segid " " and resid 436 and name HD1%)
(( segid " " and resid 407 and name H ))
3.800 1.800 1.800 peak 1134 spectrum 1 weight 0.10000E+01 volume 0.32424E-03 ppm1 1.011 ppm2 7.790 CV 1
OR { 1134}
( segid " " and resid 436 and name HD1%)
(( segid " " and resid 401 and name H ))
OR { 1134}
( segid " " and resid 436 and name HD1%)
(( segid " " and resid 444 and name H ))
OR { 1134}
( segid " " and resid 436 and name HD1%)
(( segid " " and resid 395 and name HE21))
ASSI { 639}
( segid " " and resid 264 and name HB% )
(( segid " " and resid 266 and name H ))
5.000 3.200 1.000 peak 639 spectrum 1 weight 0.10000E+01 volume 0.52725E-03 ppm1 0.952 ppm2 8.211 CV 1
OR { 639}
( segid " " and resid 264 and name HB% )
(( segid " " and resid 269 and name H ))
ASSI { 529}
(( segid " " and resid 304 and name HG2 ))
(( segid " " and resid 367 and name HB3 ))
4.500 2.500 1.500 peak 529 spectrum 1 weight 0.10000E+01 volume 0.70769E-03 ppm1 2.482 ppm2 0.071 CV 1
OR { 529}
(( segid " " and resid 301 and name HG2 ))
( segid " " and resid 300 and name HG1%)
OR { 529}
(( segid " " and resid 304 and name HG2 ))
( segid " " and resid 300 and name HG1%)
ASSI { 315}
(( segid " " and resid 363 and name HD2 ))
( segid " " and resid 300 and name HG2%)
5.100 3.200 0.900 peak 315 spectrum 1 weight 0.10000E+01 volume 0.35244E-03 ppm1 7.049 ppm2 0.568 CV 1
OR { 315}
(( segid " " and resid 320 and name HZ3 ))
( segid " " and resid 373 and name HD2%)
ASSI { 3128}
(( segid " " and resid 432 and name HB ))
(( segid " " and resid 432 and name HA ))
2.700 0.900 0.900 peak 3128 spectrum 1 weight 0.10000E+01 volume 0.19595E-02 ppm1 2.126 ppm2 3.654 CV 1
OR { 3128}
(( segid " " and resid 364 and name HB ))
(( segid " " and resid 364 and name HA ))
ASSI { 734}
( segid " " and resid 198 and name HG1%)
(( segid " " and resid 202 and name HG2 ))
3.000 1.200 1.200 peak 734 spectrum 1 weight 0.10000E+01 volume 0.33693E-02 ppm1 0.599 ppm2 2.274 CV 1
OR { 734}
( segid " " and resid 198 and name HG1%)
(( segid " " and resid 199 and name HG2 ))
OR { 734}
( segid " " and resid 198 and name HG1%)
(( segid " " and resid 199 and name HG3 ))
OR { 734}
( segid " " and resid 198 and name HG1%)
(( segid " " and resid 202 and name HB3 ))
ASSI { 2905}
(( segid " " and resid 255 and name HA ))
( segid " " and resid 258 and name HD% )
2.400 0.700 0.700 peak 2905 spectrum 1 weight 0.10000E+01 volume 0.41108E-02 ppm1 3.970 ppm2 7.085 CV 1
OR { 2905}
(( segid " " and resid 308 and name HA ))
(( segid " " and resid 308 and name H ))
ASSI { 888}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 321 and name HA ))
4.700 2.800 1.300 peak 888 spectrum 1 weight 0.10000E+01 volume 0.67666E-03 ppm1 -0.165 ppm2 4.006 CV 1
OR { 888}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 346 and name HA ))
OR { 888}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 343 and name HA ))
OR { 888}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 358 and name HA ))
ASSI { 365}
( segid " " and resid 429 and name HD2%)
(( segid " " and resid 430 and name H ))
3.600 1.600 1.600 peak 365 spectrum 1 weight 0.10000E+01 volume 0.37893E-02 ppm1 0.641 ppm2 7.744 CV 1
OR { 365}
( segid " " and resid 429 and name HD2%)
(( segid " " and resid 428 and name H ))
ASSI { 1071}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 317 and name H ))
4.900 3.000 1.100 peak 1071 spectrum 1 weight 0.10000E+01 volume 0.35244E-03 ppm1 -0.918 ppm2 7.504 CV 1
OR { 1071}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 211 and name H ))
ASSI { 4401}
(( segid " " and resid 429 and name HB3 ))
(( segid " " and resid 429 and name HA ))
3.500 1.600 1.600 peak 4401 spectrum 1 weight 0.10000E+01 volume 0.76128E-03 ppm1 1.794 ppm2 3.720 CV 1
OR { 4401}
(( segid " " and resid 429 and name HB3 ))
(( segid " " and resid 426 and name HA ))
ASSI { 3993}
(( segid " " and resid 183 and name HG3 ))
(( segid " " and resid 183 and name HA ))
3.400 1.500 1.500 peak 3993 spectrum 1 weight 0.10000E+01 volume 0.22274E-02 ppm1 2.441 ppm2 4.706 CV 1
OR { 3993}
(( segid " " and resid 377 and name HG3 ))
(( segid " " and resid 377 and name HA ))
ASSI { 1200}
(( segid " " and resid 426 and name HA ))
(( segid " " and resid 428 and name H ))
4.300 2.400 1.700 peak 1200 spectrum 1 weight 0.10000E+01 volume 0.56109E-03 ppm1 3.683 ppm2 7.728 CV 1
OR { 1200}
(( segid " " and resid 426 and name HA ))
(( segid " " and resid 430 and name H ))
OR { 1200}
(( segid " " and resid 426 and name HA ))
(( segid " " and resid 425 and name H ))
ASSI { 628}
( segid " " and resid 373 and name HD1%)
( segid " " and resid 371 and name HG2%)
2.800 2.800 3.200 peak 628 spectrum 1 weight 0.10000E+01 volume 0.20300E-02 ppm1 -0.196 ppm2 0.928 CV 1
OR { 628}
( segid " " and resid 373 and name HD1%)
( segid " " and resid 325 and name HE% )
OR { 628}
( segid " " and resid 373 and name HD1%)
( segid " " and resid 321 and name HD1%)
OR { 628}
( segid " " and resid 373 and name HD1%)
( segid " " and resid 364 and name HG2%)
OR { 628}
( segid " " and resid 373 and name HD1%)
( segid " " and resid 207 and name HD1%)
OR { 628}
( segid " " and resid 373 and name HD1%)
( segid " " and resid 376 and name HG2%)
OR { 628}
( segid " " and resid 373 and name HD1%)
( segid " " and resid 376 and name HG1%)
ASSI { 1625}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 307 and name HG ))
2.800 1.000 1.000 peak 1625 spectrum 1 weight 0.10000E+01 volume 0.28477E-02 ppm1 0.349 ppm2 2.278 CV 1
OR { 1625}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 319 and name HA ))
ASSI { 1003}
(( segid " " and resid 358 and name HB2 ))
( segid " " and resid 359 and name HG1%)
6.000 4.400 0.000 peak 1003 spectrum 1 weight 0.10000E+01 volume 0.60337E-03 ppm1 3.270 ppm2 0.886 CV 1
OR { 1003}
(( segid " " and resid 358 and name HB2 ))
( segid " " and resid 357 and name HD2%)
ASSI { 1549}
( segid " " and resid 321 and name HD2%)
( segid " " and resid 318 and name HD1%)
2.200 0.600 0.600 peak 1549 spectrum 1 weight 0.10000E+01 volume 0.21476E-01 ppm1 0.660 ppm2 0.365 CV 1
OR { 1549}
( segid " " and resid 278 and name HD1%)
( segid " " and resid 318 and name HD1%)
OR { 1549}
( segid " " and resid 278 and name HD1%)
( segid " " and resid 279 and name HD2%)
OR { 1549}
( segid " " and resid 278 and name HD1%)
(( segid " " and resid 317 and name HG ))
OR { 1549}
( segid " " and resid 278 and name HD1%)
( segid " " and resid 317 and name HD2%)
OR { 1549}
( segid " " and resid 321 and name HD2%)
( segid " " and resid 322 and name HG2%)
OR { 1549}
( segid " " and resid 278 and name HD1%)
( segid " " and resid 318 and name HG2%)
ASSI { 2959}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 198 and name H ))
2.700 0.900 0.900 peak 2959 spectrum 1 weight 0.10000E+01 volume 0.37272E-02 ppm1 0.616 ppm2 8.602 CV 1
OR { 2959}
( segid " " and resid 255 and name HD1%)
(( segid " " and resid 255 and name H ))
ASSI { 1266}
( segid " " and resid 203 and name HE% )
( segid " " and resid 247 and name HE% )
5.400 3.700 0.600 peak 1266 spectrum 1 weight 0.10000E+01 volume 0.40036E-03 ppm1 2.215 ppm2 6.430 CV 1
OR { 1266}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 205 and name H ))
ASSI { 1432}
( segid " " and resid 443 and name HD2%)
(( segid " " and resid 402 and name H ))
2.500 2.500 3.500 peak 1432 spectrum 1 weight 0.10000E+01 volume 0.14718E-02 ppm1 0.782 ppm2 8.683 CV 1
OR { 1432}
( segid " " and resid 443 and name HD2%)
(( segid " " and resid 398 and name H ))
OR { 1432}
( segid " " and resid 443 and name HD2%)
(( segid " " and resid 396 and name H ))
ASSI { 499}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 317 and name HB2 ))
3.400 1.500 1.500 peak 499 spectrum 1 weight 0.10000E+01 volume 0.12265E-02 ppm1 0.187 ppm2 1.345 CV 1
OR { 499}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 208 and name HB2 ))
OR { 499}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 207 and name HG12))
OR { 499}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 210 and name HB3 ))
OR { 499}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 194 and name HG ))
ASSI { 1410}
( segid " " and resid 189 and name HD1%)
(( segid " " and resid 196 and name HB3 ))
4.600 2.700 1.400 peak 1410 spectrum 1 weight 0.10000E+01 volume 0.75846E-03 ppm1 0.740 ppm2 2.741 CV 1
OR { 1410}
( segid " " and resid 189 and name HD1%)
(( segid " " and resid 202 and name HG3 ))
ASSI { 385}
( segid " " and resid 407 and name HD% )
( segid " " and resid 408 and name HD2%)
5.200 3.400 0.800 peak 385 spectrum 1 weight 0.10000E+01 volume 0.53289E-03 ppm1 7.307 ppm2 0.890 CV 1
OR { 385}
( segid " " and resid 407 and name HD% )
( segid " " and resid 436 and name HD2%)
OR { 385}
( segid " " and resid 407 and name HD% )
( segid " " and resid 412 and name HD1%)
ASSI { 1496}
(( segid " " and resid 322 and name HA ))
(( segid " " and resid 325 and name HB3 ))
3.500 1.500 1.500 peak 1496 spectrum 1 weight 0.10000E+01 volume 0.59491E-03 ppm1 3.384 ppm2 1.355 CV 1
OR { 1496}
(( segid " " and resid 322 and name HA ))
(( segid " " and resid 322 and name HB ))
OR { 1496}
(( segid " " and resid 322 and name HA ))
(( segid " " and resid 322 and name HG12))
ASSI { 1086}
( segid " " and resid 367 and name HD1%)
(( segid " " and resid 304 and name HE21))
3.000 1.100 1.100 peak 1086 spectrum 1 weight 0.10000E+01 volume 0.13731E-02 ppm1 0.668 ppm2 6.668 CV 1
OR { 1086}
( segid " " and resid 274 and name HD1%)
(( segid " " and resid 192 and name H ))
ASSI { 1456}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 352 and name HG13))
3.700 1.700 1.700 peak 1456 spectrum 1 weight 0.10000E+01 volume 0.18186E-02 ppm1 2.585 ppm2 1.583 CV 1
OR { 1456}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 279 and name HB2 ))
OR { 1456}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 352 and name HG13))
OR { 1456}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 279 and name HB2 ))
ASSI { 49}
(( segid " " and resid 239 and name HD2 ))
( segid " " and resid 262 and name HG2%)
3.700 1.700 1.700 peak 49 spectrum 1 weight 0.10000E+01 volume 0.14492E-02 ppm1 1.753 ppm2 1.074 CV 1
OR { 49}
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(( segid " " and resid 243 and name HG ))
OR { 49}
(( segid " " and resid 239 and name HD2 ))
( segid " " and resid 240 and name HG1%)
ASSI { 457}
( segid " " and resid 300 and name HG2%)
(( segid " " and resid 301 and name HG3 ))
3.200 1.300 1.300 peak 457 spectrum 1 weight 0.10000E+01 volume 0.73251E-02 ppm1 0.538 ppm2 2.271 CV 1
OR { 457}
( segid " " and resid 300 and name HG2%)
(( segid " " and resid 304 and name HG3 ))
OR { 457}
( segid " " and resid 300 and name HG2%)
(( segid " " and resid 366 and name HG2 ))
OR { 457}
( segid " " and resid 300 and name HG2%)
(( segid " " and resid 366 and name HG3 ))
ASSI { 537}
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(( segid " " and resid 398 and name HG13))
2.200 0.600 0.600 peak 537 spectrum 1 weight 0.10000E+01 volume 0.92141E-02 ppm1 0.558 ppm2 1.623 CV 1
OR { 537}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 443 and name HB2 ))
OR { 537}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 442 and name HG2 ))
OR { 537}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 443 and name HG ))
OR { 537}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 443 and name HB3 ))
ASSI { 1005}
(( segid " " and resid 317 and name HB3 ))
( segid " " and resid 317 and name HD1%)
4.200 2.200 1.800 peak 1005 spectrum 1 weight 0.10000E+01 volume 0.61183E-03 ppm1 1.146 ppm2 0.168 CV 1
OR { 1005}
(( segid " " and resid 317 and name HB3 ))
( segid " " and resid 209 and name HD1%)
ASSI { 870}
(( segid " " and resid 398 and name HG12))
(( segid " " and resid 395 and name HA ))
5.500 3.800 0.500 peak 870 spectrum 1 weight 0.10000E+01 volume 0.32424E-03 ppm1 0.571 ppm2 3.741 CV 1
OR { 870}
(( segid " " and resid 398 and name HG12))
(( segid " " and resid 397 and name HA2 ))
OR { 870}
(( segid " " and resid 398 and name HG12))
(( segid " " and resid 397 and name HA3 ))
OR { 870}
(( segid " " and resid 398 and name HG12))
(( segid " " and resid 399 and name HA ))
ASSI { 1108}
( segid " " and resid 198 and name HG1%)
( segid " " and resid 202 and name HE% )
2.800 1.000 1.000 peak 1108 spectrum 1 weight 0.10000E+01 volume 0.39754E-02 ppm1 0.598 ppm2 1.862 CV 1
OR { 1108}
( segid " " and resid 198 and name HG1%)
(( segid " " and resid 199 and name HB2 ))
ASSI { 158}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 366 and name H ))
4.600 2.700 1.400 peak 158 spectrum 1 weight 0.10000E+01 volume 0.82329E-03 ppm1 0.078 ppm2 8.324 CV 1
OR { 158}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 365 and name H ))
ASSI { 702}
(( segid " " and resid 184 and name HD2 ))
(( segid " " and resid 184 and name HG3 ))
1.800 0.400 0.400 peak 702 spectrum 1 weight 0.10000E+01 volume 0.25449E-01 ppm1 3.665 ppm2 1.944 CV 1
OR { 702}
(( segid " " and resid 285 and name HD3 ))
(( segid " " and resid 285 and name HG2 ))
OR { 702}
(( segid " " and resid 184 and name HD2 ))
(( segid " " and resid 184 and name HG2 ))
OR { 702}
(( segid " " and resid 285 and name HD3 ))
(( segid " " and resid 285 and name HG3 ))
OR { 702}
(( segid " " and resid 184 and name HD2 ))
(( segid " " and resid 183 and name HB2 ))
ASSI { 581}
(( segid " " and resid 256 and name HG3 ))
(( segid " " and resid 254 and name HD21))
4.500 2.600 1.500 peak 581 spectrum 1 weight 0.10000E+01 volume 0.10601E-02 ppm1 2.388 ppm2 7.447 CV 1
OR { 581}
(( segid " " and resid 256 and name HG3 ))
(( segid " " and resid 257 and name H ))
ASSI { 1991}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 314 and name HA ))
4.000 2.000 2.000 peak 1991 spectrum 1 weight 0.10000E+01 volume 0.16579E-02 ppm1 0.170 ppm2 3.827 CV 1
OR { 1991}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 278 and name HA ))
ASSI { 1421}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 319 and name HA ))
3.900 1.900 1.900 peak 1421 spectrum 1 weight 0.10000E+01 volume 0.83457E-03 ppm1 0.436 ppm2 2.315 CV 1
OR { 1421}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 365 and name HG2 ))
OR { 1421}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 365 and name HG3 ))
ASSI { 3177}
(( segid " " and resid 289 and name HB3 ))
( segid " " and resid 306 and name HD2%)
4.700 2.700 1.300 peak 3177 spectrum 1 weight 0.10000E+01 volume 0.38908E-03 ppm1 2.061 ppm2 -0.350 CV 1
OR { 3177}
(( segid " " and resid 288 and name HB3 ))
( segid " " and resid 306 and name HD2%)
ASSI { 784}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 318 and name HG12))
2.500 0.800 0.800 peak 784 spectrum 1 weight 0.10000E+01 volume 0.32678E-02 ppm1 0.168 ppm2 0.934 CV 1
OR { 784}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 306 and name HB2 ))
OR { 784}
( segid " " and resid 279 and name HD1%)
( segid " " and resid 283 and name HD2%)
OR { 784}
( segid " " and resid 279 and name HD1%)
( segid " " and resid 352 and name HG2%)
ASSI { 1090}
(( segid " " and resid 413 and name HE1 ))
(( segid " " and resid 429 and name HG ))
5.600 3.900 0.400 peak 1090 spectrum 1 weight 0.10000E+01 volume 0.30169E-03 ppm1 7.629 ppm2 1.407 CV 1
OR { 1090}
(( segid " " and resid 413 and name HE1 ))
(( segid " " and resid 429 and name HB2 ))
OR { 1090}
(( segid " " and resid 413 and name HE1 ))
(( segid " " and resid 409 and name HG ))
ASSI { 334}
(( segid " " and resid 217 and name HB ))
( segid " " and resid 267 and name HD2%)
5.100 3.200 0.900 peak 334 spectrum 1 weight 0.10000E+01 volume 0.55263E-03 ppm1 1.645 ppm2 0.894 CV 1
OR { 334}
(( segid " " and resid 217 and name HB ))
( segid " " and resid 267 and name HD1%)
OR { 334}
(( segid " " and resid 217 and name HB ))
( segid " " and resid 325 and name HE% )
OR { 334}
(( segid " " and resid 217 and name HB ))
( segid " " and resid 321 and name HD1%)
ASSI { 331}
( segid " " and resid 315 and name HE% )
(( segid " " and resid 316 and name H ))
4.300 2.300 1.700 peak 331 spectrum 1 weight 0.10000E+01 volume 0.12490E-02 ppm1 6.875 ppm2 8.722 CV 1
OR { 331}
( segid " " and resid 315 and name HE% )
(( segid " " and resid 304 and name H ))
ASSI { 1272}
( segid " " and resid 258 and name HD% )
( segid " " and resid 255 and name HD1%)
4.400 2.400 1.600 peak 1272 spectrum 1 weight 0.10000E+01 volume 0.55545E-03 ppm1 7.068 ppm2 0.605 CV 1
OR { 1272}
( segid " " and resid 258 and name HD% )
( segid " " and resid 253 and name HG2%)
ASSI { 789}
( segid " " and resid 436 and name HD2%)
(( segid " " and resid 436 and name HB3 ))
2.400 0.700 0.700 peak 789 spectrum 1 weight 0.10000E+01 volume 0.63072E-02 ppm1 0.857 ppm2 1.983 CV 1
OR { 789}
( segid " " and resid 436 and name HD2%)
(( segid " " and resid 405 and name HB2 ))
ASSI { 1328}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 305 and name HB2 ))
3.600 1.600 1.600 peak 1328 spectrum 1 weight 0.10000E+01 volume 0.33693E-02 ppm1 0.378 ppm2 1.834 CV 1
OR { 1328}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 309 and name HB2 ))
OR { 1328}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 305 and name HB3 ))
OR { 1328}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 309 and name HB3 ))
OR { 1328}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 282 and name HB2 ))
ASSI { 3669}
(( segid " " and resid 317 and name HA ))
( segid " " and resid 209 and name HD1%)
3.000 1.100 1.100 peak 3669 spectrum 1 weight 0.10000E+01 volume 0.14718E-02 ppm1 3.128 ppm2 0.173 CV 1
OR { 3669}
(( segid " " and resid 317 and name HA ))
( segid " " and resid 317 and name HD1%)
ASSI { 721}
(( segid " " and resid 342 and name HG13))
(( segid " " and resid 342 and name HB ))
2.900 1.100 1.100 peak 721 spectrum 1 weight 0.10000E+01 volume 0.11560E-02 ppm1 1.296 ppm2 1.763 CV 1
OR { 721}
(( segid " " and resid 342 and name HG13))
( segid " " and resid 337 and name HE% )
OR { 721}
(( segid " " and resid 342 and name HG13))
(( segid " " and resid 332 and name HB2 ))
ASSI { 1428}
( segid " " and resid 358 and name HE% )
(( segid " " and resid 339 and name HB ))
3.300 1.300 1.300 peak 1428 spectrum 1 weight 0.10000E+01 volume 0.10798E-02 ppm1 6.701 ppm2 1.544 CV 1
OR { 1428}
( segid " " and resid 358 and name HE% )
(( segid " " and resid 359 and name HB ))
ASSI { 1618}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 213 and name HA ))
3.800 1.800 1.800 peak 1618 spectrum 1 weight 0.10000E+01 volume 0.71615E-03 ppm1 0.171 ppm2 3.598 CV 1
OR { 1618}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 316 and name HA ))
ASSI { 2669}
(( segid " " and resid 289 and name HB2 ))
( segid " " and resid 306 and name HD2%)
4.600 2.600 1.400 peak 2669 spectrum 1 weight 0.10000E+01 volume 0.41447E-03 ppm1 1.965 ppm2 -0.361 CV 1
OR { 2669}
(( segid " " and resid 288 and name HB2 ))
( segid " " and resid 306 and name HD2%)
ASSI { 404}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 352 and name HA ))
3.600 1.600 1.600 peak 404 spectrum 1 weight 0.10000E+01 volume 0.41559E-02 ppm1 2.151 ppm2 4.155 CV 1
OR { 404}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 353 and name HA ))
ASSI { 1471}
(( segid " " and resid 272 and name HG3 ))
(( segid " " and resid 349 and name HB ))
4.200 2.200 1.800 peak 1471 spectrum 1 weight 0.10000E+01 volume 0.16466E-02 ppm1 1.803 ppm2 4.428 CV 1
OR { 1471}
(( segid " " and resid 272 and name HG2 ))
(( segid " " and resid 349 and name HB ))
OR { 1471}
(( segid " " and resid 272 and name HG3 ))
(( segid " " and resid 273 and name HA ))
OR { 1471}
(( segid " " and resid 272 and name HG2 ))
(( segid " " and resid 273 and name HA ))
ASSI { 117}
(( segid " " and resid 272 and name HG2 ))
(( segid " " and resid 351 and name H ))
4.500 2.500 1.500 peak 117 spectrum 1 weight 0.10000E+01 volume 0.42575E-03 ppm1 1.803 ppm2 7.863 CV 1
OR { 117}
(( segid " " and resid 272 and name HG3 ))
(( segid " " and resid 351 and name H ))
OR { 117}
(( segid " " and resid 272 and name HG3 ))
( segid " " and resid 190 and name HD% )
OR { 117}
(( segid " " and resid 272 and name HG2 ))
( segid " " and resid 190 and name HD% )
ASSI { 1348}
(( segid " " and resid 304 and name HG2 ))
(( segid " " and resid 300 and name HA ))
4.700 2.800 1.300 peak 1348 spectrum 1 weight 0.10000E+01 volume 0.94736E-03 ppm1 2.444 ppm2 2.851 CV 1
OR { 1348}
(( segid " " and resid 304 and name HG2 ))
(( segid " " and resid 308 and name HE2 ))
OR { 1348}
(( segid " " and resid 304 and name HG2 ))
(( segid " " and resid 308 and name HE3 ))
ASSI { 1189}
( segid " " and resid 220 and name HG1%)
(( segid " " and resid 219 and name HB2 ))
3.700 1.700 1.700 peak 1189 spectrum 1 weight 0.10000E+01 volume 0.24304E-02 ppm1 1.124 ppm2 3.134 CV 1
OR { 1189}
( segid " " and resid 220 and name HG1%)
(( segid " " and resid 219 and name HB3 ))
OR { 1189}
( segid " " and resid 220 and name HG2%)
(( segid " " and resid 219 and name HB2 ))
OR { 1189}
( segid " " and resid 220 and name HG2%)
(( segid " " and resid 227 and name HB2 ))
OR { 1189}
( segid " " and resid 220 and name HG2%)
(( segid " " and resid 219 and name HB3 ))
OR { 1189}
( segid " " and resid 220 and name HG1%)
(( segid " " and resid 227 and name HB2 ))
ASSI { 128}
( segid " " and resid 290 and name HB% )
(( segid " " and resid 302 and name HB3 ))
2.200 0.600 0.600 peak 128 spectrum 1 weight 0.10000E+01 volume 0.56081E-02 ppm1 1.529 ppm2 2.068 CV 1
OR { 128}
( segid " " and resid 290 and name HB% )
(( segid " " and resid 302 and name HG3 ))
OR { 128}
( segid " " and resid 290 and name HB% )
(( segid " " and resid 293 and name HG3 ))
ASSI { 492}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 319 and name HA ))
4.400 2.400 1.600 peak 492 spectrum 1 weight 0.10000E+01 volume 0.88531E-03 ppm1 0.377 ppm2 2.293 CV 1
OR { 492}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 307 and name HG ))
OR { 492}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 284 and name HB2 ))
OR { 492}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 365 and name HG2 ))
ASSI { 179}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 342 and name HA ))
2.600 0.800 0.800 peak 179 spectrum 1 weight 0.10000E+01 volume 0.38344E-02 ppm1 0.514 ppm2 3.896 CV 1
OR { 179}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 325 and name HA ))
OR { 179}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 343 and name HB3 ))
OR { 179}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 343 and name HB2 ))
ASSI { 791}
( segid " " and resid 435 and name HG2%)
(( segid " " and resid 439 and name HB2 ))
2.700 2.700 3.300 peak 791 spectrum 1 weight 0.10000E+01 volume 0.38231E-02 ppm1 0.905 ppm2 2.144 CV 1
OR { 791}
( segid " " and resid 435 and name HG2%)
(( segid " " and resid 433 and name HB3 ))
ASSI { 957}
(( segid " " and resid 346 and name HB3 ))
( segid " " and resid 346 and name HD2%)
2.400 0.700 0.700 peak 957 spectrum 1 weight 0.10000E+01 volume 0.61437E-02 ppm1 1.471 ppm2 0.758 CV 1
OR { 957}
(( segid " " and resid 346 and name HB3 ))
( segid " " and resid 350 and name HG1%)
OR { 957}
(( segid " " and resid 346 and name HB3 ))
( segid " " and resid 350 and name HG2%)
ASSI { 1263}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 305 and name HG2 ))
3.400 1.500 1.500 peak 1263 spectrum 1 weight 0.10000E+01 volume 0.16720E-02 ppm1 -0.358 ppm2 1.677 CV 1
OR { 1263}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 307 and name HB3 ))
ASSI { 1372}
( segid " " and resid 364 and name HG2%)
(( segid " " and resid 323 and name HA ))
3.000 1.100 1.100 peak 1372 spectrum 1 weight 0.10000E+01 volume 0.43872E-02 ppm1 0.908 ppm2 3.277 CV 1
OR { 1372}
( segid " " and resid 364 and name HG2%)
(( segid " " and resid 368 and name HB2 ))
OR { 1372}
( segid " " and resid 364 and name HG2%)
(( segid " " and resid 319 and name HB2 ))
ASSI { 3552}
( segid " " and resid 212 and name HG2%)
( segid " " and resid 255 and name HD1%)
4.100 2.100 1.900 peak 3552 spectrum 1 weight 0.10000E+01 volume 0.11419E-02 ppm1 -0.165 ppm2 0.620 CV 1
OR { 3552}
( segid " " and resid 212 and name HG2%)
( segid " " and resid 253 and name HG2%)
ASSI { 740}
( segid " " and resid 195 and name HB% )
(( segid " " and resid 313 and name HB3 ))
3.800 1.800 1.800 peak 740 spectrum 1 weight 0.10000E+01 volume 0.17594E-02 ppm1 1.356 ppm2 2.848 CV 1
OR { 740}
( segid " " and resid 195 and name HB% )
(( segid " " and resid 313 and name HB2 ))
OR { 740}
( segid " " and resid 195 and name HB% )
(( segid " " and resid 198 and name HA ))
ASSI { 725}
( segid " " and resid 368 and name HD% )
( segid " " and resid 364 and name HG2%)
2.700 0.900 0.900 peak 725 spectrum 1 weight 0.10000E+01 volume 0.10827E-02 ppm1 7.149 ppm2 0.919 CV 1
OR { 725}
( segid " " and resid 368 and name HD% )
( segid " " and resid 371 and name HG2%)
ASSI { 1248}
( segid " " and resid 318 and name HD1%)
( segid " " and resid 284 and name HE% )
4.300 2.300 1.700 peak 1248 spectrum 1 weight 0.10000E+01 volume 0.12321E-02 ppm1 0.380 ppm2 2.145 CV 1
OR { 1248}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 364 and name HB ))
ASSI { 1554}
(( segid " " and resid 276 and name HG3 ))
(( segid " " and resid 281 and name HG2 ))
3.400 1.400 1.400 peak 1554 spectrum 1 weight 0.10000E+01 volume 0.27151E-02 ppm1 2.209 ppm2 1.399 CV 1
OR { 1554}
(( segid " " and resid 276 and name HG3 ))
(( segid " " and resid 281 and name HG3 ))
OR { 1554}
(( segid " " and resid 276 and name HG3 ))
(( segid " " and resid 279 and name HB3 ))
OR { 1554}
(( segid " " and resid 276 and name HG3 ))
(( segid " " and resid 310 and name HB2 ))
ASSI { 1257}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 361 and name H ))
4.100 2.100 1.900 peak 1257 spectrum 1 weight 0.10000E+01 volume 0.11250E-02 ppm1 0.394 ppm2 8.374 CV 1
OR { 1257}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 365 and name H ))
OR { 1257}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 366 and name H ))
ASSI { 3802}
( segid " " and resid 373 and name HD1%)
(( segid " " and resid 371 and name HB ))
2.700 2.700 3.300 peak 3802 spectrum 1 weight 0.10000E+01 volume 0.84586E-03 ppm1 -0.196 ppm2 1.934 CV 1
OR { 3802}
( segid " " and resid 373 and name HD1%)
( segid " " and resid 225 and name HE% )
ASSI { 94}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 399 and name HA ))
3.800 1.800 1.800 peak 94 spectrum 1 weight 0.10000E+01 volume 0.24642E-02 ppm1 0.768 ppm2 3.787 CV 1
OR { 94}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 440 and name HA ))
OR { 94}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 439 and name HA ))
ASSI { 1336}
(( segid " " and resid 210 and name HD3 ))
( segid " " and resid 194 and name HD1%)
3.800 1.800 1.800 peak 1336 spectrum 1 weight 0.10000E+01 volume 0.75846E-03 ppm1 2.894 ppm2 0.742 CV 1
OR { 1336}
(( segid " " and resid 210 and name HD3 ))
(( segid " " and resid 209 and name HG ))
OR { 1336}
(( segid " " and resid 210 and name HD3 ))
( segid " " and resid 316 and name HD2%)
ASSI { 614}
(( segid " " and resid 320 and name HZ2 ))
( segid " " and resid 207 and name HG2%)
4.600 2.700 1.400 peak 614 spectrum 1 weight 0.10000E+01 volume 0.69641E-03 ppm1 7.369 ppm2 0.470 CV 1
OR { 614}
(( segid " " and resid 320 and name HZ2 ))
(( segid " " and resid 373 and name HB2 ))
OR { 614}
(( segid " " and resid 320 and name HZ2 ))
( segid " " and resid 373 and name HD2%)
OR { 614}
(( segid " " and resid 320 and name HZ2 ))
( segid " " and resid 217 and name HG2%)
ASSI { 164}
(( segid " " and resid 243 and name HG ))
(( segid " " and resid 243 and name H ))
3.000 1.200 1.200 peak 164 spectrum 1 weight 0.10000E+01 volume 0.12067E-02 ppm1 1.121 ppm2 7.827 CV 1
OR { 164}
(( segid " " and resid 236 and name HG12))
(( segid " " and resid 236 and name H ))
ASSI { 1191}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 326 and name H ))
5.400 3.600 0.600 peak 1191 spectrum 1 weight 0.10000E+01 volume 0.56952E-03 ppm1 1.913 ppm2 8.907 CV 1
OR { 1191}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 335 and name H ))
ASSI { 144}
( segid " " and resid 192 and name HG2%)
(( segid " " and resid 189 and name HA ))
4.200 2.200 1.800 peak 144 spectrum 1 weight 0.10000E+01 volume 0.16353E-02 ppm1 0.685 ppm2 4.364 CV 1
OR { 144}
( segid " " and resid 192 and name HG2%)
(( segid " " and resid 196 and name HA ))
ASSI { 2372}
(( segid " " and resid 444 and name HG2 ))
(( segid " " and resid 444 and name HD3 ))
1.800 0.400 0.400 peak 2372 spectrum 1 weight 0.10000E+01 volume 0.21885E-01 ppm1 1.596 ppm2 3.142 CV 1
OR { 2372}
(( segid " " and resid 389 and name HG2 ))
(( segid " " and resid 389 and name HD2 ))
OR { 2372}
(( segid " " and resid 444 and name HG2 ))
(( segid " " and resid 444 and name HD2 ))
ASSI { 53}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 352 and name HG12))
2.500 0.800 0.800 peak 53 spectrum 1 weight 0.10000E+01 volume 0.18411E-02 ppm1 2.586 ppm2 1.752 CV 1
OR { 53}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 352 and name HG12))
OR { 53}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 285 and name HB3 ))
OR { 53}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 285 and name HB3 ))
ASSI { 1502}
(( segid " " and resid 359 and name HA ))
( segid " " and resid 358 and name HD% )
3.500 1.500 1.500 peak 1502 spectrum 1 weight 0.10000E+01 volume 0.83739E-03 ppm1 3.331 ppm2 7.038 CV 1
OR { 1502}
(( segid " " and resid 359 and name HA ))
(( segid " " and resid 363 and name HD2 ))
OR { 1502}
(( segid " " and resid 359 and name HA ))
( segid " " and resid 360 and name HD% )
ASSI { 1020}
( segid " " and resid 202 and name HE% )
(( segid " " and resid 208 and name H ))
3.000 1.100 1.100 peak 1020 spectrum 1 weight 0.10000E+01 volume 0.49651E-02 ppm1 1.851 ppm2 8.210 CV 1
OR { 1020}
( segid " " and resid 388 and name HE% )
(( segid " " and resid 388 and name H ))
OR { 1020}
( segid " " and resid 388 and name HE% )
(( segid " " and resid 391 and name H ))
OR { 1020}
( segid " " and resid 202 and name HE% )
(( segid " " and resid 203 and name H ))
OR { 1020}
( segid " " and resid 202 and name HE% )
(( segid " " and resid 202 and name H ))
ASSI { 466}
( segid " " and resid 307 and name HD1%)
( segid " " and resid 360 and name HE% )
2.800 1.000 1.000 peak 466 spectrum 1 weight 0.10000E+01 volume 0.83683E-02 ppm1 1.210 ppm2 7.055 CV 1
OR { 466}
( segid " " and resid 307 and name HD1%)
( segid " " and resid 315 and name HD% )
OR { 466}
( segid " " and resid 307 and name HD1%)
( segid " " and resid 303 and name HD% )
OR { 466}
( segid " " and resid 307 and name HD1%)
(( segid " " and resid 308 and name H ))
OR { 466}
( segid " " and resid 307 and name HD1%)
(( segid " " and resid 310 and name H ))
ASSI { 1361}
(( segid " " and resid 362 and name HB ))
( segid " " and resid 358 and name HD% )
5.100 3.200 0.900 peak 1361 spectrum 1 weight 0.10000E+01 volume 0.43985E-03 ppm1 3.769 ppm2 7.043 CV 1
OR { 1361}
(( segid " " and resid 362 and name HB ))
(( segid " " and resid 363 and name HD2 ))
OR { 1361}
(( segid " " and resid 362 and name HB ))
( segid " " and resid 360 and name HD% )
ASSI { 1124}
( segid " " and resid 316 and name HD1%)
( segid " " and resid 209 and name HD1%)
3.400 1.400 1.400 peak 1124 spectrum 1 weight 0.10000E+01 volume 0.41672E-02 ppm1 0.823 ppm2 0.192 CV 1
OR { 1124}
( segid " " and resid 316 and name HD1%)
( segid " " and resid 317 and name HD1%)
ASSI { 1202}
(( segid " " and resid 246 and name HA ))
(( segid " " and resid 251 and name HG2 ))
4.500 2.500 1.500 peak 1202 spectrum 1 weight 0.10000E+01 volume 0.56109E-03 ppm1 3.837 ppm2 2.176 CV 1
OR { 1202}
(( segid " " and resid 246 and name HA ))
(( segid " " and resid 251 and name HG3 ))
OR { 1202}
(( segid " " and resid 246 and name HA ))
(( segid " " and resid 242 and name HG2 ))
ASSI { 825}
(( segid " " and resid 351 and name HG3 ))
(( segid " " and resid 277 and name HB3 ))
3.000 3.000 3.000 peak 825 spectrum 1 weight 0.10000E+01 volume 0.30732E-02 ppm1 2.062 ppm2 1.901 CV 1
OR { 825}
(( segid " " and resid 351 and name HG3 ))
(( segid " " and resid 272 and name HB3 ))
OR { 825}
(( segid " " and resid 351 and name HG3 ))
(( segid " " and resid 356 and name HB ))
ASSI { 430}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 277 and name H ))
3.000 3.000 3.000 peak 430 spectrum 1 weight 0.10000E+01 volume 0.67666E-03 ppm1 2.149 ppm2 8.696 CV 1
OR { 430}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 282 and name H ))
OR { 430}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 307 and name H ))
ASSI { 263}
( segid " " and resid 359 and name HG2%)
( segid " " and resid 364 and name HG1%)
4.500 2.600 1.500 peak 263 spectrum 1 weight 0.10000E+01 volume 0.79791E-03 ppm1 -0.458 ppm2 1.014 CV 1
OR { 263}
( segid " " and resid 359 and name HG2%)
(( segid " " and resid 367 and name HB2 ))
OR { 263}
( segid " " and resid 359 and name HG2%)
( segid " " and resid 307 and name HD2%)
ASSI { 1399}
(( segid " " and resid 197 and name HA ))
(( segid " " and resid 197 and name H ))
3.600 1.700 1.700 peak 1399 spectrum 1 weight 0.10000E+01 volume 0.60055E-03 ppm1 3.905 ppm2 8.045 CV 1
OR { 1399}
(( segid " " and resid 264 and name HA ))
(( segid " " and resid 267 and name H ))
OR { 1399}
(( segid " " and resid 195 and name HA ))
(( segid " " and resid 197 and name H ))
ASSI { 916}
(( segid " " and resid 198 and name HA ))
(( segid " " and resid 201 and name HG1 ))
3.400 1.500 1.500 peak 916 spectrum 1 weight 0.10000E+01 volume 0.63439E-03 ppm1 2.890 ppm2 4.398 CV 1
OR { 916}
(( segid " " and resid 198 and name HA ))
(( segid " " and resid 201 and name HB ))
OR { 916}
(( segid " " and resid 198 and name HA ))
(( segid " " and resid 209 and name HA ))
ASSI { 1136}
( segid " " and resid 207 and name HG2%)
(( segid " " and resid 206 and name H ))
5.000 3.100 1.000 peak 1136 spectrum 1 weight 0.10000E+01 volume 0.49904E-03 ppm1 0.460 ppm2 7.667 CV 1
OR { 1136}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 219 and name H ))
OR { 1136}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 216 and name H ))
ASSI { 1205}
( segid " " and resid 361 and name HE% )
(( segid " " and resid 325 and name HB2 ))
3.600 1.600 1.600 peak 1205 spectrum 1 weight 0.10000E+01 volume 0.82047E-03 ppm1 7.072 ppm2 1.704 CV 1
OR { 1205}
( segid " " and resid 361 and name HE% )
(( segid " " and resid 342 and name HB ))
OR { 1205}
( segid " " and resid 361 and name HE% )
(( segid " " and resid 346 and name HG ))
ASSI { 569}
( segid " " and resid 189 and name HD1%)
(( segid " " and resid 198 and name HA ))
5.000 3.200 1.000 peak 569 spectrum 1 weight 0.10000E+01 volume 0.41729E-03 ppm1 0.734 ppm2 2.905 CV 1
OR { 569}
( segid " " and resid 189 and name HD1%)
(( segid " " and resid 270 and name HB2 ))
OR { 569}
( segid " " and resid 189 and name HD1%)
(( segid " " and resid 210 and name HD3 ))
ASSI { 1310}
( segid " " and resid 236 and name HG2%)
(( segid " " and resid 236 and name HB ))
2.200 0.600 0.600 peak 1310 spectrum 1 weight 0.10000E+01 volume 0.90759E-02 ppm1 0.960 ppm2 1.753 CV 1
OR { 1310}
( segid " " and resid 236 and name HG2%)
(( segid " " and resid 237 and name HB3 ))
OR { 1310}
( segid " " and resid 236 and name HG2%)
(( segid " " and resid 239 and name HB3 ))
ASSI { 1076}
( segid " " and resid 335 and name HG2%)
(( segid " " and resid 227 and name HB3 ))
2.500 2.500 3.500 peak 1076 spectrum 1 weight 0.10000E+01 volume 0.13054E-02 ppm1 1.247 ppm2 2.841 CV 1
OR { 1076}
( segid " " and resid 335 and name HG2%)
(( segid " " and resid 331 and name HE3 ))
OR { 1076}
( segid " " and resid 335 and name HG2%)
(( segid " " and resid 336 and name HE2 ))
OR { 1076}
( segid " " and resid 335 and name HG2%)
(( segid " " and resid 336 and name HE3 ))
OR { 1076}
( segid " " and resid 335 and name HG2%)
(( segid " " and resid 225 and name HG2 ))
ASSI { 1396}
( segid " " and resid 317 and name HD1%)
( segid " " and resid 278 and name HD2%)
2.200 0.600 0.600 peak 1396 spectrum 1 weight 0.10000E+01 volume 0.18983E-01 ppm1 0.170 ppm2 0.742 CV 1
OR { 1396}
( segid " " and resid 317 and name HD1%)
( segid " " and resid 194 and name HD1%)
OR { 1396}
( segid " " and resid 317 and name HD1%)
( segid " " and resid 271 and name HD2%)
OR { 1396}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 209 and name HG ))
ASSI { 1551}
( segid " " and resid 243 and name HD2%)
( segid " " and resid 266 and name HD2%)
3.300 1.300 1.300 peak 1551 spectrum 1 weight 0.10000E+01 volume 0.67610E-02 ppm1 0.166 ppm2 0.789 CV 1
OR { 1551}
( segid " " and resid 243 and name HD2%)
( segid " " and resid 255 and name HD2%)
OR { 1551}
( segid " " and resid 243 and name HD2%)
( segid " " and resid 240 and name HG2%)
ASSI { 2222}
(( segid " " and resid 429 and name HB2 ))
(( segid " " and resid 429 and name HA ))
3.400 1.400 1.400 peak 2222 spectrum 1 weight 0.10000E+01 volume 0.56952E-03 ppm1 1.416 ppm2 3.706 CV 1
OR { 2222}
(( segid " " and resid 429 and name HB2 ))
(( segid " " and resid 426 and name HA ))
ASSI { 802}
(( segid " " and resid 281 and name HG2 ))
(( segid " " and resid 282 and name HG2 ))
3.700 1.700 1.700 peak 802 spectrum 1 weight 0.10000E+01 volume 0.23120E-02 ppm1 1.404 ppm2 2.385 CV 1
OR { 802}
(( segid " " and resid 281 and name HG3 ))
(( segid " " and resid 282 and name HG2 ))
OR { 802}
(( segid " " and resid 281 and name HG2 ))
(( segid " " and resid 283 and name HB2 ))
ASSI { 511}
(( segid " " and resid 256 and name HG2 ))
(( segid " " and resid 254 and name HD21))
5.000 3.100 1.000 peak 511 spectrum 1 weight 0.10000E+01 volume 0.10037E-02 ppm1 2.315 ppm2 7.446 CV 1
OR { 511}
(( segid " " and resid 256 and name HG2 ))
(( segid " " and resid 257 and name H ))
ASSI { 80}
(( segid " " and resid 210 and name HG2 ))
( segid " " and resid 317 and name HD2%)
3.800 1.800 1.800 peak 80 spectrum 1 weight 0.10000E+01 volume 0.19454E-02 ppm1 1.651 ppm2 0.376 CV 1
OR { 80}
(( segid " " and resid 305 and name HG2 ))
( segid " " and resid 306 and name HD1%)
OR { 80}
(( segid " " and resid 210 and name HG2 ))
(( segid " " and resid 317 and name HG ))
ASSI { 936}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 337 and name HB3 ))
3.300 1.300 1.300 peak 936 spectrum 1 weight 0.10000E+01 volume 0.26616E-02 ppm1 0.658 ppm2 1.505 CV 1
OR { 936}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 232 and name HG3 ))
OR { 936}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 232 and name HB2 ))
OR { 936}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 346 and name HB3 ))
ASSI { 669}
( segid " " and resid 416 and name HD1%)
(( segid " " and resid 422 and name H ))
3.400 1.500 1.500 peak 669 spectrum 1 weight 0.10000E+01 volume 0.15874E-02 ppm1 0.847 ppm2 8.222 CV 1
OR { 669}
( segid " " and resid 416 and name HD1%)
(( segid " " and resid 418 and name H ))
ASSI { 774}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 318 and name HG12))
2.000 0.500 0.500 peak 774 spectrum 1 weight 0.10000E+01 volume 0.12899E-01 ppm1 0.349 ppm2 1.040 CV 1
OR { 774}
( segid " " and resid 318 and name HG2%)
( segid " " and resid 310 and name HD1%)
OR { 774}
( segid " " and resid 318 and name HG2%)
( segid " " and resid 307 and name HD2%)
ASSI { 1114}
( segid " " and resid 306 and name HD2%)
( segid " " and resid 303 and name HD% )
4.000 2.000 2.000 peak 1114 spectrum 1 weight 0.10000E+01 volume 0.12124E-02 ppm1 -0.359 ppm2 7.077 CV 1
OR { 1114}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 308 and name H ))
ASSI { 2860}
(( segid " " and resid 358 and name HB3 ))
(( segid " " and resid 358 and name H ))
3.100 1.200 1.200 peak 2860 spectrum 1 weight 0.10000E+01 volume 0.17396E-02 ppm1 2.947 ppm2 8.567 CV 1
OR { 2860}
(( segid " " and resid 254 and name HB3 ))
(( segid " " and resid 255 and name H ))
ASSI { 1168}
(( segid " " and resid 324 and name HB2 ))
(( segid " " and resid 324 and name HD2 ))
3.700 1.700 1.700 peak 1168 spectrum 1 weight 0.10000E+01 volume 0.43985E-03 ppm1 2.912 ppm2 7.140 CV 1
OR { 1168}
(( segid " " and resid 324 and name HB2 ))
( segid " " and resid 213 and name HE% )
OR { 1168}
(( segid " " and resid 324 and name HB2 ))
(( segid " " and resid 328 and name H ))
ASSI { 611}
( segid " " and resid 217 and name HD1%)
( segid " " and resid 267 and name HD1%)
1.900 0.500 0.500 peak 611 spectrum 1 weight 0.10000E+01 volume 0.21950E-01 ppm1 -0.047 ppm2 0.904 CV 1
OR { 611}
( segid " " and resid 217 and name HD1%)
( segid " " and resid 267 and name HD2%)
OR { 611}
( segid " " and resid 217 and name HD1%)
( segid " " and resid 321 and name HD1%)
ASSI { 1185}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 360 and name HB2 ))
3.800 1.800 1.800 peak 1185 spectrum 1 weight 0.10000E+01 volume 0.14690E-02 ppm1 -0.167 ppm2 2.746 CV 1
OR { 1185}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 325 and name HG3 ))
ASSI { 1084}
( segid " " and resid 373 and name HD1%)
( segid " " and resid 373 and name HD2%)
2.200 0.600 0.600 peak 1084 spectrum 1 weight 0.10000E+01 volume 0.12575E-01 ppm1 -0.196 ppm2 0.469 CV 1
OR { 1084}
( segid " " and resid 373 and name HD1%)
(( segid " " and resid 373 and name HB2 ))
OR { 1084}
( segid " " and resid 373 and name HD1%)
( segid " " and resid 217 and name HG2%)
ASSI { 1385}
( segid " " and resid 279 and name HD2%)
(( segid " " and resid 360 and name HZ ))
3.200 1.300 1.300 peak 1385 spectrum 1 weight 0.10000E+01 volume 0.14238E-02 ppm1 0.377 ppm2 6.625 CV 1
OR { 1385}
(( segid " " and resid 222 and name HG2 ))
( segid " " and resid 223 and name HE% )
ASSI { 544}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 352 and name HG13))
2.300 0.700 0.700 peak 544 spectrum 1 weight 0.10000E+01 volume 0.49340E-02 ppm1 2.152 ppm2 1.574 CV 1
OR { 544}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 279 and name HB2 ))
ASSI { 58}
(( segid " " and resid 278 and name HB3 ))
( segid " " and resid 318 and name HD1%)
3.400 1.500 1.500 peak 58 spectrum 1 weight 0.10000E+01 volume 0.11419E-02 ppm1 1.517 ppm2 0.367 CV 1
OR { 58}
(( segid " " and resid 278 and name HB3 ))
( segid " " and resid 279 and name HD2%)
OR { 58}
(( segid " " and resid 278 and name HB3 ))
( segid " " and resid 318 and name HG2%)
OR { 58}
(( segid " " and resid 278 and name HB3 ))
( segid " " and resid 317 and name HD2%)
ASSI { 455}
( segid " " and resid 329 and name HD1%)
( segid " " and resid 361 and name HD% )
3.600 1.700 1.700 peak 455 spectrum 1 weight 0.10000E+01 volume 0.17876E-02 ppm1 0.115 ppm2 7.130 CV 1
OR { 455}
( segid " " and resid 329 and name HD1%)
(( segid " " and resid 331 and name H ))
ASSI { 472}
(( segid " " and resid 361 and name HB2 ))
( segid " " and resid 339 and name HG2%)
3.400 1.400 1.400 peak 472 spectrum 1 weight 0.10000E+01 volume 0.12321E-02 ppm1 3.080 ppm2 0.677 CV 1
OR { 472}
(( segid " " and resid 361 and name HB2 ))
( segid " " and resid 357 and name HD1%)
ASSI { 1162}
( segid " " and resid 274 and name HD1%)
(( segid " " and resid 192 and name HG13))
2.800 1.000 1.000 peak 1162 spectrum 1 weight 0.10000E+01 volume 0.50948E-02 ppm1 0.670 ppm2 1.654 CV 1
OR { 1162}
( segid " " and resid 367 and name HD1%)
(( segid " " and resid 307 and name HB3 ))
OR { 1162}
( segid " " and resid 274 and name HD1%)
(( segid " " and resid 193 and name HB3 ))
ASSI { 766}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 286 and name H ))
3.800 3.800 2.200 peak 766 spectrum 1 weight 0.10000E+01 volume 0.20864E-02 ppm1 2.152 ppm2 7.450 CV 1
OR { 766}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 288 and name H ))
ASSI { 1654}
(( segid " " and resid 308 and name HD2 ))
(( segid " " and resid 310 and name HG ))
3.700 1.700 1.700 peak 1654 spectrum 1 weight 0.10000E+01 volume 0.23825E-02 ppm1 1.530 ppm2 2.140 CV 1
OR { 1654}
(( segid " " and resid 308 and name HD2 ))
(( segid " " and resid 309 and name HG3 ))
ASSI { 931}
(( segid " " and resid 308 and name HD2 ))
(( segid " " and resid 309 and name H ))
3.500 1.500 1.500 peak 931 spectrum 1 weight 0.10000E+01 volume 0.25150E-02 ppm1 1.530 ppm2 7.487 CV 1
OR { 931}
(( segid " " and resid 308 and name HD3 ))
(( segid " " and resid 305 and name H ))
OR { 931}
(( segid " " and resid 308 and name HD2 ))
(( segid " " and resid 305 and name H ))
ASSI { 3627}
(( segid " " and resid 389 and name HG3 ))
(( segid " " and resid 389 and name HD2 ))
2.100 0.500 0.500 peak 3627 spectrum 1 weight 0.10000E+01 volume 0.16046E-01 ppm1 1.660 ppm2 3.146 CV 1
OR { 3627}
(( segid " " and resid 444 and name HG3 ))
(( segid " " and resid 444 and name HD2 ))
OR { 3627}
(( segid " " and resid 444 and name HG3 ))
(( segid " " and resid 444 and name HD3 ))
ASSI { 1512}
( segid " " and resid 307 and name HD2%)
(( segid " " and resid 303 and name HB3 ))
3.900 1.900 1.900 peak 1512 spectrum 1 weight 0.10000E+01 volume 0.58362E-03 ppm1 1.025 ppm2 2.597 CV 1
OR { 1512}
( segid " " and resid 307 and name HD2%)
(( segid " " and resid 363 and name HB3 ))
ASSI { 267}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 342 and name HG12))
3.300 1.400 1.400 peak 267 spectrum 1 weight 0.10000E+01 volume 0.33411E-02 ppm1 0.514 ppm2 1.014 CV 1
OR { 267}
( segid " " and resid 342 and name HG2%)
( segid " " and resid 345 and name HG1%)
ASSI { 739}
( segid " " and resid 201 and name HG2%)
(( segid " " and resid 200 and name HB2 ))
3.100 1.200 1.200 peak 739 spectrum 1 weight 0.10000E+01 volume 0.27039E-02 ppm1 1.291 ppm2 2.067 CV 1
OR { 739}
( segid " " and resid 201 and name HG2%)
(( segid " " and resid 200 and name HB3 ))
OR { 739}
( segid " " and resid 201 and name HG2%)
(( segid " " and resid 202 and name HB2 ))
OR { 739}
( segid " " and resid 201 and name HG2%)
(( segid " " and resid 198 and name HB ))
ASSI { 142}
( segid " " and resid 297 and name HG2%)
(( segid " " and resid 297 and name H ))
3.200 1.300 1.300 peak 142 spectrum 1 weight 0.10000E+01 volume 0.69951E-02 ppm1 1.114 ppm2 8.047 CV 1
OR { 142}
( segid " " and resid 297 and name HG2%)
(( segid " " and resid 301 and name H ))
OR { 142}
( segid " " and resid 297 and name HG2%)
(( segid " " and resid 302 and name H ))
ASSI { 1242}
( segid " " and resid 420 and name HD1%)
(( segid " " and resid 416 and name H ))
2.700 2.700 3.300 peak 1242 spectrum 1 weight 0.10000E+01 volume 0.96992E-03 ppm1 0.770 ppm2 7.962 CV 1
OR { 1242}
( segid " " and resid 420 and name HD1%)
(( segid " " and resid 415 and name H ))
OR { 1242}
( segid " " and resid 420 and name HD1%)
(( segid " " and resid 419 and name H ))
ASSI { 442}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 317 and name HB2 ))
4.500 2.500 1.500 peak 442 spectrum 1 weight 0.10000E+01 volume 0.66538E-03 ppm1 -0.912 ppm2 1.312 CV 1
OR { 442}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 207 and name HG12))
OR { 442}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 208 and name HB2 ))
OR { 442}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 374 and name HG3 ))
OR { 442}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 194 and name HG ))
OR { 442}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 374 and name HG2 ))
ASSI { 691}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 281 and name HA ))
4.000 2.000 2.000 peak 691 spectrum 1 weight 0.10000E+01 volume 0.16015E-02 ppm1 2.587 ppm2 3.976 CV 1
OR { 691}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 281 and name HA ))
OR { 691}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 280 and name HA ))
OR { 691}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 280 and name HA ))
OR { 691}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 353 and name HB2 ))
OR { 691}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 353 and name HB2 ))
OR { 691}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 353 and name HB3 ))
ASSI { 4162}
( segid " " and resid 361 and name HE% )
(( segid " " and resid 361 and name HZ ))
2.600 0.800 0.800 peak 4162 spectrum 1 weight 0.10000E+01 volume 0.21400E-02 ppm1 7.071 ppm2 6.622 CV 1
OR { 4162}
( segid " " and resid 360 and name HE% )
(( segid " " and resid 360 and name HZ ))
ASSI { 1815}
(( segid " " and resid 287 and name HA ))
(( segid " " and resid 287 and name H ))
3.300 1.400 1.400 peak 1815 spectrum 1 weight 0.10000E+01 volume 0.87120E-03 ppm1 3.490 ppm2 8.000 CV 1
OR { 1815}
(( segid " " and resid 287 and name HA ))
(( segid " " and resid 289 and name H ))
ASSI { 783}
( segid " " and resid 283 and name HD2%)
( segid " " and resid 310 and name HD2%)
1.900 0.500 0.500 peak 783 spectrum 1 weight 0.10000E+01 volume 0.22065E-01 ppm1 0.903 ppm2 1.084 CV 1
OR { 783}
( segid " " and resid 283 and name HD2%)
( segid " " and resid 280 and name HG2%)
OR { 783}
( segid " " and resid 283 and name HD2%)
( segid " " and resid 310 and name HD1%)
OR { 783}
( segid " " and resid 267 and name HD2%)
( segid " " and resid 220 and name HG2%)
ASSI { 737}
( segid " " and resid 339 and name HG2%)
(( segid " " and resid 338 and name HD22))
5.600 4.000 0.400 peak 737 spectrum 1 weight 0.10000E+01 volume 0.41165E-03 ppm1 0.708 ppm2 7.425 CV 1
OR { 737}
( segid " " and resid 339 and name HG2%)
(( segid " " and resid 340 and name HE22))
ASSI { 211}
( segid " " and resid 373 and name HD2%)
( segid " " and resid 325 and name HE% )
2.400 2.400 3.600 peak 211 spectrum 1 weight 0.10000E+01 volume 0.16579E-02 ppm1 0.513 ppm2 0.887 CV 1
OR { 211}
( segid " " and resid 373 and name HD2%)
( segid " " and resid 364 and name HG2%)
OR { 211}
( segid " " and resid 373 and name HD2%)
( segid " " and resid 207 and name HD1%)
OR { 211}
( segid " " and resid 373 and name HD2%)
( segid " " and resid 321 and name HD1%)
OR { 211}
( segid " " and resid 373 and name HD2%)
( segid " " and resid 267 and name HD1%)
OR { 211}
( segid " " and resid 373 and name HD2%)
( segid " " and resid 267 and name HD2%)
OR { 211}
( segid " " and resid 373 and name HD2%)
( segid " " and resid 346 and name HD1%)
ASSI { 1264}
( segid " " and resid 345 and name HG2%)
( segid " " and resid 346 and name HD2%)
2.600 0.900 0.900 peak 1264 spectrum 1 weight 0.10000E+01 volume 0.20021E-01 ppm1 0.912 ppm2 0.751 CV 1
OR { 1264}
( segid " " and resid 364 and name HG2%)
( segid " " and resid 323 and name HG1%)
OR { 1264}
( segid " " and resid 364 and name HG2%)
( segid " " and resid 367 and name HD2%)
ASSI { 486}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 341 and name HA ))
4.400 2.400 1.600 peak 486 spectrum 1 weight 0.10000E+01 volume 0.82611E-03 ppm1 0.655 ppm2 4.422 CV 1
OR { 486}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 232 and name HA ))
ASSI { 1079}
( segid " " and resid 247 and name HE% )
(( segid " " and resid 243 and name HA ))
4.800 2.900 1.200 peak 1079 spectrum 1 weight 0.10000E+01 volume 0.31014E-03 ppm1 6.470 ppm2 3.926 CV 1
OR { 1079}
( segid " " and resid 247 and name HE% )
(( segid " " and resid 255 and name HA ))
ASSI { 394}
( segid " " and resid 267 and name HD1%)
( segid " " and resid 213 and name HE% )
2.700 0.900 0.900 peak 394 spectrum 1 weight 0.10000E+01 volume 0.37893E-02 ppm1 0.915 ppm2 7.137 CV 1
OR { 394}
( segid " " and resid 267 and name HD1%)
( segid " " and resid 270 and name HD% )
ASSI { 2638}
( segid " " and resid 223 and name HE% )
(( segid " " and resid 256 and name HA ))
4.000 2.000 2.000 peak 2638 spectrum 1 weight 0.10000E+01 volume 0.10291E-02 ppm1 6.643 ppm2 4.121 CV 1
OR { 2638}
( segid " " and resid 223 and name HE% )
(( segid " " and resid 219 and name HA ))
ASSI { 276}
( segid " " and resid 236 and name HG2%)
(( segid " " and resid 236 and name HG12))
2.100 0.600 0.600 peak 276 spectrum 1 weight 0.10000E+01 volume 0.11594E-01 ppm1 0.960 ppm2 1.121 CV 1
OR { 276}
( segid " " and resid 236 and name HG2%)
( segid " " and resid 262 and name HG2%)
ASSI { 647}
( segid " " and resid 189 and name HG2%)
(( segid " " and resid 189 and name H ))
4.400 2.500 1.600 peak 647 spectrum 1 weight 0.10000E+01 volume 0.10827E-02 ppm1 0.938 ppm2 8.882 CV 1
OR { 647}
( segid " " and resid 189 and name HG2%)
(( segid " " and resid 248 and name H ))
ASSI { 1659}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 363 and name HB3 ))
3.200 1.300 1.300 peak 1659 spectrum 1 weight 0.10000E+01 volume 0.13872E-02 ppm1 0.074 ppm2 2.651 CV 1
OR { 1659}
( segid " " and resid 263 and name HG1%)
(( segid " " and resid 258 and name HB2 ))
OR { 1659}
( segid " " and resid 263 and name HG1%)
(( segid " " and resid 258 and name HB3 ))
ASSI { 716}
( segid " " and resid 443 and name HD2%)
(( segid " " and resid 443 and name H ))
3.500 1.500 1.500 peak 716 spectrum 1 weight 0.10000E+01 volume 0.54756E-02 ppm1 0.784 ppm2 7.638 CV 1
OR { 716}
( segid " " and resid 443 and name HD2%)
(( segid " " and resid 446 and name H ))
ASSI { 1232}
(( segid " " and resid 207 and name HG13))
(( segid " " and resid 209 and name HB3 ))
3.400 1.400 1.400 peak 1232 spectrum 1 weight 0.10000E+01 volume 0.15676E-02 ppm1 1.034 ppm2 1.858 CV 1
OR { 1232}
( segid " " and resid 307 and name HD2%)
(( segid " " and resid 304 and name HB3 ))
OR { 1232}
(( segid " " and resid 207 and name HG13))
(( segid " " and resid 203 and name HB3 ))
OR { 1232}
(( segid " " and resid 207 and name HG13))
( segid " " and resid 202 and name HE% )
OR { 1232}
( segid " " and resid 307 and name HD2%)
(( segid " " and resid 308 and name HB3 ))
OR { 1232}
( segid " " and resid 307 and name HD2%)
(( segid " " and resid 308 and name HB2 ))
ASSI { 1935}
(( segid " " and resid 287 and name HB3 ))
( segid " " and resid 356 and name HG2%)
3.900 1.900 1.900 peak 1935 spectrum 1 weight 0.10000E+01 volume 0.50469E-03 ppm1 2.466 ppm2 0.375 CV 1
OR { 1935}
(( segid " " and resid 287 and name HB3 ))
( segid " " and resid 279 and name HD2%)
ASSI { 1333}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 346 and name HB3 ))
3.500 1.500 1.500 peak 1333 spectrum 1 weight 0.10000E+01 volume 0.22923E-02 ppm1 0.514 ppm2 1.518 CV 1
OR { 1333}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 337 and name HB3 ))
OR { 1333}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 339 and name HB ))
ASSI { 371}
( segid " " and resid 220 and name HG2%)
(( segid " " and resid 223 and name H ))
4.900 3.100 1.100 peak 371 spectrum 1 weight 0.10000E+01 volume 0.11504E-02 ppm1 1.115 ppm2 8.433 CV 1
OR { 371}
( segid " " and resid 220 and name HG1%)
(( segid " " and resid 223 and name H ))
OR { 371}
( segid " " and resid 220 and name HG1%)
(( segid " " and resid 231 and name H ))
ASSI { 2997}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 318 and name HG13))
1.700 0.400 0.500 peak 2997 spectrum 1 weight 0.10000E+01 volume 0.28578E-01 ppm1 0.380 ppm2 0.632 CV 1
OR { 2997}
( segid " " and resid 318 and name HD1%)
( segid " " and resid 321 and name HD2%)
OR { 2997}
( segid " " and resid 318 and name HD1%)
( segid " " and resid 278 and name HD1%)
ASSI { 1552}
(( segid " " and resid 239 and name HG2 ))
(( segid " " and resid 239 and name HA ))
3.200 1.300 1.300 peak 1552 spectrum 1 weight 0.10000E+01 volume 0.18665E-02 ppm1 1.419 ppm2 4.264 CV 1
OR { 1552}
(( segid " " and resid 187 and name HG2 ))
(( segid " " and resid 186 and name HA ))
ASSI { 1042}
( segid " " and resid 321 and name HD2%)
( segid " " and resid 213 and name HE% )
3.700 1.700 1.700 peak 1042 spectrum 1 weight 0.10000E+01 volume 0.21400E-02 ppm1 0.661 ppm2 7.089 CV 1
OR { 1042}
( segid " " and resid 321 and name HD2%)
( segid " " and resid 360 and name HE% )
OR { 1042}
( segid " " and resid 321 and name HD2%)
( segid " " and resid 360 and name HD% )
OR { 1042}
( segid " " and resid 321 and name HD2%)
( segid " " and resid 361 and name HE% )
OR { 1042}
( segid " " and resid 321 and name HD2%)
(( segid " " and resid 349 and name H ))
ASSI { 1197}
( segid " " and resid 436 and name HD2%)
(( segid " " and resid 410 and name H ))
3.100 3.100 2.900 peak 1197 spectrum 1 weight 0.10000E+01 volume 0.49904E-03 ppm1 0.856 ppm2 7.898 CV 1
OR { 1197}
( segid " " and resid 436 and name HD2%)
(( segid " " and resid 445 and name H ))
ASSI { 624}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 309 and name H ))
3.500 1.600 1.600 peak 624 spectrum 1 weight 0.10000E+01 volume 0.24755E-02 ppm1 0.378 ppm2 7.466 CV 1
OR { 624}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 305 and name H ))
ASSI { 398}
(( segid " " and resid 374 and name HG3 ))
(( segid " " and resid 320 and name HZ2 ))
3.500 1.500 1.500 peak 398 spectrum 1 weight 0.10000E+01 volume 0.10094E-02 ppm1 1.368 ppm2 7.366 CV 1
OR { 398}
(( segid " " and resid 299 and name HG3 ))
(( segid " " and resid 295 and name H ))
OR { 398}
(( segid " " and resid 299 and name HG3 ))
(( segid " " and resid 298 and name H ))
OR { 398}
(( segid " " and resid 374 and name HG2 ))
(( segid " " and resid 320 and name HZ2 ))
OR { 398}
(( segid " " and resid 299 and name HG2 ))
(( segid " " and resid 295 and name H ))
ASSI { 1389}
(( segid " " and resid 207 and name HG13))
(( segid " " and resid 207 and name HB ))
2.600 0.800 0.800 peak 1389 spectrum 1 weight 0.10000E+01 volume 0.33242E-02 ppm1 1.030 ppm2 1.626 CV 1
OR { 1389}
( segid " " and resid 307 and name HD2%)
(( segid " " and resid 307 and name HB3 ))
OR { 1389}
( segid " " and resid 307 and name HD2%)
(( segid " " and resid 307 and name HB2 ))
ASSI { 1620}
(( segid " " and resid 318 and name HB ))
(( segid " " and resid 278 and name HB3 ))
3.000 1.100 1.100 peak 1620 spectrum 1 weight 0.10000E+01 volume 0.56952E-03 ppm1 1.356 ppm2 1.545 CV 1
OR { 1620}
(( segid " " and resid 318 and name HB ))
(( segid " " and resid 321 and name HB3 ))
ASSI { 1657}
(( segid " " and resid 317 and name HB2 ))
( segid " " and resid 317 and name HD2%)
3.900 1.900 1.900 peak 1657 spectrum 1 weight 0.10000E+01 volume 0.53571E-03 ppm1 1.334 ppm2 0.361 CV 1
OR { 1657}
(( segid " " and resid 317 and name HB2 ))
(( segid " " and resid 317 and name HG ))
OR { 1657}
(( segid " " and resid 317 and name HB2 ))
( segid " " and resid 318 and name HG2%)
ASSI { 1378}
( segid " " and resid 316 and name HD2%)
(( segid " " and resid 319 and name HG ))
3.800 1.800 1.800 peak 1378 spectrum 1 weight 0.10000E+01 volume 0.21626E-02 ppm1 0.751 ppm2 4.041 CV 1
OR { 1378}
(( segid " " and resid 209 and name HG ))
(( segid " " and resid 210 and name HA ))
OR { 1378}
(( segid " " and resid 208 and name HG3 ))
(( segid " " and resid 312 and name HA ))
OR { 1378}
(( segid " " and resid 208 and name HG2 ))
(( segid " " and resid 312 and name HA ))
OR { 1378}
(( segid " " and resid 209 and name HG ))
(( segid " " and resid 319 and name HG ))
OR { 1378}
(( segid " " and resid 209 and name HG ))
(( segid " " and resid 321 and name HA ))
OR { 1378}
( segid " " and resid 316 and name HD2%)
(( segid " " and resid 374 and name HA ))
ASSI { 3025}
(( segid " " and resid 304 and name HB2 ))
(( segid " " and resid 304 and name HA ))
3.100 1.200 1.200 peak 3025 spectrum 1 weight 0.10000E+01 volume 0.16325E-02 ppm1 2.237 ppm2 3.987 CV 1
OR { 3025}
(( segid " " and resid 304 and name HB2 ))
(( segid " " and resid 301 and name HA ))
ASSI { 483}
( segid " " and resid 307 and name HD1%)
(( segid " " and resid 307 and name HG ))
2.500 0.800 0.800 peak 483 spectrum 1 weight 0.10000E+01 volume 0.40516E-02 ppm1 1.210 ppm2 2.294 CV 1
OR { 483}
( segid " " and resid 307 and name HD1%)
(( segid " " and resid 304 and name HG3 ))
ASSI { 587}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 410 and name HA ))
3.300 1.400 1.400 peak 587 spectrum 1 weight 0.10000E+01 volume 0.37752E-02 ppm1 0.764 ppm2 4.368 CV 1
OR { 587}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 430 and name HA ))
OR { 587}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 407 and name HA ))
ASSI { 3198}
( segid " " and resid 264 and name HB% )
(( segid " " and resid 264 and name HA ))
2.300 0.700 0.700 peak 3198 spectrum 1 weight 0.10000E+01 volume 0.67582E-02 ppm1 0.956 ppm2 3.921 CV 1
OR { 3198}
( segid " " and resid 236 and name HG2%)
(( segid " " and resid 236 and name HA ))
ASSI { 2586}
( segid " " and resid 423 and name HD2%)
(( segid " " and resid 423 and name H ))
3.600 1.600 1.600 peak 2586 spectrum 1 weight 0.10000E+01 volume 0.48635E-02 ppm1 0.822 ppm2 8.696 CV 1
OR { 2586}
( segid " " and resid 316 and name HD1%)
(( segid " " and resid 316 and name H ))
ASSI { 122}
(( segid " " and resid 214 and name HD2 ))
( segid " " and resid 207 and name HD1%)
2.200 0.600 0.600 peak 122 spectrum 1 weight 0.10000E+01 volume 0.94566E-02 ppm1 2.966 ppm2 0.891 CV 1
OR { 122}
(( segid " " and resid 374 and name HE3 ))
( segid " " and resid 207 and name HD1%)
OR { 122}
(( segid " " and resid 214 and name HD2 ))
( segid " " and resid 376 and name HG2%)
ASSI { 241}
( segid " " and resid 209 and name HD2%)
( segid " " and resid 213 and name HE% )
3.500 1.500 1.500 peak 241 spectrum 1 weight 0.10000E+01 volume 0.17876E-02 ppm1 -0.904 ppm2 7.156 CV 1
OR { 241}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 320 and name HH2 ))
OR { 241}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 214 and name H ))
ASSI { 76}
(( segid " " and resid 318 and name HA ))
(( segid " " and resid 318 and name HG12))
4.200 2.200 1.800 peak 76 spectrum 1 weight 0.10000E+01 volume 0.91069E-03 ppm1 3.369 ppm2 0.969 CV 1
OR { 76}
(( segid " " and resid 318 and name HA ))
( segid " " and resid 307 and name HD2%)
ASSI { 717}
( segid " " and resid 317 and name HD1%)
( segid " " and resid 270 and name HE% )
2.800 1.000 1.000 peak 717 spectrum 1 weight 0.10000E+01 volume 0.68230E-03 ppm1 0.168 ppm2 6.064 CV 1
OR { 717}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 320 and name HE3 ))
ASSI { 1851}
( segid " " and resid 243 and name HD1%)
( segid " " and resid 255 and name HD1%)
3.000 1.100 1.100 peak 1851 spectrum 1 weight 0.10000E+01 volume 0.55856E-02 ppm1 0.012 ppm2 0.606 CV 1
OR { 1851}
( segid " " and resid 243 and name HD1%)
( segid " " and resid 253 and name HG2%)
ASSI { 2502}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 210 and name HD3 ))
3.400 1.400 1.400 peak 2502 spectrum 1 weight 0.10000E+01 volume 0.13449E-02 ppm1 0.170 ppm2 2.874 CV 1
OR { 2502}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 320 and name HB2 ))
ASSI { 3690}
(( segid " " and resid 285 and name HG2 ))
(( segid " " and resid 285 and name HD3 ))
2.300 0.700 0.700 peak 3690 spectrum 1 weight 0.10000E+01 volume 0.37808E-02 ppm1 1.971 ppm2 3.696 CV 1
OR { 3690}
(( segid " " and resid 348 and name HG3 ))
(( segid " " and resid 348 and name HD3 ))
OR { 3690}
(( segid " " and resid 285 and name HG3 ))
(( segid " " and resid 285 and name HD3 ))
ASSI { 612}
( segid " " and resid 315 and name HD% )
(( segid " " and resid 307 and name HB2 ))
3.300 1.400 1.400 peak 612 spectrum 1 weight 0.10000E+01 volume 0.14041E-02 ppm1 7.022 ppm2 1.592 CV 1
OR { 612}
( segid " " and resid 315 and name HD% )
(( segid " " and resid 316 and name HB3 ))
OR { 612}
( segid " " and resid 315 and name HD% )
(( segid " " and resid 307 and name HB3 ))
OR { 612}
( segid " " and resid 315 and name HD% )
(( segid " " and resid 316 and name HG ))
OR { 612}
( segid " " and resid 315 and name HD% )
(( segid " " and resid 316 and name HB2 ))
ASSI { 399}
(( segid " " and resid 416 and name HG ))
(( segid " " and resid 416 and name H ))
3.700 1.700 1.700 peak 399 spectrum 1 weight 0.10000E+01 volume 0.20046E-02 ppm1 1.642 ppm2 7.977 CV 1
OR { 399}
(( segid " " and resid 399 and name HG3 ))
(( segid " " and resid 400 and name H ))
OR { 399}
(( segid " " and resid 416 and name HG ))
(( segid " " and resid 415 and name H ))
ASSI { 619}
( segid " " and resid 258 and name HE% )
(( segid " " and resid 258 and name HA ))
3.000 3.000 3.000 peak 619 spectrum 1 weight 0.10000E+01 volume 0.44831E-03 ppm1 6.639 ppm2 4.388 CV 1
OR { 619}
( segid " " and resid 258 and name HE% )
(( segid " " and resid 257 and name HA ))
ASSI { 25}
( segid " " and resid 357 and name HD1%)
( segid " " and resid 322 and name HG2%)
3.200 1.300 1.300 peak 25 spectrum 1 weight 0.10000E+01 volume 0.44465E-02 ppm1 0.676 ppm2 0.383 CV 1
OR { 25}
( segid " " and resid 357 and name HD1%)
( segid " " and resid 318 and name HD1%)
OR { 25}
( segid " " and resid 357 and name HD1%)
( segid " " and resid 279 and name HD2%)
ASSI { 330}
( segid " " and resid 315 and name HD% )
( segid " " and resid 318 and name HG2%)
4.100 2.100 1.900 peak 330 spectrum 1 weight 0.10000E+01 volume 0.10714E-02 ppm1 7.024 ppm2 0.356 CV 1
OR { 330}
( segid " " and resid 315 and name HD% )
( segid " " and resid 318 and name HD1%)
OR { 330}
( segid " " and resid 315 and name HD% )
( segid " " and resid 317 and name HD2%)
ASSI { 2213}
( segid " " and resid 213 and name HD% )
( segid " " and resid 317 and name HD1%)
4.000 2.000 2.000 peak 2213 spectrum 1 weight 0.10000E+01 volume 0.33270E-03 ppm1 6.701 ppm2 0.184 CV 1
OR { 2213}
( segid " " and resid 213 and name HD% )
( segid " " and resid 209 and name HD1%)
ASSI { 360}
( segid " " and resid 263 and name HG1%)
(( segid " " and resid 255 and name HA ))
3.800 1.800 1.800 peak 360 spectrum 1 weight 0.10000E+01 volume 0.21654E-02 ppm1 0.074 ppm2 3.952 CV 1
OR { 360}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 366 and name HA ))
OR { 360}
( segid " " and resid 263 and name HG1%)
(( segid " " and resid 264 and name HA ))
OR { 360}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 301 and name HA ))
OR { 360}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 297 and name HB ))
OR { 360}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 298 and name HA ))
OR { 360}
( segid " " and resid 263 and name HG1%)
(( segid " " and resid 265 and name HB3 ))
OR { 360}
( segid " " and resid 263 and name HG1%)
(( segid " " and resid 266 and name HA ))
ASSI { 1296}
( segid " " and resid 357 and name HD1%)
(( segid " " and resid 357 and name HB2 ))
3.500 1.500 1.500 peak 1296 spectrum 1 weight 0.10000E+01 volume 0.20187E-02 ppm1 0.675 ppm2 1.982 CV 1
OR { 1296}
( segid " " and resid 357 and name HD1%)
(( segid " " and resid 356 and name HB ))
ASSI { 135}
( segid " " and resid 212 and name HG2%)
( segid " " and resid 266 and name HD2%)
3.400 1.500 1.500 peak 135 spectrum 1 weight 0.10000E+01 volume 0.49651E-02 ppm1 -0.168 ppm2 0.798 CV 1
OR { 135}
( segid " " and resid 212 and name HG2%)
( segid " " and resid 255 and name HD2%)
OR { 135}
( segid " " and resid 212 and name HG2%)
( segid " " and resid 274 and name HD2%)
OR { 135}
( segid " " and resid 212 and name HG2%)
( segid " " and resid 271 and name HD1%)
OR { 135}
( segid " " and resid 212 and name HG2%)
( segid " " and resid 194 and name HD1%)
ASSI { 667}
( segid " " and resid 360 and name HD% )
( segid " " and resid 357 and name HD1%)
2.500 0.800 0.800 peak 667 spectrum 1 weight 0.10000E+01 volume 0.42800E-02 ppm1 7.075 ppm2 0.682 CV 1
OR { 667}
( segid " " and resid 360 and name HE% )
( segid " " and resid 350 and name HG2%)
OR { 667}
( segid " " and resid 360 and name HE% )
( segid " " and resid 357 and name HD1%)
OR { 667}
( segid " " and resid 360 and name HD% )
( segid " " and resid 339 and name HG2%)
ASSI { 1289}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 279 and name HA ))
3.500 1.500 1.500 peak 1289 spectrum 1 weight 0.10000E+01 volume 0.22217E-02 ppm1 0.902 ppm2 4.330 CV 1
OR { 1289}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 310 and name HA ))
OR { 1289}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 284 and name HA ))
ASSI { 3673}
( segid " " and resid 219 and name HE% )
(( segid " " and resid 256 and name HA ))
3.000 1.200 1.200 peak 3673 spectrum 1 weight 0.10000E+01 volume 0.80919E-03 ppm1 6.392 ppm2 4.124 CV 1
OR { 3673}
( segid " " and resid 219 and name HE% )
(( segid " " and resid 219 and name HA ))
ASSI { 631}
(( segid " " and resid 220 and name HB ))
( segid " " and resid 217 and name HG2%)
4.700 2.800 1.300 peak 631 spectrum 1 weight 0.10000E+01 volume 0.46802E-03 ppm1 2.233 ppm2 0.469 CV 1
OR { 631}
(( segid " " and resid 220 and name HB ))
(( segid " " and resid 217 and name HG13))
OR { 631}
(( segid " " and resid 220 and name HB ))
(( segid " " and resid 217 and name HG12))
OR { 631}
(( segid " " and resid 220 and name HB ))
( segid " " and resid 373 and name HD2%)
ASSI { 839}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 341 and name HB2 ))
2.500 0.800 0.800 peak 839 spectrum 1 weight 0.10000E+01 volume 0.48607E-02 ppm1 1.803 ppm2 2.810 CV 1
OR { 839}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 341 and name HB3 ))
OR { 839}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 231 and name HB3 ))
OR { 839}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 231 and name HB2 ))
ASSI { 495}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 443 and name H ))
4.200 2.200 1.800 peak 495 spectrum 1 weight 0.10000E+01 volume 0.12152E-02 ppm1 0.701 ppm2 7.596 CV 1
OR { 495}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 403 and name H ))
OR { 495}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 441 and name H ))
OR { 495}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 442 and name H ))
OR { 495}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 404 and name H ))
ASSI { 137}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 344 and name HG13))
3.800 1.800 1.800 peak 137 spectrum 1 weight 0.10000E+01 volume 0.27885E-02 ppm1 1.010 ppm2 1.263 CV 1
OR { 137}
( segid " " and resid 345 and name HG1%)
( segid " " and resid 349 and name HG2%)
ASSI { 1201}
(( segid " " and resid 321 and name HA ))
(( segid " " and resid 317 and name HG ))
4.600 2.700 1.400 peak 1201 spectrum 1 weight 0.10000E+01 volume 0.85432E-03 ppm1 3.991 ppm2 0.398 CV 1
OR { 1201}
(( segid " " and resid 321 and name HA ))
( segid " " and resid 318 and name HD1%)
OR { 1201}
(( segid " " and resid 321 and name HA ))
( segid " " and resid 317 and name HD2%)
OR { 1201}
(( segid " " and resid 321 and name HA ))
( segid " " and resid 322 and name HG2%)
OR { 1201}
(( segid " " and resid 321 and name HA ))
( segid " " and resid 323 and name HG2%)
OR { 1201}
(( segid " " and resid 321 and name HA ))
( segid " " and resid 318 and name HG2%)
OR { 1201}
(( segid " " and resid 321 and name HA ))
(( segid " " and resid 373 and name HB2 ))
ASSI { 1488}
( segid " " and resid 367 and name HD2%)
(( segid " " and resid 364 and name H ))
2.900 2.900 3.100 peak 1488 spectrum 1 weight 0.10000E+01 volume 0.11983E-02 ppm1 0.772 ppm2 7.500 CV 1
OR { 1488}
( segid " " and resid 367 and name HD2%)
(( segid " " and resid 305 and name H ))
OR { 1488}
( segid " " and resid 367 and name HD2%)
(( segid " " and resid 370 and name HD22))
OR { 1488}
( segid " " and resid 367 and name HD2%)
(( segid " " and resid 371 and name H ))
ASSI { 403}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 393 and name H ))
2.500 2.500 3.500 peak 403 spectrum 1 weight 0.10000E+01 volume 0.13054E-02 ppm1 0.557 ppm2 8.321 CV 1
OR { 403}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 399 and name H ))
ASSI { 984}
( segid " " and resid 367 and name HD1%)
(( segid " " and resid 364 and name H ))
2.800 2.800 3.200 peak 984 spectrum 1 weight 0.10000E+01 volume 0.78381E-03 ppm1 0.662 ppm2 7.492 CV 1
OR { 984}
( segid " " and resid 367 and name HD1%)
(( segid " " and resid 305 and name H ))
OR { 984}
( segid " " and resid 367 and name HD1%)
(( segid " " and resid 299 and name H ))
OR { 984}
( segid " " and resid 274 and name HD1%)
(( segid " " and resid 317 and name H ))
ASSI { 4304}
(( segid " " and resid 409 and name HA ))
(( segid " " and resid 409 and name HB3 ))
3.600 1.700 1.700 peak 4304 spectrum 1 weight 0.10000E+01 volume 0.78098E-03 ppm1 3.688 ppm2 1.906 CV 1
OR { 4304}
(( segid " " and resid 409 and name HA ))
(( segid " " and resid 412 and name HB3 ))
ASSI { 4568}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 352 and name H ))
2.300 0.600 0.600 peak 4568 spectrum 1 weight 0.10000E+01 volume 0.33383E-02 ppm1 0.730 ppm2 7.057 CV 1
OR { 4568}
( segid " " and resid 350 and name HG2%)
( segid " " and resid 360 and name HE% )
ASSI { 746}
(( segid " " and resid 400 and name HA ))
(( segid " " and resid 400 and name H ))
2.800 1.000 1.000 peak 746 spectrum 1 weight 0.10000E+01 volume 0.35809E-02 ppm1 3.908 ppm2 7.990 CV 1
OR { 746}
(( segid " " and resid 289 and name HA ))
(( segid " " and resid 289 and name H ))
OR { 746}
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(( segid " " and resid 415 and name H ))
ASSI { 1027}
(( segid " " and resid 378 and name HD3 ))
(( segid " " and resid 378 and name HA ))
3.300 1.400 1.400 peak 1027 spectrum 1 weight 0.10000E+01 volume 0.19934E-02 ppm1 1.667 ppm2 4.426 CV 1
OR { 1027}
(( segid " " and resid 378 and name HD2 ))
(( segid " " and resid 378 and name HA ))
OR { 1027}
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(( segid " " and resid 341 and name HA ))
ASSI { 1096}
(( segid " " and resid 420 and name HG13))
(( segid " " and resid 416 and name HA ))
4.000 2.000 2.000 peak 1096 spectrum 1 weight 0.10000E+01 volume 0.12800E-02 ppm1 1.384 ppm2 4.268 CV 1
OR { 1096}
(( segid " " and resid 420 and name HG13))
(( segid " " and resid 421 and name HA ))
ASSI { 1626}
(( segid " " and resid 350 and name HA ))
(( segid " " and resid 352 and name H ))
5.400 3.700 0.600 peak 1626 spectrum 1 weight 0.10000E+01 volume 0.32142E-03 ppm1 4.538 ppm2 7.037 CV 1
OR { 1626}
(( segid " " and resid 350 and name HA ))
( segid " " and resid 360 and name HE% )
ASSI { 1145}
(( segid " " and resid 318 and name HA ))
(( segid " " and resid 318 and name HG13))
3.200 1.300 1.300 peak 1145 spectrum 1 weight 0.10000E+01 volume 0.17594E-02 ppm1 3.368 ppm2 0.649 CV 1
OR { 1145}
(( segid " " and resid 318 and name HA ))
( segid " " and resid 321 and name HD2%)
OR { 1145}
(( segid " " and resid 318 and name HA ))
( segid " " and resid 278 and name HD1%)
ASSI { 1229}
( segid " " and resid 420 and name HG2%)
(( segid " " and resid 416 and name HA ))
3.200 1.200 1.200 peak 1229 spectrum 1 weight 0.10000E+01 volume 0.36849E-02 ppm1 0.805 ppm2 4.276 CV 1
OR { 1229}
( segid " " and resid 420 and name HG2%)
(( segid " " and resid 421 and name HA ))
ASSI { 643}
(( segid " " and resid 425 and name HE3 ))
(( segid " " and resid 425 and name H ))
3.000 3.000 3.000 peak 643 spectrum 1 weight 0.10000E+01 volume 0.15874E-02 ppm1 2.893 ppm2 7.757 CV 1
OR { 643}
(( segid " " and resid 425 and name HE2 ))
(( segid " " and resid 425 and name H ))
OR { 643}
(( segid " " and resid 442 and name HE3 ))
(( segid " " and resid 444 and name H ))
OR { 643}
(( segid " " and resid 442 and name HE3 ))
(( segid " " and resid 395 and name HE21))
OR { 643}
(( segid " " and resid 442 and name HE2 ))
(( segid " " and resid 444 and name H ))
OR { 643}
(( segid " " and resid 442 and name HE2 ))
(( segid " " and resid 395 and name HE21))
ASSI { 939}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 201 and name H ))
4.800 2.900 1.200 peak 939 spectrum 1 weight 0.10000E+01 volume 0.77252E-03 ppm1 0.608 ppm2 7.449 CV 1
OR { 939}
( segid " " and resid 255 and name HD1%)
(( segid " " and resid 257 and name H ))
OR { 939}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 211 and name H ))
OR { 939}
( segid " " and resid 255 and name HD1%)
(( segid " " and resid 254 and name HD21))
ASSI { 470}
( segid " " and resid 352 and name HD1%)
( segid " " and resid 350 and name HG2%)
2.500 0.800 0.800 peak 470 spectrum 1 weight 0.10000E+01 volume 0.96710E-02 ppm1 0.604 ppm2 0.736 CV 1
OR { 470}
( segid " " and resid 352 and name HD1%)
( segid " " and resid 356 and name HG1%)
OR { 470}
( segid " " and resid 352 and name HD1%)
( segid " " and resid 350 and name HG1%)
ASSI { 2625}
( segid " " and resid 264 and name HB% )
(( segid " " and resid 265 and name H ))
3.100 1.200 1.200 peak 2625 spectrum 1 weight 0.10000E+01 volume 0.27434E-02 ppm1 0.959 ppm2 7.767 CV 1
OR { 2625}
( segid " " and resid 236 and name HG2%)
(( segid " " and resid 236 and name H ))
ASSI { 1506}
( segid " " and resid 290 and name HB% )
(( segid " " and resid 302 and name HA ))
5.100 3.200 0.900 peak 1506 spectrum 1 weight 0.10000E+01 volume 0.10094E-02 ppm1 1.533 ppm2 4.300 CV 1
OR { 1506}
( segid " " and resid 290 and name HB% )
(( segid " " and resid 293 and name HA ))
ASSI { 1069}
( segid " " and resid 295 and name HG2%)
(( segid " " and resid 296 and name HB3 ))
3.400 1.500 1.500 peak 1069 spectrum 1 weight 0.10000E+01 volume 0.32283E-02 ppm1 1.184 ppm2 1.985 CV 1
OR { 1069}
( segid " " and resid 295 and name HG2%)
(( segid " " and resid 298 and name HB3 ))
ASSI { 30}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 314 and name HD21))
3.300 3.300 2.700 peak 30 spectrum 1 weight 0.10000E+01 volume 0.73307E-03 ppm1 0.381 ppm2 7.340 CV 1
OR { 30}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 356 and name H ))
OR { 30}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 320 and name HZ2 ))
ASSI { 520}
( segid " " and resid 439 and name HD2%)
(( segid " " and resid 398 and name HA ))
3.000 1.100 1.100 peak 520 spectrum 1 weight 0.10000E+01 volume 0.22810E-02 ppm1 0.893 ppm2 3.371 CV 1
OR { 520}
( segid " " and resid 439 and name HD2%)
(( segid " " and resid 402 and name HA ))
ASSI { 696}
(( segid " " and resid 318 and name HG13))
( segid " " and resid 360 and name HE% )
3.400 1.500 1.500 peak 696 spectrum 1 weight 0.10000E+01 volume 0.11475E-02 ppm1 0.612 ppm2 7.078 CV 1
OR { 696}
(( segid " " and resid 318 and name HG13))
( segid " " and resid 360 and name HD% )
OR { 696}
(( segid " " and resid 318 and name HG13))
( segid " " and resid 315 and name HD% )
ASSI { 2385}
(( segid " " and resid 263 and name HA ))
( segid " " and resid 263 and name HG2%)
3.400 1.400 1.400 peak 2385 spectrum 1 weight 0.10000E+01 volume 0.30338E-02 ppm1 3.166 ppm2 0.797 CV 1
OR { 2385}
(( segid " " and resid 263 and name HA ))
( segid " " and resid 266 and name HD2%)
ASSI { 1097}
(( segid " " and resid 403 and name HA ))
( segid " " and resid 402 and name HG2%)
3.600 1.600 1.600 peak 1097 spectrum 1 weight 0.10000E+01 volume 0.12434E-02 ppm1 4.097 ppm2 0.766 CV 1
OR { 1097}
(( segid " " and resid 406 and name HA ))
( segid " " and resid 409 and name HD2%)
OR { 1097}
(( segid " " and resid 406 and name HA ))
( segid " " and resid 409 and name HD1%)
OR { 1097}
(( segid " " and resid 406 and name HA ))
( segid " " and resid 402 and name HG2%)
ASSI { 1624}
(( segid " " and resid 417 and name HG3 ))
(( segid " " and resid 419 and name H ))
4.500 2.500 1.500 peak 1624 spectrum 1 weight 0.10000E+01 volume 0.13280E-02 ppm1 2.368 ppm2 7.952 CV 1
OR { 1624}
(( segid " " and resid 417 and name HG3 ))
(( segid " " and resid 416 and name H ))
OR { 1624}
(( segid " " and resid 417 and name HG2 ))
(( segid " " and resid 416 and name H ))
OR { 1624}
(( segid " " and resid 417 and name HG2 ))
(( segid " " and resid 419 and name H ))
ASSI { 1}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 231 and name HA ))
3.200 3.200 2.800 peak 1 spectrum 1 weight 0.10000E+01 volume 0.83739E-03 ppm1 0.652 ppm2 3.538 CV 1
OR { 1}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 335 and name HG1 ))
OR { 1}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 348 and name HD2 ))
ASSI { 1649}
(( segid " " and resid 282 and name HG2 ))
(( segid " " and resid 281 and name HG2 ))
3.100 1.200 1.200 peak 1649 spectrum 1 weight 0.10000E+01 volume 0.17396E-02 ppm1 2.393 ppm2 1.405 CV 1
OR { 1649}
(( segid " " and resid 282 and name HG2 ))
(( segid " " and resid 279 and name HB3 ))
OR { 1649}
(( segid " " and resid 282 and name HG2 ))
(( segid " " and resid 306 and name HG ))
OR { 1649}
(( segid " " and resid 282 and name HG2 ))
(( segid " " and resid 279 and name HG ))
OR { 1649}
(( segid " " and resid 282 and name HG2 ))
(( segid " " and resid 310 and name HB2 ))
ASSI { 559}
( segid " " and resid 323 and name HG2%)
( segid " " and resid 368 and name HD% )
3.300 1.300 1.300 peak 559 spectrum 1 weight 0.10000E+01 volume 0.86278E-03 ppm1 0.432 ppm2 7.212 CV 1
OR { 559}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 320 and name HD1 ))
ASSI { 758}
(( segid " " and resid 318 and name HG13))
( segid " " and resid 307 and name HD1%)
3.800 1.800 1.800 peak 758 spectrum 1 weight 0.10000E+01 volume 0.14267E-02 ppm1 0.610 ppm2 1.200 CV 1
OR { 758}
(( segid " " and resid 318 and name HG13))
(( segid " " and resid 278 and name HB2 ))
OR { 758}
(( segid " " and resid 318 and name HG13))
(( segid " " and resid 317 and name HB3 ))
ASSI { 764}
(( segid " " and resid 187 and name HB3 ))
(( segid " " and resid 187 and name HE3 ))
3.600 1.600 1.600 peak 764 spectrum 1 weight 0.10000E+01 volume 0.33693E-02 ppm1 1.675 ppm2 2.891 CV 1
OR { 764}
(( segid " " and resid 421 and name HB3 ))
(( segid " " and resid 421 and name HE3 ))
OR { 764}
(( segid " " and resid 421 and name HB3 ))
(( segid " " and resid 421 and name HE2 ))
OR { 764}
(( segid " " and resid 187 and name HB3 ))
(( segid " " and resid 187 and name HE2 ))
OR { 764}
(( segid " " and resid 421 and name HB2 ))
(( segid " " and resid 421 and name HE2 ))
OR { 764}
(( segid " " and resid 421 and name HB2 ))
(( segid " " and resid 421 and name HE3 ))
ASSI { 325}
( segid " " and resid 279 and name HD1%)
( segid " " and resid 360 and name HE% )
3.300 1.300 1.300 peak 325 spectrum 1 weight 0.10000E+01 volume 0.33552E-02 ppm1 0.169 ppm2 7.069 CV 1
OR { 325}
( segid " " and resid 279 and name HD1%)
( segid " " and resid 360 and name HD% )
OR { 325}
( segid " " and resid 279 and name HD1%)
( segid " " and resid 315 and name HD% )
OR { 325}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 310 and name H ))
ASSI { 555}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 331 and name HG3 ))
2.900 1.000 1.000 peak 555 spectrum 1 weight 0.10000E+01 volume 0.21569E-02 ppm1 1.912 ppm2 1.461 CV 1
OR { 555}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 325 and name HB3 ))
ASSI { 441}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 321 and name HB3 ))
3.200 1.300 1.300 peak 441 spectrum 1 weight 0.10000E+01 volume 0.17932E-02 ppm1 0.170 ppm2 1.594 CV 1
OR { 441}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 210 and name HG3 ))
ASSI { 2470}
(( segid " " and resid 406 and name HA ))
(( segid " " and resid 409 and name HB2 ))
3.100 1.200 1.200 peak 2470 spectrum 1 weight 0.10000E+01 volume 0.14971E-02 ppm1 4.097 ppm2 1.617 CV 1
OR { 2470}
(( segid " " and resid 403 and name HA ))
(( segid " " and resid 403 and name HG2 ))
ASSI { 869}
( segid " " and resid 278 and name HD2%)
(( segid " " and resid 317 and name HB3 ))
2.700 0.900 0.900 peak 869 spectrum 1 weight 0.10000E+01 volume 0.11450E-01 ppm1 0.742 ppm2 1.100 CV 1
OR { 869}
( segid " " and resid 409 and name HD2%)
( segid " " and resid 432 and name HG2%)
OR { 869}
( segid " " and resid 409 and name HD2%)
( segid " " and resid 432 and name HG1%)
OR { 869}
( segid " " and resid 278 and name HD2%)
(( segid " " and resid 271 and name HB3 ))
OR { 869}
( segid " " and resid 278 and name HD2%)
( segid " " and resid 310 and name HD1%)
ASSI { 602}
( segid " " and resid 367 and name HD2%)
(( segid " " and resid 366 and name H ))
3.100 3.100 2.900 peak 602 spectrum 1 weight 0.10000E+01 volume 0.85432E-03 ppm1 0.778 ppm2 8.361 CV 1
OR { 602}
( segid " " and resid 367 and name HD2%)
(( segid " " and resid 365 and name H ))
OR { 602}
( segid " " and resid 367 and name HD2%)
(( segid " " and resid 370 and name H ))
ASSI { 4786}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 210 and name HD2 ))
3.300 1.400 1.400 peak 4786 spectrum 1 weight 0.10000E+01 volume 0.99245E-03 ppm1 0.186 ppm2 3.325 CV 1
OR { 4786}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 320 and name HB3 ))
ASSI { 1074}
(( segid " " and resid 414 and name HB3 ))
(( segid " " and resid 415 and name H ))
2.600 0.800 0.800 peak 1074 spectrum 1 weight 0.10000E+01 volume 0.61662E-02 ppm1 2.045 ppm2 7.993 CV 1
OR { 1074}
(( segid " " and resid 289 and name HB3 ))
(( segid " " and resid 289 and name H ))
OR { 1074}
(( segid " " and resid 288 and name HB3 ))
(( segid " " and resid 289 and name H ))
OR { 1074}
(( segid " " and resid 288 and name HB3 ))
(( segid " " and resid 287 and name H ))
ASSI { 1578}
( segid " " and resid 359 and name HG2%)
(( segid " " and resid 363 and name HD2 ))
3.000 1.200 1.200 peak 1578 spectrum 1 weight 0.10000E+01 volume 0.53374E-02 ppm1 -0.458 ppm2 7.055 CV 1
OR { 1578}
( segid " " and resid 359 and name HG2%)
( segid " " and resid 303 and name HD% )
OR { 1578}
( segid " " and resid 359 and name HG2%)
( segid " " and resid 358 and name HD% )
OR { 1578}
( segid " " and resid 359 and name HG2%)
( segid " " and resid 360 and name HD% )
ASSI { 1022}
( segid " " and resid 317 and name HD2%)
(( segid " " and resid 210 and name HD3 ))
3.500 1.500 1.500 peak 1022 spectrum 1 weight 0.10000E+01 volume 0.10686E-02 ppm1 0.343 ppm2 2.872 CV 1
OR { 1022}
( segid " " and resid 317 and name HD2%)
(( segid " " and resid 320 and name HB2 ))
ASSI { 1364}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 328 and name H ))
2.600 0.800 0.800 peak 1364 spectrum 1 weight 0.10000E+01 volume 0.90872E-02 ppm1 1.914 ppm2 7.216 CV 1
OR { 1364}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 324 and name HE1 ))
OR { 1364}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 331 and name H ))
ASSI { 1601}
(( segid " " and resid 191 and name HA2 ))
(( segid " " and resid 275 and name HD3 ))
4.000 2.000 2.000 peak 1601 spectrum 1 weight 0.10000E+01 volume 0.37780E-03 ppm1 4.127 ppm2 3.079 CV 1
OR { 1601}
(( segid " " and resid 191 and name HA2 ))
(( segid " " and resid 190 and name HB3 ))
ASSI { 679}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 305 and name HD3 ))
2.500 0.800 0.800 peak 679 spectrum 1 weight 0.10000E+01 volume 0.20216E-02 ppm1 0.379 ppm2 3.044 CV 1
OR { 679}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 286 and name HD3 ))
ASSI { 308}
(( segid " " and resid 279 and name HA ))
( segid " " and resid 310 and name HD2%)
2.700 0.900 0.900 peak 308 spectrum 1 weight 0.10000E+01 volume 0.13477E-02 ppm1 4.306 ppm2 1.088 CV 1
OR { 308}
(( segid " " and resid 279 and name HA ))
( segid " " and resid 310 and name HD1%)
OR { 308}
(( segid " " and resid 279 and name HA ))
( segid " " and resid 280 and name HG2%)
ASSI { 374}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 207 and name HB ))
2.200 0.600 0.600 peak 374 spectrum 1 weight 0.10000E+01 volume 0.15837E-01 ppm1 0.884 ppm2 1.609 CV 1
OR { 374}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 374 and name HD2 ))
OR { 374}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 374 and name HB2 ))
OR { 374}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 374 and name HD3 ))
OR { 374}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 316 and name HG ))
ASSI { 709}
(( segid " " and resid 311 and name HD3 ))
(( segid " " and resid 310 and name HB3 ))
4.300 2.300 1.700 peak 709 spectrum 1 weight 0.10000E+01 volume 0.64003E-03 ppm1 3.115 ppm2 2.040 CV 1
OR { 709}
(( segid " " and resid 311 and name HD3 ))
(( segid " " and resid 311 and name HB2 ))
ASSI { 819}
(( segid " " and resid 217 and name HB ))
(( segid " " and resid 218 and name HB2 ))
5.200 3.400 0.800 peak 819 spectrum 1 weight 0.10000E+01 volume 0.31578E-03 ppm1 1.647 ppm2 2.754 CV 1
OR { 819}
(( segid " " and resid 217 and name HB ))
(( segid " " and resid 216 and name HB3 ))
OR { 819}
(( segid " " and resid 217 and name HB ))
(( segid " " and resid 213 and name HB3 ))
OR { 819}
(( segid " " and resid 217 and name HB ))
(( segid " " and resid 216 and name HG ))
ASSI { 60}
(( segid " " and resid 217 and name HA ))
( segid " " and resid 328 and name HG2%)
4.600 2.600 1.400 peak 60 spectrum 1 weight 0.10000E+01 volume 0.62311E-03 ppm1 2.981 ppm2 0.813 CV 1
OR { 60}
(( segid " " and resid 217 and name HA ))
( segid " " and resid 263 and name HG2%)
OR { 60}
(( segid " " and resid 217 and name HA ))
( segid " " and resid 328 and name HG1%)
OR { 60}
(( segid " " and resid 217 and name HA ))
( segid " " and resid 255 and name HD2%)
OR { 60}
(( segid " " and resid 217 and name HA ))
(( segid " " and resid 230 and name HG12))
OR { 60}
(( segid " " and resid 217 and name HA ))
( segid " " and resid 323 and name HG1%)
OR { 60}
(( segid " " and resid 217 and name HA ))
(( segid " " and resid 222 and name HB3 ))
OR { 60}
(( segid " " and resid 217 and name HA ))
( segid " " and resid 271 and name HD1%)
ASSI { 1365}
( segid " " and resid 300 and name HG2%)
(( segid " " and resid 363 and name HB3 ))
5.100 3.200 0.900 peak 1365 spectrum 1 weight 0.10000E+01 volume 0.89377E-03 ppm1 0.540 ppm2 2.619 CV 1
OR { 1365}
( segid " " and resid 300 and name HG2%)
(( segid " " and resid 303 and name HB3 ))
ASSI { 634}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 360 and name HB3 ))
2.900 1.100 1.100 peak 634 spectrum 1 weight 0.10000E+01 volume 0.13054E-02 ppm1 -0.167 ppm2 3.089 CV 1
OR { 634}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 361 and name HB2 ))
ASSI { 1527}
( segid " " and resid 380 and name HD2%)
(( segid " " and resid 381 and name H ))
3.300 1.400 1.400 peak 1527 spectrum 1 weight 0.10000E+01 volume 0.51710E-02 ppm1 0.774 ppm2 8.190 CV 1
OR { 1527}
( segid " " and resid 323 and name HG1%)
(( segid " " and resid 373 and name H ))
OR { 1527}
( segid " " and resid 323 and name HG1%)
(( segid " " and resid 322 and name H ))
ASSI { 1098}
(( segid " " and resid 184 and name HD3 ))
(( segid " " and resid 184 and name HG2 ))
1.900 0.500 0.500 peak 1098 spectrum 1 weight 0.10000E+01 volume 0.27851E-01 ppm1 3.614 ppm2 1.945 CV 1
OR { 1098}
(( segid " " and resid 184 and name HD3 ))
(( segid " " and resid 184 and name HG3 ))
OR { 1098}
(( segid " " and resid 379 and name HD2 ))
(( segid " " and resid 379 and name HB2 ))
OR { 1098}
(( segid " " and resid 184 and name HD3 ))
(( segid " " and resid 183 and name HB2 ))
ASSI { 140}
(( segid " " and resid 243 and name HB2 ))
(( segid " " and resid 243 and name HB3 ))
2.400 0.700 0.700 peak 140 spectrum 1 weight 0.10000E+01 volume 0.68230E-03 ppm1 1.755 ppm2 1.204 CV 1
OR { 140}
(( segid " " and resid 243 and name HB2 ))
( segid " " and resid 246 and name HB% )
ASSI { 333}
( segid " " and resid 303 and name HE% )
( segid " " and resid 359 and name HG1%)
3.600 1.600 1.600 peak 333 spectrum 1 weight 0.10000E+01 volume 0.13900E-02 ppm1 6.801 ppm2 0.911 CV 1
OR { 333}
( segid " " and resid 303 and name HE% )
( segid " " and resid 352 and name HG2%)
ASSI { 422}
( segid " " and resid 255 and name HD2%)
( segid " " and resid 212 and name HG2%)
2.200 2.200 3.800 peak 422 spectrum 1 weight 0.10000E+01 volume 0.27434E-02 ppm1 0.792 ppm2 -0.169 CV 1
OR { 422}
( segid " " and resid 274 and name HD2%)
( segid " " and resid 212 and name HG2%)
ASSI { 1318}
( segid " " and resid 278 and name HD2%)
(( segid " " and resid 350 and name HA ))
4.500 2.500 1.500 peak 1318 spectrum 1 weight 0.10000E+01 volume 0.60337E-03 ppm1 0.749 ppm2 4.503 CV 1
OR { 1318}
( segid " " and resid 278 and name HD2%)
(( segid " " and resid 277 and name HA ))
ASSI { 813}
( segid " " and resid 284 and name HE% )
( segid " " and resid 350 and name HG2%)
3.200 1.300 1.300 peak 813 spectrum 1 weight 0.10000E+01 volume 0.69669E-02 ppm1 2.151 ppm2 0.785 CV 1
OR { 813}
( segid " " and resid 284 and name HE% )
( segid " " and resid 356 and name HG1%)
ASSI { 811}
( segid " " and resid 303 and name HE% )
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4.800 2.900 1.200 peak 811 spectrum 1 weight 0.10000E+01 volume 0.62875E-03 ppm1 6.798 ppm2 0.673 CV 1
OR { 811}
( segid " " and resid 303 and name HE% )
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OR { 811}
( segid " " and resid 303 and name HE% )
( segid " " and resid 350 and name HG2%)
ASSI { 224}
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( segid " " and resid 339 and name HG2%)
4.000 2.000 2.000 peak 224 spectrum 1 weight 0.10000E+01 volume 0.96146E-03 ppm1 2.537 ppm2 0.672 CV 1
OR { 224}
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( segid " " and resid 357 and name HD1%)
ASSI { 2602}
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4.500 2.500 1.500 peak 2602 spectrum 1 weight 0.10000E+01 volume 0.63439E-03 ppm1 4.128 ppm2 6.413 CV 1
OR { 2602}
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( segid " " and resid 219 and name HE% )
ASSI { 337}
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(( segid " " and resid 437 and name H ))
4.400 2.400 1.600 peak 337 spectrum 1 weight 0.10000E+01 volume 0.11842E-02 ppm1 1.601 ppm2 8.208 CV 1
OR { 337}
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(( segid " " and resid 391 and name H ))
ASSI { 771}
( segid " " and resid 437 and name HG2%)
( segid " " and resid 438 and name HB% )
3.400 1.400 1.400 peak 771 spectrum 1 weight 0.10000E+01 volume 0.56698E-02 ppm1 1.186 ppm2 1.588 CV 1
OR { 771}
( segid " " and resid 437 and name HG2%)
(( segid " " and resid 436 and name HG ))
OR { 771}
( segid " " and resid 437 and name HG2%)
(( segid " " and resid 440 and name HD2 ))
ASSI { 967}
(( segid " " and resid 225 and name HG2 ))
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5.400 3.600 0.600 peak 967 spectrum 1 weight 0.10000E+01 volume 0.43139E-03 ppm1 2.804 ppm2 1.645 CV 1
OR { 967}
(( segid " " and resid 225 and name HG2 ))
(( segid " " and resid 331 and name HD2 ))
OR { 967}
(( segid " " and resid 225 and name HG2 ))
(( segid " " and resid 226 and name HD2 ))
ASSI { 250}
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(( segid " " and resid 310 and name H ))
3.700 1.700 1.700 peak 250 spectrum 1 weight 0.10000E+01 volume 0.34680E-03 ppm1 1.387 ppm2 7.039 CV 1
OR { 250}
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( segid " " and resid 315 and name HD% )
ASSI { 2416}
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(( segid " " and resid 208 and name HD3 ))
2.800 1.000 1.000 peak 2416 spectrum 1 weight 0.10000E+01 volume 0.20808E-02 ppm1 0.744 ppm2 2.915 CV 1
OR { 2416}
(( segid " " and resid 208 and name HG2 ))
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OR { 2416}
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(( segid " " and resid 210 and name HD3 ))
ASSI { 882}
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3.200 1.300 1.300 peak 882 spectrum 1 weight 0.10000E+01 volume 0.28392E-02 ppm1 0.743 ppm2 3.998 CV 1
OR { 882}
( segid " " and resid 409 and name HD2%)
(( segid " " and resid 408 and name HA ))
ASSI { 238}
(( segid " " and resid 252 and name HB2 ))
(( segid " " and resid 253 and name HA ))
4.100 2.100 1.900 peak 238 spectrum 1 weight 0.10000E+01 volume 0.12321E-02 ppm1 3.739 ppm2 4.201 CV 1
OR { 238}
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(( segid " " and resid 251 and name HA ))
ASSI { 1070}
(( segid " " and resid 253 and name HB ))
(( segid " " and resid 255 and name HG ))
4.700 2.700 1.300 peak 1070 spectrum 1 weight 0.10000E+01 volume 0.63721E-03 ppm1 3.520 ppm2 1.710 CV 1
OR { 1070}
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(( segid " " and resid 255 and name HB2 ))
OR { 1070}
(( segid " " and resid 253 and name HB ))
(( segid " " and resid 239 and name HD2 ))
OR { 1070}
(( segid " " and resid 253 and name HB ))
(( segid " " and resid 239 and name HD3 ))
ASSI { 4696}
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2.700 0.900 0.900 peak 4696 spectrum 1 weight 0.10000E+01 volume 0.11729E-02 ppm1 -0.193 ppm2 2.917 CV 1
OR { 4696}
( segid " " and resid 373 and name HD1%)
(( segid " " and resid 320 and name HB2 ))
ASSI { 407}
(( segid " " and resid 300 and name HA ))
(( segid " " and resid 304 and name HG3 ))
4.500 2.500 1.500 peak 407 spectrum 1 weight 0.10000E+01 volume 0.76128E-03 ppm1 2.895 ppm2 2.278 CV 1
OR { 407}
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(( segid " " and resid 202 and name HG2 ))
OR { 407}
(( segid " " and resid 198 and name HA ))
(( segid " " and resid 199 and name HG2 ))
OR { 407}
(( segid " " and resid 198 and name HA ))
(( segid " " and resid 199 and name HG3 ))
OR { 407}
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(( segid " " and resid 304 and name HB2 ))
OR { 407}
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(( segid " " and resid 366 and name HG2 ))
OR { 407}
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(( segid " " and resid 202 and name HB3 ))
OR { 407}
(( segid " " and resid 300 and name HA ))
(( segid " " and resid 366 and name HG3 ))
OR { 407}
(( segid " " and resid 300 and name HA ))
(( segid " " and resid 301 and name HG3 ))
OR { 407}
(( segid " " and resid 300 and name HA ))
(( segid " " and resid 302 and name HG2 ))
OR { 407}
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( segid " " and resid 203 and name HE% )
ASSI { 485}
( segid " " and resid 364 and name HG2%)
(( segid " " and resid 323 and name H ))
2.900 1.000 1.000 peak 485 spectrum 1 weight 0.10000E+01 volume 0.18806E-02 ppm1 0.909 ppm2 7.759 CV 1
OR { 485}
( segid " " and resid 364 and name HG2%)
(( segid " " and resid 369 and name H ))
ASSI { 1341}
( segid " " and resid 364 and name HG2%)
( segid " " and resid 279 and name HD1%)
3.800 1.800 1.800 peak 1341 spectrum 1 weight 0.10000E+01 volume 0.68230E-03 ppm1 0.908 ppm2 0.111 CV 1
OR { 1341}
( segid " " and resid 364 and name HG2%)
( segid " " and resid 300 and name HG1%)
ASSI { 2110}
( segid " " and resid 361 and name HE% )
(( segid " " and resid 357 and name HB2 ))
3.800 1.800 1.800 peak 2110 spectrum 1 weight 0.10000E+01 volume 0.46520E-03 ppm1 7.081 ppm2 2.082 CV 1
OR { 2110}
( segid " " and resid 360 and name HD% )
(( segid " " and resid 364 and name HB ))
OR { 2110}
( segid " " and resid 360 and name HD% )
(( segid " " and resid 357 and name HB2 ))
ASSI { 1548}
(( segid " " and resid 443 and name HB2 ))
(( segid " " and resid 440 and name HA ))
3.100 1.200 1.200 peak 1548 spectrum 1 weight 0.10000E+01 volume 0.10150E-02 ppm1 1.657 ppm2 3.750 CV 1
OR { 1548}
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(( segid " " and resid 440 and name HA ))
OR { 1548}
(( segid " " and resid 443 and name HB2 ))
(( segid " " and resid 399 and name HA ))
OR { 1548}
(( segid " " and resid 443 and name HB3 ))
(( segid " " and resid 399 and name HA ))
OR { 1548}
(( segid " " and resid 443 and name HB2 ))
(( segid " " and resid 395 and name HA ))
ASSI { 1553}
(( segid " " and resid 254 and name HB3 ))
(( segid " " and resid 254 and name HD21))
3.000 1.100 1.100 peak 1553 spectrum 1 weight 0.10000E+01 volume 0.19172E-02 ppm1 2.944 ppm2 7.466 CV 1
OR { 1553}
(( segid " " and resid 254 and name HB3 ))
(( segid " " and resid 257 and name H ))
ASSI { 81}
( segid " " and resid 212 and name HG1%)
(( segid " " and resid 213 and name HB3 ))
4.600 2.700 1.400 peak 81 spectrum 1 weight 0.10000E+01 volume 0.82329E-03 ppm1 -0.344 ppm2 2.758 CV 1
OR { 81}
( segid " " and resid 212 and name HG1%)
(( segid " " and resid 216 and name HB3 ))
ASSI { 1403}
( segid " " and resid 231 and name HE% )
( segid " " and resid 264 and name HB% )
3.600 1.700 1.700 peak 1403 spectrum 1 weight 0.10000E+01 volume 0.92761E-03 ppm1 6.778 ppm2 0.919 CV 1
OR { 1403}
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(( segid " " and resid 230 and name HG13))
OR { 1403}
( segid " " and resid 231 and name HE% )
( segid " " and resid 230 and name HG2%)
OR { 1403}
( segid " " and resid 231 and name HE% )
( segid " " and resid 325 and name HE% )
OR { 1403}
( segid " " and resid 231 and name HE% )
( segid " " and resid 267 and name HD2%)
ASSI { 3083}
(( segid " " and resid 213 and name HZ ))
(( segid " " and resid 324 and name H ))
5.100 3.200 0.900 peak 3083 spectrum 1 weight 0.10000E+01 volume 0.31296E-03 ppm1 6.335 ppm2 8.493 CV 1
OR { 3083}
(( segid " " and resid 213 and name HZ ))
(( segid " " and resid 325 and name H ))
ASSI { 1078}
(( segid " " and resid 198 and name HB ))
(( segid " " and resid 195 and name HA ))
3.500 1.500 1.500 peak 1078 spectrum 1 weight 0.10000E+01 volume 0.12970E-02 ppm1 2.041 ppm2 3.913 CV 1
OR { 1078}
(( segid " " and resid 198 and name HB ))
(( segid " " and resid 208 and name HA ))
OR { 1078}
(( segid " " and resid 198 and name HB ))
(( segid " " and resid 197 and name HA ))
ASSI { 960}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 331 and name H ))
4.100 2.200 1.900 peak 960 spectrum 1 weight 0.10000E+01 volume 0.17283E-02 ppm1 0.748 ppm2 7.167 CV 1
OR { 960}
( segid " " and resid 329 and name HG2%)
( segid " " and resid 361 and name HD% )
OR { 960}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 328 and name H ))
ASSI { 532}
(( segid " " and resid 432 and name HB ))
(( segid " " and resid 433 and name H ))
3.100 1.200 1.200 peak 532 spectrum 1 weight 0.10000E+01 volume 0.29605E-02 ppm1 2.123 ppm2 8.344 CV 1
OR { 532}
(( segid " " and resid 364 and name HB ))
(( segid " " and resid 365 and name H ))
OR { 532}
(( segid " " and resid 364 and name HB ))
(( segid " " and resid 361 and name H ))
OR { 532}
(( segid " " and resid 364 and name HB ))
(( segid " " and resid 366 and name H ))
ASSI { 320}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 284 and name H ))
3.900 1.900 1.900 peak 320 spectrum 1 weight 0.10000E+01 volume 0.30338E-02 ppm1 0.903 ppm2 8.052 CV 1
OR { 320}
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(( segid " " and resid 267 and name H ))
OR { 320}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 306 and name H ))
ASSI { 33}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 210 and name HG2 ))
4.000 2.000 2.000 peak 33 spectrum 1 weight 0.10000E+01 volume 0.19201E-02 ppm1 1.456 ppm2 1.700 CV 1
OR { 33}
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(( segid " " and resid 193 and name HB3 ))
OR { 33}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 189 and name HG13))
OR { 33}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 200 and name HG2 ))
OR { 33}
( segid " " and resid 197 and name HB% )
( segid " " and resid 211 and name HB% )
ASSI { 899}
( segid " " and resid 266 and name HD2%)
( segid " " and resid 190 and name HD% )
3.600 1.600 1.600 peak 899 spectrum 1 weight 0.10000E+01 volume 0.21315E-02 ppm1 0.822 ppm2 7.830 CV 1
OR { 899}
( segid " " and resid 316 and name HD1%)
(( segid " " and resid 319 and name H ))
OR { 899}
( segid " " and resid 266 and name HD2%)
(( segid " " and resid 268 and name H ))
ASSI { 1292}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 278 and name HA ))
4.400 2.400 1.600 peak 1292 spectrum 1 weight 0.10000E+01 volume 0.77534E-03 ppm1 0.169 ppm2 3.814 CV 1
OR { 1292}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 315 and name HA ))
OR { 1292}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 303 and name HA ))
OR { 1292}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 314 and name HA ))
ASSI { 1409}
( segid " " and resid 243 and name HD2%)
(( segid " " and resid 253 and name H ))
5.300 3.500 0.700 peak 1409 spectrum 1 weight 0.10000E+01 volume 0.42575E-03 ppm1 0.170 ppm2 8.233 CV 1
OR { 1409}
( segid " " and resid 243 and name HD2%)
(( segid " " and resid 266 and name H ))
OR { 1409}
( segid " " and resid 243 and name HD2%)
(( segid " " and resid 256 and name H ))
ASSI { 522}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 322 and name HG12))
2.100 0.500 0.500 peak 522 spectrum 1 weight 0.10000E+01 volume 0.10088E-01 ppm1 0.380 ppm2 1.363 CV 1
OR { 522}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 318 and name HB ))
OR { 522}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 322 and name HB ))
ASSI { 127}
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(( segid " " and resid 187 and name H ))
2.900 1.100 1.100 peak 127 spectrum 1 weight 0.10000E+01 volume 0.29661E-02 ppm1 1.334 ppm2 8.506 CV 1
OR { 127}
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(( segid " " and resid 375 and name H ))
ASSI { 1125}
( segid " " and resid 315 and name HD% )
(( segid " " and resid 310 and name HB2 ))
3.800 1.800 1.800 peak 1125 spectrum 1 weight 0.10000E+01 volume 0.47366E-03 ppm1 7.028 ppm2 1.371 CV 1
OR { 1125}
( segid " " and resid 315 and name HD% )
(( segid " " and resid 318 and name HB ))
OR { 1125}
( segid " " and resid 315 and name HD% )
(( segid " " and resid 317 and name HB2 ))
OR { 1125}
( segid " " and resid 315 and name HD% )
(( segid " " and resid 322 and name HB ))
ASSI { 1458}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 320 and name HH2 ))
2.800 1.000 1.000 peak 1458 spectrum 1 weight 0.10000E+01 volume 0.24135E-02 ppm1 0.886 ppm2 7.159 CV 1
OR { 1458}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 214 and name H ))
ASSI { 1094}
( segid " " and resid 283 and name HD1%)
(( segid " " and resid 283 and name HB2 ))
2.900 1.100 1.100 peak 1094 spectrum 1 weight 0.10000E+01 volume 0.67046E-02 ppm1 0.717 ppm2 2.315 CV 1
OR { 1094}
( segid " " and resid 283 and name HD1%)
(( segid " " and resid 309 and name HG2 ))
ASSI { 213}
( segid " " and resid 356 and name HG2%)
( segid " " and resid 352 and name HG2%)
2.400 0.700 0.700 peak 213 spectrum 1 weight 0.10000E+01 volume 0.70064E-02 ppm1 0.382 ppm2 0.903 CV 1
OR { 213}
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(( segid " " and resid 306 and name HB2 ))
OR { 213}
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( segid " " and resid 359 and name HG1%)
OR { 213}
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( segid " " and resid 283 and name HD2%)
ASSI { 1392}
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(( segid " " and resid 415 and name HB3 ))
3.900 1.900 1.900 peak 1392 spectrum 1 weight 0.10000E+01 volume 0.22330E-02 ppm1 0.853 ppm2 2.634 CV 1
OR { 1392}
( segid " " and resid 416 and name HD1%)
(( segid " " and resid 422 and name HB3 ))
ASSI { 176}
(( segid " " and resid 399 and name HA ))
(( segid " " and resid 399 and name HB2 ))
2.700 0.900 0.900 peak 176 spectrum 1 weight 0.10000E+01 volume 0.31099E-02 ppm1 3.764 ppm2 1.891 CV 1
OR { 176}
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(( segid " " and resid 402 and name HB ))
OR { 176}
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(( segid " " and resid 302 and name HB2 ))
OR { 176}
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(( segid " " and resid 439 and name HB3 ))
OR { 176}
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(( segid " " and resid 298 and name HB2 ))
OR { 176}
(( segid " " and resid 299 and name HA ))
(( segid " " and resid 301 and name HB3 ))
OR { 176}
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(( segid " " and resid 439 and name HG ))
OR { 176}
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(( segid " " and resid 400 and name HB3 ))
OR { 176}
(( segid " " and resid 399 and name HA ))
(( segid " " and resid 400 and name HB2 ))
ASSI { 1401}
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( segid " " and resid 263 and name HG2%)
4.100 2.100 1.900 peak 1401 spectrum 1 weight 0.10000E+01 volume 0.62593E-03 ppm1 3.171 ppm2 0.807 CV 1
OR { 1401}
(( segid " " and resid 219 and name HB3 ))
( segid " " and resid 263 and name HG2%)
OR { 1401}
(( segid " " and resid 219 and name HB3 ))
( segid " " and resid 255 and name HD2%)
OR { 1401}
(( segid " " and resid 219 and name HB2 ))
( segid " " and resid 255 and name HD2%)
OR { 1401}
(( segid " " and resid 315 and name HB2 ))
( segid " " and resid 316 and name HD1%)
OR { 1401}
(( segid " " and resid 219 and name HB2 ))
(( segid " " and resid 222 and name HB3 ))
ASSI { 1291}
(( segid " " and resid 289 and name HB2 ))
(( segid " " and resid 289 and name H ))
2.400 0.700 0.700 peak 1291 spectrum 1 weight 0.10000E+01 volume 0.72602E-02 ppm1 1.979 ppm2 7.993 CV 1
OR { 1291}
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(( segid " " and resid 289 and name H ))
OR { 1291}
(( segid " " and resid 288 and name HB2 ))
(( segid " " and resid 287 and name H ))
ASSI { 1653}
(( segid " " and resid 217 and name HG13))
( segid " " and resid 267 and name HD1%)
4.100 2.100 1.900 peak 1653 spectrum 1 weight 0.10000E+01 volume 0.13618E-02 ppm1 0.471 ppm2 0.905 CV 1
OR { 1653}
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( segid " " and resid 325 and name HE% )
OR { 1653}
(( segid " " and resid 217 and name HG13))
( segid " " and resid 267 and name HD2%)
OR { 1653}
(( segid " " and resid 217 and name HG13))
( segid " " and resid 321 and name HD1%)
ASSI { 855}
(( segid " " and resid 268 and name HG2 ))
(( segid " " and resid 270 and name H ))
3.400 1.400 1.400 peak 855 spectrum 1 weight 0.10000E+01 volume 0.18580E-02 ppm1 1.254 ppm2 8.501 CV 1
OR { 855}
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(( segid " " and resid 270 and name H ))
OR { 855}
(( segid " " and resid 268 and name HG2 ))
(( segid " " and resid 272 and name H ))
OR { 855}
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(( segid " " and resid 272 and name H ))
ASSI { 67}
( segid " " and resid 329 and name HD1%)
( segid " " and resid 345 and name HG2%)
4.600 2.700 1.400 peak 67 spectrum 1 weight 0.10000E+01 volume 0.11504E-02 ppm1 0.116 ppm2 0.890 CV 1
OR { 67}
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( segid " " and resid 346 and name HD1%)
OR { 67}
( segid " " and resid 329 and name HD1%)
( segid " " and resid 230 and name HG2%)
OR { 67}
( segid " " and resid 329 and name HD1%)
( segid " " and resid 325 and name HE% )
OR { 67}
( segid " " and resid 329 and name HD1%)
( segid " " and resid 333 and name HD2%)
OR { 67}
( segid " " and resid 329 and name HD1%)
( segid " " and resid 333 and name HD1%)
ASSI { 3267}
( segid " " and resid 391 and name HD2%)
(( segid " " and resid 391 and name HG ))
2.200 0.600 0.600 peak 3267 spectrum 1 weight 0.10000E+01 volume 0.89461E-02 ppm1 0.531 ppm2 1.627 CV 1
OR { 3267}
( segid " " and resid 391 and name HD2%)
( segid " " and resid 438 and name HB% )
ASSI { 1245}
(( segid " " and resid 264 and name HA ))
(( segid " " and resid 265 and name H ))
3.900 1.900 1.900 peak 1245 spectrum 1 weight 0.10000E+01 volume 0.65413E-03 ppm1 3.900 ppm2 7.765 CV 1
OR { 1245}
(( segid " " and resid 195 and name HA ))
(( segid " " and resid 199 and name H ))
OR { 1245}
(( segid " " and resid 197 and name HA ))
(( segid " " and resid 199 and name H ))
ASSI { 1459}
( segid " " and resid 189 and name HG2%)
( segid " " and resid 201 and name HG2%)
3.100 1.200 1.200 peak 1459 spectrum 1 weight 0.10000E+01 volume 0.31804E-02 ppm1 0.937 ppm2 1.300 CV 1
OR { 1459}
( segid " " and resid 189 and name HG2%)
(( segid " " and resid 192 and name HG12))
ASSI { 1739}
( segid " " and resid 329 and name HD1%)
(( segid " " and resid 343 and name H ))
5.100 3.300 0.900 peak 1739 spectrum 1 weight 0.10000E+01 volume 0.43985E-03 ppm1 0.115 ppm2 8.173 CV 1
OR { 1739}
( segid " " and resid 329 and name HD1%)
(( segid " " and resid 340 and name H ))
ASSI { 846}
(( segid " " and resid 311 and name HD3 ))
( segid " " and resid 310 and name HD2%)
4.100 2.100 1.900 peak 846 spectrum 1 weight 0.10000E+01 volume 0.98117E-03 ppm1 3.103 ppm2 1.109 CV 1
OR { 846}
(( segid " " and resid 311 and name HD3 ))
( segid " " and resid 280 and name HG2%)
OR { 846}
(( segid " " and resid 311 and name HD3 ))
( segid " " and resid 310 and name HD1%)
ASSI { 617}
( segid " " and resid 359 and name HG2%)
(( segid " " and resid 291 and name HA ))
3.700 1.700 1.700 peak 617 spectrum 1 weight 0.10000E+01 volume 0.82893E-03 ppm1 -0.460 ppm2 3.982 CV 1
OR { 617}
( segid " " and resid 359 and name HG2%)
(( segid " " and resid 358 and name HA ))
ASSI { 689}
( segid " " and resid 315 and name HD% )
(( segid " " and resid 310 and name HG ))
2.800 2.800 3.200 peak 689 spectrum 1 weight 0.10000E+01 volume 0.84021E-03 ppm1 7.032 ppm2 2.155 CV 1
OR { 689}
( segid " " and resid 315 and name HD% )
(( segid " " and resid 312 and name HB2 ))
OR { 689}
( segid " " and resid 315 and name HD% )
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ASSI { 793}
(( segid " " and resid 322 and name HA ))
( segid " " and resid 346 and name HD2%)
4.500 2.500 1.500 peak 793 spectrum 1 weight 0.10000E+01 volume 0.54699E-03 ppm1 3.379 ppm2 0.746 CV 1
OR { 793}
(( segid " " and resid 322 and name HA ))
( segid " " and resid 350 and name HG1%)
OR { 793}
(( segid " " and resid 322 and name HA ))
( segid " " and resid 323 and name HG1%)
OR { 793}
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( segid " " and resid 328 and name HG2%)
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(( segid " " and resid 322 and name HA ))
( segid " " and resid 339 and name HG2%)
OR { 793}
(( segid " " and resid 322 and name HA ))
( segid " " and resid 356 and name HG1%)
ASSI { 1276}
(( segid " " and resid 281 and name HG2 ))
(( segid " " and resid 282 and name HG3 ))
3.400 1.400 1.400 peak 1276 spectrum 1 weight 0.10000E+01 volume 0.53007E-02 ppm1 1.405 ppm2 2.182 CV 1
OR { 1276}
(( segid " " and resid 281 and name HG2 ))
(( segid " " and resid 284 and name HB2 ))
OR { 1276}
(( segid " " and resid 281 and name HG2 ))
(( segid " " and resid 276 and name HG3 ))
OR { 1276}
(( segid " " and resid 281 and name HG2 ))
( segid " " and resid 284 and name HE% )
OR { 1276}
(( segid " " and resid 281 and name HG2 ))
(( segid " " and resid 284 and name HB3 ))
OR { 1276}
(( segid " " and resid 281 and name HG3 ))
(( segid " " and resid 282 and name HG3 ))
OR { 1276}
(( segid " " and resid 281 and name HG3 ))
(( segid " " and resid 284 and name HB3 ))
OR { 1276}
(( segid " " and resid 281 and name HG3 ))
(( segid " " and resid 284 and name HB2 ))
OR { 1276}
(( segid " " and resid 281 and name HG3 ))
( segid " " and resid 284 and name HE% )
ASSI { 723}
( segid " " and resid 364 and name HG1%)
( segid " " and resid 361 and name HD% )
2.700 0.900 0.900 peak 723 spectrum 1 weight 0.10000E+01 volume 0.65949E-02 ppm1 1.057 ppm2 7.140 CV 1
OR { 723}
( segid " " and resid 364 and name HG1%)
( segid " " and resid 368 and name HD% )
ASSI { 625}
( segid " " and resid 240 and name HG2%)
(( segid " " and resid 244 and name H ))
4.300 2.300 1.700 peak 625 spectrum 1 weight 0.10000E+01 volume 0.13844E-02 ppm1 0.769 ppm2 8.534 CV 1
OR { 625}
( segid " " and resid 240 and name HG2%)
(( segid " " and resid 264 and name H ))
OR { 625}
( segid " " and resid 240 and name HG2%)
(( segid " " and resid 270 and name H ))
ASSI { 1637}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 324 and name HD2 ))
3.100 1.200 1.200 peak 1637 spectrum 1 weight 0.10000E+01 volume 0.26024E-02 ppm1 0.463 ppm2 7.169 CV 1
OR { 1637}
( segid " " and resid 217 and name HG2%)
( segid " " and resid 213 and name HE% )
OR { 1637}
( segid " " and resid 207 and name HG2%)
(( segid " " and resid 320 and name HH2 ))
OR { 1637}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 214 and name H ))
ASSI { 379}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 357 and name HG ))
3.500 1.500 1.500 peak 379 spectrum 1 weight 0.10000E+01 volume 0.31240E-02 ppm1 0.729 ppm2 1.744 CV 1
OR { 379}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 352 and name HG12))
OR { 379}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 346 and name HG ))
OR { 379}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 346 and name HB2 ))
OR { 379}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 357 and name HB3 ))
ASSI { 763}
( segid " " and resid 436 and name HD1%)
(( segid " " and resid 436 and name HB2 ))
2.500 0.800 0.800 peak 763 spectrum 1 weight 0.10000E+01 volume 0.47705E-02 ppm1 1.014 ppm2 1.401 CV 1
OR { 763}
( segid " " and resid 436 and name HD1%)
(( segid " " and resid 440 and name HG2 ))
OR { 763}
( segid " " and resid 436 and name HD1%)
(( segid " " and resid 440 and name HG3 ))
ASSI { 879}
(( segid " " and resid 279 and name HB2 ))
( segid " " and resid 279 and name HD2%)
3.200 1.300 1.300 peak 879 spectrum 1 weight 0.10000E+01 volume 0.54981E-03 ppm1 1.590 ppm2 0.376 CV 1
OR { 879}
(( segid " " and resid 279 and name HB2 ))
( segid " " and resid 318 and name HD1%)
OR { 879}
(( segid " " and resid 279 and name HB2 ))
( segid " " and resid 306 and name HD1%)
ASSI { 468}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 331 and name HG2 ))
2.900 1.100 1.100 peak 468 spectrum 1 weight 0.10000E+01 volume 0.46464E-02 ppm1 1.914 ppm2 1.539 CV 1
OR { 468}
( segid " " and resid 225 and name HE% )
( segid " " and resid 330 and name HB% )
ASSI { 1150}
( segid " " and resid 278 and name HD2%)
(( segid " " and resid 317 and name H ))
4.500 2.500 1.500 peak 1150 spectrum 1 weight 0.10000E+01 volume 0.16212E-02 ppm1 0.747 ppm2 7.506 CV 1
OR { 1150}
( segid " " and resid 409 and name HD2%)
(( segid " " and resid 408 and name H ))
OR { 1150}
( segid " " and resid 409 and name HD2%)
(( segid " " and resid 410 and name HD22))
ASSI { 3253}
(( segid " " and resid 305 and name HB2 ))
(( segid " " and resid 305 and name HD2 ))
2.500 0.800 0.800 peak 3253 spectrum 1 weight 0.10000E+01 volume 0.69415E-02 ppm1 1.856 ppm2 3.144 CV 1
OR { 3253}
(( segid " " and resid 305 and name HB3 ))
(( segid " " and resid 305 and name HD2 ))
OR { 3253}
(( segid " " and resid 444 and name HB2 ))
(( segid " " and resid 444 and name HD2 ))
OR { 3253}
(( segid " " and resid 444 and name HB2 ))
(( segid " " and resid 444 and name HD3 ))
ASSI { 765}
( segid " " and resid 439 and name HD1%)
(( segid " " and resid 442 and name H ))
2.900 2.900 3.100 peak 765 spectrum 1 weight 0.10000E+01 volume 0.52725E-03 ppm1 0.819 ppm2 7.570 CV 1
OR { 765}
( segid " " and resid 439 and name HD1%)
(( segid " " and resid 438 and name H ))
OR { 765}
( segid " " and resid 439 and name HD1%)
(( segid " " and resid 441 and name H ))
OR { 765}
( segid " " and resid 439 and name HD1%)
(( segid " " and resid 403 and name H ))
OR { 765}
( segid " " and resid 439 and name HD1%)
(( segid " " and resid 394 and name H ))
ASSI { 3534}
(( segid " " and resid 400 and name HG2 ))
(( segid " " and resid 400 and name HA ))
2.400 0.700 0.700 peak 3534 spectrum 1 weight 0.10000E+01 volume 0.10723E-01 ppm1 2.345 ppm2 3.914 CV 1
OR { 3534}
(( segid " " and resid 289 and name HG2 ))
(( segid " " and resid 289 and name HA ))
ASSI { 471}
( segid " " and resid 358 and name HE% )
(( segid " " and resid 339 and name H ))
4.400 2.400 1.600 peak 471 spectrum 1 weight 0.10000E+01 volume 0.34398E-03 ppm1 6.703 ppm2 8.366 CV 1
OR { 471}
( segid " " and resid 358 and name HE% )
(( segid " " and resid 361 and name H ))
OR { 471}
( segid " " and resid 358 and name HE% )
(( segid " " and resid 365 and name H ))
ASSI { 437}
(( segid " " and resid 209 and name HG ))
( segid " " and resid 209 and name HD1%)
2.600 0.800 0.800 peak 437 spectrum 1 weight 0.10000E+01 volume 0.32424E-02 ppm1 0.749 ppm2 0.177 CV 1
OR { 437}
( segid " " and resid 316 and name HD2%)
( segid " " and resid 209 and name HD1%)
ASSI { 1073}
(( segid " " and resid 430 and name HD1 ))
(( segid " " and resid 433 and name HB2 ))
4.800 2.900 1.200 peak 1073 spectrum 1 weight 0.10000E+01 volume 0.43985E-03 ppm1 7.189 ppm2 1.972 CV 1
OR { 1073}
(( segid " " and resid 430 and name HD1 ))
(( segid " " and resid 427 and name HB3 ))
ASSI { 50}
(( segid " " and resid 297 and name HB ))
(( segid " " and resid 298 and name HB3 ))
4.500 2.500 1.500 peak 50 spectrum 1 weight 0.10000E+01 volume 0.12716E-02 ppm1 3.941 ppm2 1.986 CV 1
OR { 50}
(( segid " " and resid 297 and name HB ))
(( segid " " and resid 296 and name HB3 ))
OR { 50}
(( segid " " and resid 297 and name HB ))
(( segid " " and resid 301 and name HB2 ))
ASSI { 563}
( segid " " and resid 367 and name HD1%)
(( segid " " and resid 367 and name HB2 ))
2.300 0.600 0.600 peak 563 spectrum 1 weight 0.10000E+01 volume 0.80186E-02 ppm1 0.668 ppm2 1.025 CV 1
OR { 563}
( segid " " and resid 367 and name HD1%)
( segid " " and resid 307 and name HD2%)
ASSI { 994}
(( segid " " and resid 241 and name HA ))
(( segid " " and resid 242 and name H ))
3.300 1.400 1.400 peak 994 spectrum 1 weight 0.10000E+01 volume 0.16748E-02 ppm1 4.111 ppm2 7.531 CV 1
OR { 994}
(( segid " " and resid 241 and name HA ))
(( segid " " and resid 245 and name H ))
ASSI { 1362}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 221 and name H ))
4.100 2.200 1.900 peak 1362 spectrum 1 weight 0.10000E+01 volume 0.62593E-03 ppm1 0.466 ppm2 8.721 CV 1
OR { 1362}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 220 and name H ))
ASSI { 1054}
(( segid " " and resid 321 and name HG ))
( segid " " and resid 321 and name HD1%)
2.000 0.500 0.500 peak 1054 spectrum 1 weight 0.10000E+01 volume 0.13728E-01 ppm1 1.735 ppm2 0.871 CV 1
OR { 1054}
(( segid " " and resid 352 and name HG12))
( segid " " and resid 352 and name HG2%)
OR { 1054}
(( segid " " and resid 321 and name HG ))
( segid " " and resid 325 and name HE% )
OR { 1054}
(( segid " " and resid 321 and name HG ))
( segid " " and resid 346 and name HD1%)
ASSI { 867}
(( segid " " and resid 322 and name HA ))
( segid " " and resid 321 and name HD2%)
4.800 2.900 1.200 peak 867 spectrum 1 weight 0.10000E+01 volume 0.57516E-03 ppm1 3.382 ppm2 0.677 CV 1
OR { 867}
(( segid " " and resid 322 and name HA ))
( segid " " and resid 357 and name HD1%)
OR { 867}
(( segid " " and resid 322 and name HA ))
( segid " " and resid 350 and name HG1%)
OR { 867}
(( segid " " and resid 322 and name HA ))
( segid " " and resid 339 and name HG2%)
OR { 867}
(( segid " " and resid 322 and name HA ))
( segid " " and resid 342 and name HD1%)
ASSI { 257}
( segid " " and resid 266 and name HD2%)
(( segid " " and resid 266 and name H ))
3.700 1.700 1.700 peak 257 spectrum 1 weight 0.10000E+01 volume 0.35862E-02 ppm1 0.820 ppm2 8.269 CV 1
OR { 257}
( segid " " and resid 423 and name HD2%)
(( segid " " and resid 424 and name H ))
ASSI { 961}
( segid " " and resid 198 and name HG1%)
(( segid " " and resid 208 and name HA ))
2.400 0.700 0.700 peak 961 spectrum 1 weight 0.10000E+01 volume 0.50356E-02 ppm1 0.604 ppm2 3.872 CV 1
OR { 961}
( segid " " and resid 198 and name HG1%)
(( segid " " and resid 199 and name HA ))
OR { 961}
( segid " " and resid 198 and name HG1%)
(( segid " " and resid 195 and name HA ))
ASSI { 925}
(( segid " " and resid 299 and name HD2 ))
(( segid " " and resid 300 and name H ))
4.200 2.200 1.800 peak 925 spectrum 1 weight 0.10000E+01 volume 0.12378E-02 ppm1 1.599 ppm2 7.973 CV 1
OR { 925}
(( segid " " and resid 399 and name HD3 ))
(( segid " " and resid 400 and name H ))
OR { 925}
(( segid " " and resid 425 and name HD3 ))
(( segid " " and resid 426 and name H ))
OR { 925}
(( segid " " and resid 425 and name HD2 ))
(( segid " " and resid 426 and name H ))
OR { 925}
(( segid " " and resid 399 and name HD2 ))
(( segid " " and resid 400 and name H ))
ASSI { 429}
( segid " " and resid 364 and name HG2%)
(( segid " " and resid 324 and name H ))
4.300 2.300 1.700 peak 429 spectrum 1 weight 0.10000E+01 volume 0.77534E-03 ppm1 0.913 ppm2 8.500 CV 1
OR { 429}
( segid " " and resid 345 and name HG2%)
(( segid " " and resid 325 and name H ))
ASSI { 901}
(( segid " " and resid 355 and name HG2 ))
(( segid " " and resid 354 and name HB3 ))
3.300 1.400 1.400 peak 901 spectrum 1 weight 0.10000E+01 volume 0.15225E-02 ppm1 1.732 ppm2 2.747 CV 1
OR { 901}
(( segid " " and resid 355 and name HG3 ))
(( segid " " and resid 354 and name HB3 ))
OR { 901}
(( segid " " and resid 321 and name HG ))
(( segid " " and resid 325 and name HG3 ))
OR { 901}
(( segid " " and resid 355 and name HG2 ))
(( segid " " and resid 291 and name HB2 ))
OR { 901}
(( segid " " and resid 355 and name HG3 ))
(( segid " " and resid 291 and name HB2 ))
OR { 901}
(( segid " " and resid 321 and name HG ))
(( segid " " and resid 360 and name HB2 ))
OR { 901}
(( segid " " and resid 352 and name HG12))
(( segid " " and resid 360 and name HB2 ))
OR { 901}
(( segid " " and resid 352 and name HG12))
(( segid " " and resid 291 and name HB2 ))
OR { 901}
(( segid " " and resid 355 and name HG3 ))
(( segid " " and resid 360 and name HB2 ))
OR { 901}
(( segid " " and resid 352 and name HG12))
(( segid " " and resid 354 and name HB3 ))
OR { 901}
(( segid " " and resid 352 and name HG12))
(( segid " " and resid 354 and name HB2 ))
ASSI { 75}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 283 and name HB2 ))
2.100 0.600 0.600 peak 75 spectrum 1 weight 0.10000E+01 volume 0.10452E-01 ppm1 0.904 ppm2 2.300 CV 1
OR { 75}
( segid " " and resid 267 and name HD2%)
(( segid " " and resid 267 and name HB3 ))
OR { 75}
( segid " " and resid 267 and name HD2%)
(( segid " " and resid 216 and name HB2 ))
OR { 75}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 309 and name HG2 ))
ASSI { 831}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 375 and name H ))
4.800 2.900 1.200 peak 831 spectrum 1 weight 0.10000E+01 volume 0.66820E-03 ppm1 0.463 ppm2 8.492 CV 1
OR { 831}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 324 and name H ))
OR { 831}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 325 and name H ))
ASSI { 1398}
( segid " " and resid 243 and name HD1%)
(( segid " " and resid 242 and name HG2 ))
4.000 2.000 2.000 peak 1398 spectrum 1 weight 0.10000E+01 volume 0.12772E-02 ppm1 0.012 ppm2 2.216 CV 1
OR { 1398}
( segid " " and resid 243 and name HD1%)
(( segid " " and resid 242 and name HB3 ))
OR { 1398}
( segid " " and resid 243 and name HD1%)
(( segid " " and resid 269 and name HB2 ))
ASSI { 594}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 320 and name HB3 ))
4.600 2.600 1.400 peak 594 spectrum 1 weight 0.10000E+01 volume 0.61183E-03 ppm1 0.467 ppm2 3.295 CV 1
OR { 594}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 324 and name HB3 ))
OR { 594}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 220 and name HA ))
ASSI { 1448}
(( segid " " and resid 361 and name HB2 ))
( segid " " and resid 329 and name HD1%)
5.100 3.300 0.900 peak 1448 spectrum 1 weight 0.10000E+01 volume 0.22838E-03 ppm1 3.078 ppm2 0.116 CV 1
OR { 1448}
(( segid " " and resid 361 and name HB2 ))
( segid " " and resid 300 and name HG1%)
ASSI { 2732}
(( segid " " and resid 305 and name HB2 ))
( segid " " and resid 306 and name HD1%)
4.100 2.100 1.900 peak 2732 spectrum 1 weight 0.10000E+01 volume 0.12349E-02 ppm1 1.839 ppm2 0.376 CV 1
OR { 2732}
(( segid " " and resid 309 and name HB2 ))
( segid " " and resid 306 and name HD1%)
OR { 2732}
(( segid " " and resid 305 and name HB3 ))
( segid " " and resid 306 and name HD1%)
OR { 2732}
(( segid " " and resid 309 and name HB3 ))
( segid " " and resid 306 and name HD1%)
ASSI { 3166}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 207 and name HG12))
2.100 0.500 0.500 peak 3166 spectrum 1 weight 0.10000E+01 volume 0.99386E-02 ppm1 0.885 ppm2 1.332 CV 1
OR { 3166}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 374 and name HG3 ))
ASSI { 1338}
(( segid " " and resid 198 and name HA ))
( segid " " and resid 202 and name HE% )
4.700 2.700 1.300 peak 1338 spectrum 1 weight 0.10000E+01 volume 0.82329E-03 ppm1 2.898 ppm2 1.899 CV 1
OR { 1338}
(( segid " " and resid 300 and name HA ))
(( segid " " and resid 366 and name HB2 ))
OR { 1338}
(( segid " " and resid 300 and name HA ))
(( segid " " and resid 301 and name HB3 ))
OR { 1338}
(( segid " " and resid 198 and name HA ))
(( segid " " and resid 199 and name HB2 ))
OR { 1338}
(( segid " " and resid 300 and name HA ))
(( segid " " and resid 366 and name HB3 ))
OR { 1338}
(( segid " " and resid 300 and name HA ))
(( segid " " and resid 302 and name HB2 ))
OR { 1338}
(( segid " " and resid 198 and name HA ))
(( segid " " and resid 209 and name HB3 ))
OR { 1338}
(( segid " " and resid 300 and name HA ))
(( segid " " and resid 304 and name HB3 ))
ASSI { 1360}
( segid " " and resid 317 and name HD2%)
(( segid " " and resid 318 and name HA ))
3.100 1.200 1.200 peak 1360 spectrum 1 weight 0.10000E+01 volume 0.23684E-02 ppm1 0.341 ppm2 3.358 CV 1
OR { 1360}
( segid " " and resid 317 and name HD2%)
(( segid " " and resid 320 and name HB3 ))
ASSI { 1605}
( segid " " and resid 416 and name HD2%)
(( segid " " and resid 417 and name H ))
4.100 2.100 1.900 peak 1605 spectrum 1 weight 0.10000E+01 volume 0.20582E-02 ppm1 0.697 ppm2 7.757 CV 1
OR { 1605}
( segid " " and resid 416 and name HD2%)
(( segid " " and resid 425 and name H ))
OR { 1605}
( segid " " and resid 416 and name HD2%)
(( segid " " and resid 430 and name H ))
ASSI { 1407}
( segid " " and resid 255 and name HD2%)
(( segid " " and resid 256 and name HG3 ))
4.600 2.600 1.400 peak 1407 spectrum 1 weight 0.10000E+01 volume 0.16184E-02 ppm1 0.793 ppm2 2.399 CV 1
OR { 1407}
( segid " " and resid 255 and name HD2%)
(( segid " " and resid 257 and name HB3 ))
OR { 1407}
( segid " " and resid 255 and name HD2%)
(( segid " " and resid 257 and name HB2 ))
ASSI { 61}
( segid " " and resid 368 and name HE% )
( segid " " and resid 307 and name HD2%)
3.500 1.600 1.600 peak 61 spectrum 1 weight 0.10000E+01 volume 0.97271E-03 ppm1 6.751 ppm2 1.020 CV 1
OR { 61}
( segid " " and resid 368 and name HE% )
(( segid " " and resid 367 and name HB2 ))
ASSI { 1543}
(( segid " " and resid 335 and name HB ))
( segid " " and resid 328 and name HG1%)
4.200 2.200 1.800 peak 1543 spectrum 1 weight 0.10000E+01 volume 0.84868E-03 ppm1 4.152 ppm2 0.761 CV 1
OR { 1543}
(( segid " " and resid 335 and name HB ))
( segid " " and resid 329 and name HG2%)
ASSI { 375}
( segid " " and resid 423 and name HD2%)
(( segid " " and resid 430 and name HZ2 ))
3.200 1.300 1.300 peak 375 spectrum 1 weight 0.10000E+01 volume 0.30479E-02 ppm1 0.823 ppm2 7.252 CV 1
OR { 375}
( segid " " and resid 316 and name HD1%)
(( segid " " and resid 320 and name HD1 ))
ASSI { 575}
(( segid " " and resid 244 and name HA ))
( segid " " and resid 266 and name HD1%)
4.000 2.000 2.000 peak 575 spectrum 1 weight 0.10000E+01 volume 0.10996E-02 ppm1 3.285 ppm2 0.914 CV 1
OR { 575}
(( segid " " and resid 244 and name HA ))
(( segid " " and resid 244 and name HD2 ))
ASSI { 29}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 283 and name H ))
3.300 3.300 2.700 peak 29 spectrum 1 weight 0.10000E+01 volume 0.14943E-02 ppm1 2.151 ppm2 7.329 CV 1
OR { 29}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 356 and name H ))
OR { 29}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 360 and name H ))
ASSI { 1224}
(( segid " " and resid 331 and name HB3 ))
( segid " " and resid 335 and name HG2%)
3.800 1.800 1.800 peak 1224 spectrum 1 weight 0.10000E+01 volume 0.47930E-03 ppm1 2.565 ppm2 1.252 CV 1
OR { 1224}
(( segid " " and resid 331 and name HB3 ))
(( segid " " and resid 226 and name HG2 ))
OR { 1224}
(( segid " " and resid 331 and name HB3 ))
(( segid " " and resid 226 and name HG3 ))
ASSI { 975}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 328 and name HB ))
5.000 3.100 1.000 peak 975 spectrum 1 weight 0.10000E+01 volume 0.62029E-03 ppm1 1.805 ppm2 2.403 CV 1
OR { 975}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 325 and name HG2 ))
ASSI { 3826}
(( segid " " and resid 341 and name HB3 ))
(( segid " " and resid 338 and name H ))
3.000 1.200 1.200 peak 3826 spectrum 1 weight 0.10000E+01 volume 0.12913E-02 ppm1 2.800 ppm2 7.715 CV 1
OR { 3826}
(( segid " " and resid 410 and name HB2 ))
(( segid " " and resid 411 and name H ))
OR { 3826}
(( segid " " and resid 341 and name HB2 ))
(( segid " " and resid 338 and name H ))
ASSI { 1457}
( segid " " and resid 443 and name HD1%)
(( segid " " and resid 399 and name HA ))
2.500 0.800 0.800 peak 1457 spectrum 1 weight 0.10000E+01 volume 0.72828E-02 ppm1 0.846 ppm2 3.766 CV 1
OR { 1457}
( segid " " and resid 443 and name HD1%)
(( segid " " and resid 440 and name HA ))
ASSI { 2050}
( segid " " and resid 339 and name HG2%)
(( segid " " and resid 358 and name H ))
3.900 1.900 1.900 peak 2050 spectrum 1 weight 0.10000E+01 volume 0.15874E-02 ppm1 0.706 ppm2 8.540 CV 1
OR { 2050}
( segid " " and resid 339 and name HG2%)
(( segid " " and resid 341 and name H ))
ASSI { 1535}
( segid " " and resid 279 and name HD2%)
(( segid " " and resid 277 and name HB3 ))
4.200 2.200 1.800 peak 1535 spectrum 1 weight 0.10000E+01 volume 0.10150E-02 ppm1 0.368 ppm2 1.978 CV 1
OR { 1535}
( segid " " and resid 279 and name HD2%)
(( segid " " and resid 310 and name HB3 ))
OR { 1535}
( segid " " and resid 279 and name HD2%)
(( segid " " and resid 351 and name HB2 ))
OR { 1535}
( segid " " and resid 279 and name HD2%)
(( segid " " and resid 356 and name HB ))
ASSI { 2608}
( segid " " and resid 209 and name HD2%)
( segid " " and resid 209 and name HD1%)
2.700 0.900 0.900 peak 2608 spectrum 1 weight 0.10000E+01 volume 0.40911E-02 ppm1 -0.905 ppm2 0.184 CV 1
OR { 2608}
( segid " " and resid 209 and name HD2%)
( segid " " and resid 317 and name HD1%)
ASSI { 195}
( segid " " and resid 346 and name HD2%)
(( segid " " and resid 322 and name H ))
4.700 2.800 1.300 peak 195 spectrum 1 weight 0.10000E+01 volume 0.80355E-03 ppm1 0.747 ppm2 8.178 CV 1
OR { 195}
( segid " " and resid 346 and name HD2%)
(( segid " " and resid 343 and name H ))
OR { 195}
( segid " " and resid 346 and name HD2%)
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ASSI { 1178}
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2.100 0.500 0.500 peak 1178 spectrum 1 weight 0.10000E+01 volume 0.13883E-01 ppm1 0.558 ppm2 0.810 CV 1
OR { 1178}
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( segid " " and resid 439 and name HD1%)
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ASSI { 573}
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2.500 0.800 0.800 peak 573 spectrum 1 weight 0.10000E+01 volume 0.45762E-02 ppm1 0.846 ppm2 2.223 CV 1
OR { 573}
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ASSI { 1187}
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3.400 3.400 2.600 peak 1187 spectrum 1 weight 0.10000E+01 volume 0.15197E-02 ppm1 0.649 ppm2 1.245 CV 1
OR { 1187}
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(( segid " " and resid 342 and name HG13))
OR { 1187}
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OR { 1187}
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OR { 1187}
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ASSI { 1055}
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3.500 1.600 1.600 peak 1055 spectrum 1 weight 0.10000E+01 volume 0.16663E-02 ppm1 3.820 ppm2 0.376 CV 1
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( segid " " and resid 323 and name HG2%)
OR { 1055}
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OR { 1055}
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( segid " " and resid 322 and name HG2%)
ASSI { 1466}
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2.000 0.500 0.500 peak 1466 spectrum 1 weight 0.10000E+01 volume 0.79396E-02 ppm1 0.717 ppm2 2.164 CV 1
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ASSI { 1099}
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3.900 1.900 1.900 peak 1099 spectrum 1 weight 0.10000E+01 volume 0.92761E-03 ppm1 0.706 ppm2 3.275 CV 1
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ASSI { 162}
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5.200 3.400 0.800 peak 162 spectrum 1 weight 0.10000E+01 volume 0.66538E-03 ppm1 0.767 ppm2 7.778 CV 1
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OR { 162}
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ASSI { 1430}
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( segid " " and resid 310 and name HD1%)
3.300 1.300 1.300 peak 1430 spectrum 1 weight 0.10000E+01 volume 0.11757E-02 ppm1 3.779 ppm2 1.069 CV 1
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( segid " " and resid 307 and name HD2%)
ASSI { 796}
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( segid " " and resid 323 and name HG2%)
4.900 3.000 1.100 peak 796 spectrum 1 weight 0.10000E+01 volume 0.41447E-03 ppm1 2.645 ppm2 0.382 CV 1
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( segid " " and resid 371 and name HG1%)
ASSI { 1514}
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3.000 1.100 1.100 peak 1514 spectrum 1 weight 0.10000E+01 volume 0.47563E-02 ppm1 1.185 ppm2 3.928 CV 1
OR { 1514}
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ASSI { 69}
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4.900 3.100 1.100 peak 69 spectrum 1 weight 0.10000E+01 volume 0.40600E-03 ppm1 6.803 ppm2 3.634 CV 1
OR { 69}
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(( segid " " and resid 364 and name HA ))
ASSI { 714}
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3.300 1.300 1.300 peak 714 spectrum 1 weight 0.10000E+01 volume 0.23232E-02 ppm1 1.293 ppm2 7.483 CV 1
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( segid " " and resid 201 and name HG2%)
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ASSI { 868}
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3.200 1.300 1.300 peak 868 spectrum 1 weight 0.10000E+01 volume 0.53063E-02 ppm1 1.355 ppm2 2.054 CV 1
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OR { 868}
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ASSI { 77}
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(( segid " " and resid 324 and name HE1 ))
3.400 1.500 1.500 peak 77 spectrum 1 weight 0.10000E+01 volume 0.57234E-03 ppm1 2.230 ppm2 7.237 CV 1
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ASSI { 1422}
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( segid " " and resid 279 and name HD2%)
3.700 1.700 1.700 peak 1422 spectrum 1 weight 0.10000E+01 volume 0.24022E-02 ppm1 1.721 ppm2 0.376 CV 1
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( segid " " and resid 318 and name HD1%)
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( segid " " and resid 356 and name HG2%)
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( segid " " and resid 356 and name HG2%)
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( segid " " and resid 356 and name HG2%)
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( segid " " and resid 322 and name HG2%)
ASSI { 610}
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(( segid " " and resid 335 and name HG1 ))
2.800 2.800 3.200 peak 610 spectrum 1 weight 0.10000E+01 volume 0.83739E-03 ppm1 1.803 ppm2 3.546 CV 1
OR { 610}
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(( segid " " and resid 231 and name HA ))
OR { 610}
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(( segid " " and resid 348 and name HD2 ))
ASSI { 4301}
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(( segid " " and resid 301 and name HA ))
2.700 0.900 0.900 peak 4301 spectrum 1 weight 0.10000E+01 volume 0.57544E-02 ppm1 2.480 ppm2 4.008 CV 1
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(( segid " " and resid 433 and name HA ))
ASSI { 591}
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4.100 2.100 1.900 peak 591 spectrum 1 weight 0.10000E+01 volume 0.69359E-03 ppm1 1.014 ppm2 7.582 CV 1
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(( segid " " and resid 441 and name H ))
OR { 591}
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OR { 591}
( segid " " and resid 436 and name HD1%)
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ASSI { 1195}
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4.000 2.000 2.000 peak 1195 spectrum 1 weight 0.10000E+01 volume 0.48212E-03 ppm1 -0.342 ppm2 2.890 CV 1
OR { 1195}
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ASSI { 447}
( segid " " and resid 323 and name HG2%)
( segid " " and resid 364 and name HG2%)
2.200 0.600 0.600 peak 447 spectrum 1 weight 0.10000E+01 volume 0.50863E-02 ppm1 0.433 ppm2 0.937 CV 1
OR { 447}
( segid " " and resid 323 and name HG2%)
( segid " " and resid 371 and name HG2%)
ASSI { 2475}
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2.300 0.700 0.700 peak 2475 spectrum 1 weight 0.10000E+01 volume 0.12361E-01 ppm1 2.852 ppm2 1.821 CV 1
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(( segid " " and resid 308 and name HB2 ))
OR { 2475}
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(( segid " " and resid 399 and name HB3 ))
OR { 2475}
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(( segid " " and resid 308 and name HB3 ))
OR { 2475}
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(( segid " " and resid 399 and name HB3 ))
OR { 2475}
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(( segid " " and resid 308 and name HB3 ))
ASSI { 1599}
( segid " " and resid 230 and name HD1%)
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3.200 1.200 1.200 peak 1599 spectrum 1 weight 0.10000E+01 volume 0.13393E-02 ppm1 0.651 ppm2 4.515 CV 1
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ASSI { 508}
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(( segid " " and resid 372 and name H ))
3.100 1.200 1.200 peak 508 spectrum 1 weight 0.10000E+01 volume 0.13167E-02 ppm1 3.777 ppm2 7.967 CV 1
OR { 508}
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(( segid " " and resid 400 and name H ))
OR { 508}
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(( segid " " and resid 300 and name H ))
OR { 508}
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(( segid " " and resid 302 and name H ))
ASSI { 1473}
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(( segid " " and resid 340 and name HA ))
2.300 0.700 0.700 peak 1473 spectrum 1 weight 0.10000E+01 volume 0.62565E-02 ppm1 1.959 ppm2 4.010 CV 1
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(( segid " " and resid 345 and name HA ))
ASSI { 1144}
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(( segid " " and resid 245 and name H ))
3.900 1.900 1.900 peak 1144 spectrum 1 weight 0.10000E+01 volume 0.49622E-03 ppm1 3.283 ppm2 7.499 CV 1
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(( segid " " and resid 244 and name HA ))
(( segid " " and resid 246 and name H ))
ASSI { 1533}
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(( segid " " and resid 427 and name HG2 ))
5.200 3.300 0.800 peak 1533 spectrum 1 weight 0.10000E+01 volume 0.33834E-03 ppm1 7.309 ppm2 2.233 CV 1
OR { 1533}
(( segid " " and resid 430 and name HZ2 ))
(( segid " " and resid 426 and name HG2 ))
ASSI { 8}
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( segid " " and resid 323 and name HG2%)
2.000 0.500 0.500 peak 8 spectrum 1 weight 0.10000E+01 volume 0.19494E-01 ppm1 0.780 ppm2 0.399 CV 1
OR { 8}
( segid " " and resid 323 and name HG1%)
( segid " " and resid 371 and name HG1%)
ASSI { 22}
(( segid " " and resid 366 and name HB2 ))
( segid " " and resid 300 and name HG1%)
3.800 1.800 1.800 peak 22 spectrum 1 weight 0.10000E+01 volume 0.55545E-03 ppm1 1.882 ppm2 0.069 CV 1
OR { 22}
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(( segid " " and resid 367 and name HB3 ))
ASSI { 815}
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(( segid " " and resid 207 and name H ))
2.800 1.000 1.000 peak 815 spectrum 1 weight 0.10000E+01 volume 0.40967E-02 ppm1 1.028 ppm2 6.871 CV 1
OR { 815}
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( segid " " and resid 315 and name HE% )
ASSI { 1546}
( segid " " and resid 372 and name HG1%)
(( segid " " and resid 371 and name H ))
3.400 3.400 2.600 peak 1546 spectrum 1 weight 0.10000E+01 volume 0.38062E-03 ppm1 0.639 ppm2 7.533 CV 1
OR { 1546}
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(( segid " " and resid 370 and name HD22))
OR { 1546}
( segid " " and resid 372 and name HG1%)
(( segid " " and resid 375 and name HE22))
ASSI { 265}
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( segid " " and resid 356 and name HG2%)
4.700 2.800 1.300 peak 265 spectrum 1 weight 0.10000E+01 volume 0.49058E-03 ppm1 6.327 ppm2 0.383 CV 1
OR { 265}
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( segid " " and resid 306 and name HD1%)
OR { 265}
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( segid " " and resid 279 and name HD2%)
OR { 265}
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( segid " " and resid 318 and name HD1%)
ASSI { 699}
( segid " " and resid 207 and name HG2%)
(( segid " " and resid 207 and name HG13))
3.800 1.800 1.800 peak 699 spectrum 1 weight 0.10000E+01 volume 0.19031E-02 ppm1 0.464 ppm2 1.065 CV 1
OR { 699}
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OR { 699}
( segid " " and resid 217 and name HG2%)
( segid " " and resid 220 and name HG2%)
ASSI { 1375}
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4.200 2.200 1.800 peak 1375 spectrum 1 weight 0.10000E+01 volume 0.12124E-02 ppm1 2.066 ppm2 2.869 CV 1
OR { 1375}
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(( segid " " and resid 336 and name HE3 ))
OR { 1375}
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OR { 1375}
(( segid " " and resid 228 and name HG2 ))
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ASSI { 1025}
( segid " " and resid 297 and name HG2%)
(( segid " " and resid 298 and name HG3 ))
3.500 1.500 1.500 peak 1025 spectrum 1 weight 0.10000E+01 volume 0.66651E-02 ppm1 1.116 ppm2 2.134 CV 1
OR { 1025}
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(( segid " " and resid 298 and name HG2 ))
OR { 1025}
( segid " " and resid 297 and name HG2%)
(( segid " " and resid 296 and name HB2 ))
ASSI { 356}
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(( segid " " and resid 312 and name HG3 ))
3.100 1.200 1.200 peak 356 spectrum 1 weight 0.10000E+01 volume 0.40854E-02 ppm1 0.748 ppm2 2.083 CV 1
OR { 356}
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(( segid " " and resid 312 and name HB2 ))
OR { 356}
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(( segid " " and resid 312 and name HG3 ))
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(( segid " " and resid 198 and name HB ))
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ASSI { 234}
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4.100 2.100 1.900 peak 234 spectrum 1 weight 0.10000E+01 volume 0.62593E-03 ppm1 1.769 ppm2 7.774 CV 1
OR { 234}
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(( segid " " and resid 417 and name H ))
OR { 234}
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ASSI { 1220}
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4.000 2.000 2.000 peak 1220 spectrum 1 weight 0.10000E+01 volume 0.82893E-03 ppm1 0.602 ppm2 1.975 CV 1
OR { 1220}
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(( segid " " and resid 357 and name HB2 ))
ASSI { 1044}
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2.100 0.600 0.600 peak 1044 spectrum 1 weight 0.10000E+01 volume 0.20272E-01 ppm1 0.343 ppm2 0.708 CV 1
OR { 1044}
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( segid " " and resid 278 and name HD2%)
OR { 1044}
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( segid " " and resid 271 and name HD2%)
OR { 1044}
( segid " " and resid 317 and name HD2%)
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OR { 1044}
( segid " " and resid 317 and name HD2%)
( segid " " and resid 321 and name HD2%)
ASSI { 790}
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3.400 1.400 1.400 peak 790 spectrum 1 weight 0.10000E+01 volume 0.25770E-02 ppm1 0.613 ppm2 4.343 CV 1
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OR { 790}
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ASSI { 1305}
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( segid " " and resid 407 and name HE% )
3.800 1.800 1.800 peak 1305 spectrum 1 weight 0.10000E+01 volume 0.82329E-03 ppm1 1.871 ppm2 6.868 CV 1
OR { 1305}
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( segid " " and resid 407 and name HE% )
ASSI { 1489}
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(( segid " " and resid 379 and name HG2 ))
2.400 0.700 0.700 peak 1489 spectrum 1 weight 0.10000E+01 volume 0.77252E-02 ppm1 3.614 ppm2 1.819 CV 1
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(( segid " " and resid 379 and name HG3 ))
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(( segid " " and resid 184 and name HB3 ))
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(( segid " " and resid 183 and name HB3 ))
ASSI { 3379}
(( segid " " and resid 346 and name HB2 ))
(( segid " " and resid 346 and name HA ))
3.000 1.100 1.100 peak 3379 spectrum 1 weight 0.10000E+01 volume 0.12490E-02 ppm1 1.706 ppm2 4.047 CV 1
OR { 3379}
(( segid " " and resid 346 and name HB2 ))
(( segid " " and resid 343 and name HA ))
ASSI { 1072}
( segid " " and resid 253 and name HG2%)
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3.200 1.200 1.200 peak 1072 spectrum 1 weight 0.10000E+01 volume 0.45057E-02 ppm1 0.611 ppm2 1.711 CV 1
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(( segid " " and resid 210 and name HG2 ))
OR { 1072}
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OR { 1072}
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( segid " " and resid 211 and name HB% )
OR { 1072}
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(( segid " " and resid 255 and name HB2 ))
OR { 1072}
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ASSI { 1483}
(( segid " " and resid 254 and name HB2 ))
(( segid " " and resid 254 and name HD21))
3.200 1.300 1.300 peak 1483 spectrum 1 weight 0.10000E+01 volume 0.15535E-02 ppm1 2.610 ppm2 7.475 CV 1
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(( segid " " and resid 254 and name HB2 ))
(( segid " " and resid 257 and name H ))
ASSI { 498}
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(( segid " " and resid 312 and name H ))
4.200 2.200 1.800 peak 498 spectrum 1 weight 0.10000E+01 volume 0.12378E-02 ppm1 2.078 ppm2 8.733 CV 1
OR { 498}
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(( segid " " and resid 221 and name H ))
OR { 498}
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ASSI { 475}
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( segid " " and resid 350 and name HG1%)
3.900 1.900 1.900 peak 475 spectrum 1 weight 0.10000E+01 volume 0.71615E-03 ppm1 4.411 ppm2 0.709 CV 1
OR { 475}
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( segid " " and resid 350 and name HG2%)
OR { 475}
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( segid " " and resid 321 and name HD2%)
OR { 475}
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( segid " " and resid 346 and name HD2%)
OR { 475}
(( segid " " and resid 349 and name HB ))
( segid " " and resid 357 and name HD1%)
ASSI { 670}
( segid " " and resid 220 and name HG1%)
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4.300 2.300 1.700 peak 670 spectrum 1 weight 0.10000E+01 volume 0.81483E-03 ppm1 1.112 ppm2 7.464 CV 1
OR { 670}
( segid " " and resid 220 and name HG2%)
(( segid " " and resid 226 and name H ))
OR { 670}
( segid " " and resid 220 and name HG2%)
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OR { 670}
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(( segid " " and resid 226 and name H ))
ASSI { 354}
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( segid " " and resid 398 and name HG2%)
2.700 0.900 0.900 peak 354 spectrum 1 weight 0.10000E+01 volume 0.50271E-02 ppm1 4.137 ppm2 0.811 CV 1
OR { 354}
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( segid " " and resid 443 and name HD1%)
OR { 354}
(( segid " " and resid 443 and name HA ))
( segid " " and resid 443 and name HD2%)
ASSI { 558}
( segid " " and resid 367 and name HD2%)
(( segid " " and resid 304 and name HA ))
2.600 0.900 0.900 peak 558 spectrum 1 weight 0.10000E+01 volume 0.33016E-02 ppm1 0.779 ppm2 4.007 CV 1
OR { 558}
( segid " " and resid 367 and name HD2%)
(( segid " " and resid 367 and name HA ))
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(( segid " " and resid 274 and name HA ))
ASSI { 1036}
(( segid " " and resid 304 and name HB2 ))
(( segid " " and resid 308 and name HE2 ))
5.800 4.100 0.200 peak 1036 spectrum 1 weight 0.10000E+01 volume 0.36088E-03 ppm1 2.242 ppm2 2.866 CV 1
OR { 1036}
(( segid " " and resid 304 and name HB2 ))
(( segid " " and resid 300 and name HA ))
OR { 1036}
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ASSI { 209}
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2.800 1.000 1.000 peak 209 spectrum 1 weight 0.10000E+01 volume 0.51484E-02 ppm1 2.195 ppm2 1.594 CV 1
OR { 209}
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(( segid " " and resid 331 and name HD3 ))
OR { 209}
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ASSI { 773}
( segid " " and resid 283 and name HD1%)
( segid " " and resid 310 and name HD2%)
3.400 1.500 1.500 peak 773 spectrum 1 weight 0.10000E+01 volume 0.55489E-02 ppm1 0.716 ppm2 1.094 CV 1
OR { 773}
( segid " " and resid 283 and name HD1%)
( segid " " and resid 280 and name HG2%)
OR { 773}
( segid " " and resid 283 and name HD1%)
( segid " " and resid 310 and name HD1%)
ASSI { 1598}
(( segid " " and resid 425 and name HE3 ))
(( segid " " and resid 426 and name H ))
2.500 2.500 3.500 peak 1598 spectrum 1 weight 0.10000E+01 volume 0.13872E-02 ppm1 2.890 ppm2 7.974 CV 1
OR { 1598}
(( segid " " and resid 425 and name HE2 ))
(( segid " " and resid 426 and name H ))
OR { 1598}
(( segid " " and resid 421 and name HE3 ))
(( segid " " and resid 426 and name H ))
OR { 1598}
(( segid " " and resid 425 and name HE3 ))
(( segid " " and resid 416 and name H ))
OR { 1598}
(( segid " " and resid 425 and name HE2 ))
(( segid " " and resid 416 and name H ))
OR { 1598}
(( segid " " and resid 421 and name HE2 ))
(( segid " " and resid 426 and name H ))
OR { 1598}
(( segid " " and resid 425 and name HE3 ))
(( segid " " and resid 415 and name H ))
OR { 1598}
(( segid " " and resid 421 and name HE2 ))
(( segid " " and resid 419 and name H ))
OR { 1598}
(( segid " " and resid 425 and name HE2 ))
(( segid " " and resid 415 and name H ))
OR { 1598}
(( segid " " and resid 421 and name HE3 ))
(( segid " " and resid 419 and name H ))
OR { 1598}
(( segid " " and resid 440 and name HE2 ))
(( segid " " and resid 400 and name H ))
ASSI { 454}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 325 and name H ))
4.400 2.500 1.600 peak 454 spectrum 1 weight 0.10000E+01 volume 0.10432E-02 ppm1 1.912 ppm2 8.464 CV 1
OR { 454}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 324 and name H ))
OR { 454}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 231 and name H ))
ASSI { 953}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 270 and name HB2 ))
3.900 1.900 1.900 peak 953 spectrum 1 weight 0.10000E+01 volume 0.45395E-03 ppm1 -0.165 ppm2 2.929 CV 1
OR { 953}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 210 and name HD3 ))
ASSI { 1346}
( segid " " and resid 243 and name HD1%)
(( segid " " and resid 242 and name H ))
5.600 3.900 0.400 peak 1346 spectrum 1 weight 0.10000E+01 volume 0.38062E-03 ppm1 0.014 ppm2 7.535 CV 1
OR { 1346}
( segid " " and resid 243 and name HD1%)
(( segid " " and resid 245 and name H ))
ASSI { 1589}
(( segid " " and resid 365 and name HB2 ))
(( segid " " and resid 365 and name H ))
2.300 0.700 0.700 peak 1589 spectrum 1 weight 0.10000E+01 volume 0.78973E-02 ppm1 1.992 ppm2 8.342 CV 1
OR { 1589}
(( segid " " and resid 365 and name HB2 ))
(( segid " " and resid 366 and name H ))
OR { 1589}
(( segid " " and resid 433 and name HB2 ))
(( segid " " and resid 433 and name H ))
OR { 1589}
(( segid " " and resid 365 and name HB3 ))
(( segid " " and resid 365 and name H ))
OR { 1589}
(( segid " " and resid 365 and name HB3 ))
(( segid " " and resid 366 and name H ))
ASSI { 595}
( segid " " and resid 330 and name HB% )
(( segid " " and resid 331 and name HB3 ))
5.000 3.200 1.000 peak 595 spectrum 1 weight 0.10000E+01 volume 0.77534E-03 ppm1 1.550 ppm2 2.590 CV 1
OR { 595}
( segid " " and resid 330 and name HB% )
(( segid " " and resid 331 and name HB2 ))
OR { 595}
( segid " " and resid 330 and name HB% )
(( segid " " and resid 332 and name HB3 ))
ASSI { 626}
( segid " " and resid 356 and name HG2%)
(( segid " " and resid 284 and name HG3 ))
3.400 3.400 2.600 peak 626 spectrum 1 weight 0.10000E+01 volume 0.43421E-03 ppm1 0.385 ppm2 2.576 CV 1
OR { 626}
( segid " " and resid 356 and name HG2%)
(( segid " " and resid 284 and name HG2 ))
OR { 626}
( segid " " and resid 356 and name HG2%)
(( segid " " and resid 361 and name HB3 ))
ASSI { 1646}
( segid " " and resid 263 and name HG1%)
(( segid " " and resid 263 and name HA ))
2.800 1.000 1.000 peak 1646 spectrum 1 weight 0.10000E+01 volume 0.27772E-02 ppm1 0.072 ppm2 3.171 CV 1
OR { 1646}
( segid " " and resid 263 and name HG1%)
(( segid " " and resid 219 and name HB2 ))
OR { 1646}
( segid " " and resid 263 and name HG1%)
(( segid " " and resid 219 and name HB3 ))
ASSI { 97}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 323 and name HB ))
2.900 1.000 1.000 peak 97 spectrum 1 weight 0.10000E+01 volume 0.28167E-02 ppm1 0.366 ppm2 1.719 CV 1
OR { 97}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 372 and name HB ))
ASSI { 1219}
( segid " " and resid 360 and name HD% )
( segid " " and resid 322 and name HG2%)
2.400 0.700 0.700 peak 1219 spectrum 1 weight 0.10000E+01 volume 0.54981E-02 ppm1 7.076 ppm2 0.378 CV 1
OR { 1219}
( segid " " and resid 360 and name HE% )
( segid " " and resid 318 and name HD1%)
OR { 1219}
( segid " " and resid 360 and name HE% )
( segid " " and resid 279 and name HD2%)
OR { 1219}
( segid " " and resid 360 and name HD% )
( segid " " and resid 318 and name HD1%)
OR { 1219}
( segid " " and resid 360 and name HD% )
( segid " " and resid 279 and name HD2%)
ASSI { 193}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 208 and name H ))
4.500 2.600 1.500 peak 193 spectrum 1 weight 0.10000E+01 volume 0.13618E-02 ppm1 0.883 ppm2 8.259 CV 1
OR { 193}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 203 and name H ))
ASSI { 1374}
(( segid " " and resid 295 and name HB ))
(( segid " " and resid 297 and name HB ))
3.800 1.800 1.800 peak 1374 spectrum 1 weight 0.10000E+01 volume 0.81483E-03 ppm1 4.387 ppm2 3.922 CV 1
OR { 1374}
(( segid " " and resid 295 and name HB ))
(( segid " " and resid 298 and name HA ))
ASSI { 1638}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 266 and name HB2 ))
4.000 2.000 2.000 peak 1638 spectrum 1 weight 0.10000E+01 volume 0.11447E-02 ppm1 -0.166 ppm2 1.534 CV 1
OR { 1638}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 266 and name HB3 ))
OR { 1638}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 210 and name HG3 ))
OR { 1638}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 267 and name HB2 ))
OR { 1638}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 244 and name HB3 ))
ASSI { 487}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 399 and name HG2 ))
3.700 1.700 1.700 peak 487 spectrum 1 weight 0.10000E+01 volume 0.21343E-02 ppm1 0.807 ppm2 1.332 CV 1
OR { 487}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 440 and name HG2 ))
OR { 487}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 440 and name HG3 ))
ASSI { 54}
(( segid " " and resid 228 and name HB2 ))
(( segid " " and resid 227 and name HB3 ))
5.000 3.100 1.000 peak 54 spectrum 1 weight 0.10000E+01 volume 0.69923E-03 ppm1 1.814 ppm2 2.859 CV 1
OR { 54}
(( segid " " and resid 228 and name HB2 ))
(( segid " " and resid 336 and name HE2 ))
OR { 54}
(( segid " " and resid 228 and name HB2 ))
(( segid " " and resid 336 and name HE3 ))
ASSI { 3723}
(( segid " " and resid 408 and name HB3 ))
(( segid " " and resid 408 and name HB2 ))
2.000 0.500 0.500 peak 3723 spectrum 1 weight 0.10000E+01 volume 0.23007E-02 ppm1 1.630 ppm2 1.926 CV 1
OR { 3723}
(( segid " " and resid 409 and name HB2 ))
(( segid " " and resid 409 and name HB3 ))
ASSI { 1297}
( segid " " and resid 267 and name HD2%)
(( segid " " and resid 213 and name HZ ))
3.400 1.500 1.500 peak 1297 spectrum 1 weight 0.10000E+01 volume 0.20216E-02 ppm1 0.904 ppm2 6.333 CV 1
OR { 1297}
( segid " " and resid 283 and name HD2%)
( segid " " and resid 287 and name HD% )
ASSI { 464}
(( segid " " and resid 214 and name HD2 ))
(( segid " " and resid 211 and name HA ))
3.700 1.700 1.700 peak 464 spectrum 1 weight 0.10000E+01 volume 0.17086E-02 ppm1 2.971 ppm2 3.786 CV 1
OR { 464}
(( segid " " and resid 378 and name HE2 ))
(( segid " " and resid 379 and name HD3 ))
OR { 464}
(( segid " " and resid 378 and name HE3 ))
(( segid " " and resid 379 and name HD3 ))
ASSI { 271}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 198 and name H ))
5.000 3.100 1.000 peak 271 spectrum 1 weight 0.10000E+01 volume 0.39472E-03 ppm1 0.556 ppm2 8.615 CV 1
OR { 271}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 313 and name H ))
ASSI { 1290}
(( segid " " and resid 278 and name HB2 ))
( segid " " and resid 279 and name HD2%)
2.500 0.800 0.800 peak 1290 spectrum 1 weight 0.10000E+01 volume 0.13703E-02 ppm1 1.194 ppm2 0.369 CV 1
OR { 1290}
(( segid " " and resid 278 and name HB2 ))
( segid " " and resid 318 and name HD1%)
OR { 1290}
(( segid " " and resid 278 and name HB2 ))
( segid " " and resid 318 and name HG2%)
OR { 1290}
(( segid " " and resid 278 and name HB2 ))
( segid " " and resid 317 and name HD2%)
ASSI { 35}
( segid " " and resid 192 and name HD1%)
(( segid " " and resid 192 and name HG13))
2.500 0.800 0.800 peak 35 spectrum 1 weight 0.10000E+01 volume 0.41870E-02 ppm1 0.868 ppm2 1.616 CV 1
OR { 35}
( segid " " and resid 192 and name HD1%)
(( segid " " and resid 189 and name HG13))
ASSI { 1961}
( segid " " and resid 352 and name HG2%)
(( segid " " and resid 353 and name H ))
2.500 0.800 0.800 peak 1961 spectrum 1 weight 0.10000E+01 volume 0.20723E-02 ppm1 0.909 ppm2 8.945 CV 1
OR { 1961}
( segid " " and resid 435 and name HG2%)
(( segid " " and resid 436 and name H ))
ASSI { 1388}
(( segid " " and resid 202 and name HG2 ))
(( segid " " and resid 199 and name HA ))
3.600 1.600 1.600 peak 1388 spectrum 1 weight 0.10000E+01 volume 0.70769E-03 ppm1 2.311 ppm2 3.817 CV 1
OR { 1388}
(( segid " " and resid 202 and name HG2 ))
(( segid " " and resid 206 and name HA3 ))
ASSI { 3164}
(( segid " " and resid 278 and name HB2 ))
(( segid " " and resid 279 and name H ))
3.100 1.200 1.200 peak 3164 spectrum 1 weight 0.10000E+01 volume 0.59491E-03 ppm1 1.203 ppm2 9.039 CV 1
OR { 3164}
(( segid " " and resid 380 and name HB2 ))
(( segid " " and resid 380 and name H ))
ASSI { 1110}
(( segid " " and resid 311 and name HD2 ))
( segid " " and resid 310 and name HD2%)
4.300 2.300 1.700 peak 1110 spectrum 1 weight 0.10000E+01 volume 0.75282E-03 ppm1 4.049 ppm2 1.095 CV 1
OR { 1110}
(( segid " " and resid 311 and name HD2 ))
( segid " " and resid 280 and name HG2%)
OR { 1110}
(( segid " " and resid 311 and name HD2 ))
( segid " " and resid 310 and name HD1%)
ASSI { 1131}
(( segid " " and resid 433 and name HG3 ))
(( segid " " and resid 429 and name HG ))
4.100 2.100 1.900 peak 1131 spectrum 1 weight 0.10000E+01 volume 0.14182E-02 ppm1 2.478 ppm2 1.395 CV 1
OR { 1131}
(( segid " " and resid 433 and name HG3 ))
(( segid " " and resid 409 and name HG ))
OR { 1131}
(( segid " " and resid 433 and name HG3 ))
(( segid " " and resid 429 and name HB2 ))
OR { 1131}
(( segid " " and resid 433 and name HG3 ))
(( segid " " and resid 436 and name HB2 ))
ASSI { 571}
( segid " " and resid 388 and name HE% )
(( segid " " and resid 387 and name H ))
3.100 3.100 2.900 peak 571 spectrum 1 weight 0.10000E+01 volume 0.69077E-03 ppm1 1.844 ppm2 7.997 CV 1
OR { 571}
( segid " " and resid 388 and name HE% )
(( segid " " and resid 386 and name H ))
OR { 571}
( segid " " and resid 388 and name HE% )
(( segid " " and resid 434 and name H ))
ASSI { 1061}
( segid " " and resid 317 and name HD2%)
(( segid " " and resid 317 and name HB2 ))
2.800 1.000 1.000 peak 1061 spectrum 1 weight 0.10000E+01 volume 0.51963E-02 ppm1 0.344 ppm2 1.342 CV 1
OR { 1061}
( segid " " and resid 317 and name HD2%)
(( segid " " and resid 318 and name HB ))
ASSI { 133}
(( segid " " and resid 413 and name HA ))
( segid " " and resid 429 and name HD2%)
3.000 1.200 1.200 peak 133 spectrum 1 weight 0.10000E+01 volume 0.20582E-02 ppm1 4.189 ppm2 0.674 CV 1
OR { 133}
(( segid " " and resid 413 and name HA ))
( segid " " and resid 416 and name HD2%)
ASSI { 287}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 285 and name HG2 ))
3.700 1.700 1.700 peak 287 spectrum 1 weight 0.10000E+01 volume 0.43647E-02 ppm1 2.585 ppm2 1.978 CV 1
OR { 287}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 351 and name HB2 ))
OR { 287}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 351 and name HB2 ))
OR { 287}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 277 and name HB3 ))
OR { 287}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 285 and name HG3 ))
OR { 287}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 285 and name HG2 ))
OR { 287}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 277 and name HB3 ))
OR { 287}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 285 and name HG3 ))
OR { 287}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 356 and name HB ))
ASSI { 3328}
(( segid " " and resid 365 and name HA ))
(( segid " " and resid 365 and name H ))
2.800 1.000 1.000 peak 3328 spectrum 1 weight 0.10000E+01 volume 0.24981E-02 ppm1 3.878 ppm2 8.342 CV 1
OR { 3328}
(( segid " " and resid 365 and name HA ))
(( segid " " and resid 366 and name H ))
ASSI { 2785}
(( segid " " and resid 286 and name HG3 ))
( segid " " and resid 306 and name HD2%)
4.500 2.600 1.500 peak 2785 spectrum 1 weight 0.10000E+01 volume 0.94454E-03 ppm1 1.708 ppm2 -0.351 CV 1
OR { 2785}
(( segid " " and resid 305 and name HG3 ))
( segid " " and resid 306 and name HD2%)
OR { 2785}
(( segid " " and resid 286 and name HG2 ))
( segid " " and resid 306 and name HD2%)
ASSI { 93}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 413 and name HD2 ))
3.400 1.400 1.400 peak 93 spectrum 1 weight 0.10000E+01 volume 0.19680E-02 ppm1 0.781 ppm2 6.813 CV 1
OR { 93}
( segid " " and resid 380 and name HD1%)
(( segid " " and resid 384 and name HD21))
ASSI { 1062}
( segid " " and resid 377 and name HE% )
(( segid " " and resid 405 and name HA ))
3.300 1.400 1.400 peak 1062 spectrum 1 weight 0.10000E+01 volume 0.14718E-02 ppm1 1.995 ppm2 3.868 CV 1
OR { 1062}
( segid " " and resid 377 and name HE% )
(( segid " " and resid 401 and name HA ))
ASSI { 2277}
( segid " " and resid 271 and name HD1%)
(( segid " " and resid 268 and name HA ))
2.900 1.000 1.000 peak 2277 spectrum 1 weight 0.10000E+01 volume 0.54812E-02 ppm1 0.844 ppm2 3.677 CV 1
OR { 2277}
( segid " " and resid 271 and name HD1%)
(( segid " " and resid 271 and name HA ))
ASSI { 778}
( segid " " and resid 236 and name HG2%)
(( segid " " and resid 240 and name HB ))
3.600 1.600 1.600 peak 778 spectrum 1 weight 0.10000E+01 volume 0.34482E-02 ppm1 0.960 ppm2 2.185 CV 1
OR { 778}
( segid " " and resid 236 and name HG2%)
(( segid " " and resid 242 and name HB3 ))
OR { 778}
( segid " " and resid 236 and name HG2%)
(( segid " " and resid 242 and name HB2 ))
OR { 778}
( segid " " and resid 236 and name HG2%)
(( segid " " and resid 242 and name HG2 ))
ASSI { 704}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 320 and name HA ))
4.700 2.800 1.300 peak 704 spectrum 1 weight 0.10000E+01 volume 0.53571E-03 ppm1 -0.906 ppm2 3.823 CV 1
OR { 704}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 208 and name HA ))
OR { 704}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 211 and name HA ))
OR { 704}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 314 and name HA ))
OR { 704}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 315 and name HA ))
OR { 704}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 194 and name HA ))
ASSI { 1133}
( segid " " and resid 323 and name HG1%)
(( segid " " and resid 326 and name HB3 ))
3.200 1.300 1.300 peak 1133 spectrum 1 weight 0.10000E+01 volume 0.23120E-02 ppm1 0.778 ppm2 2.676 CV 1
OR { 1133}
( segid " " and resid 323 and name HG1%)
(( segid " " and resid 368 and name HB3 ))
ASSI { 27}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 221 and name HA ))
2.400 0.700 0.700 peak 27 spectrum 1 weight 0.10000E+01 volume 0.13990E-01 ppm1 1.913 ppm2 3.909 CV 1
OR { 27}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 325 and name HA ))
OR { 27}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 324 and name HA ))
ASSI { 121}
(( segid " " and resid 318 and name HA ))
(( segid " " and resid 322 and name HG13))
5.200 3.400 0.800 peak 121 spectrum 1 weight 0.10000E+01 volume 0.34962E-03 ppm1 3.365 ppm2 0.179 CV 1
OR { 121}
(( segid " " and resid 318 and name HA ))
( segid " " and resid 279 and name HD1%)
ASSI { 518}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 337 and name H ))
2.900 2.900 3.100 peak 518 spectrum 1 weight 0.10000E+01 volume 0.62593E-03 ppm1 0.654 ppm2 7.300 CV 1
OR { 518}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 341 and name HD22))
OR { 518}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 324 and name HE1 ))
ASSI { 897}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 365 and name HA ))
3.500 1.500 1.500 peak 897 spectrum 1 weight 0.10000E+01 volume 0.26560E-02 ppm1 0.436 ppm2 3.825 CV 1
OR { 897}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 320 and name HA ))
OR { 897}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 369 and name HA2 ))
OR { 897}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 372 and name HA ))
ASSI { 102}
( segid " " and resid 240 and name HG2%)
(( segid " " and resid 266 and name HB3 ))
3.600 1.600 1.600 peak 102 spectrum 1 weight 0.10000E+01 volume 0.18496E-02 ppm1 0.769 ppm2 1.529 CV 1
OR { 102}
( segid " " and resid 240 and name HG2%)
(( segid " " and resid 266 and name HB2 ))
OR { 102}
( segid " " and resid 240 and name HG2%)
(( segid " " and resid 244 and name HB3 ))
ASSI { 1573}
(( segid " " and resid 310 and name HB3 ))
(( segid " " and resid 310 and name H ))
4.500 2.500 1.500 peak 1573 spectrum 1 weight 0.10000E+01 volume 0.53853E-03 ppm1 2.047 ppm2 7.051 CV 1
OR { 1573}
(( segid " " and resid 310 and name HB3 ))
( segid " " and resid 315 and name HD% )
ASSI { 568}
( segid " " and resid 278 and name HD2%)
( segid " " and resid 318 and name HD1%)
2.400 0.700 0.700 peak 568 spectrum 1 weight 0.10000E+01 volume 0.12499E-01 ppm1 0.746 ppm2 0.360 CV 1
OR { 568}
( segid " " and resid 278 and name HD2%)
(( segid " " and resid 317 and name HG ))
OR { 568}
( segid " " and resid 278 and name HD2%)
( segid " " and resid 279 and name HD2%)
OR { 568}
( segid " " and resid 278 and name HD2%)
( segid " " and resid 317 and name HD2%)
ASSI { 1368}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 374 and name HA ))
4.800 2.900 1.200 peak 1368 spectrum 1 weight 0.10000E+01 volume 0.77252E-03 ppm1 0.883 ppm2 4.042 CV 1
OR { 1368}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 210 and name HA ))
OR { 1368}
( segid " " and resid 207 and name HD1%)
(( segid " " and resid 319 and name HG ))
ASSI { 3871}
(( segid " " and resid 226 and name HG2 ))
(( segid " " and resid 226 and name HE2 ))
2.500 0.800 0.800 peak 3871 spectrum 1 weight 0.10000E+01 volume 0.10133E-01 ppm1 1.286 ppm2 2.902 CV 1
OR { 3871}
(( segid " " and resid 421 and name HG2 ))
(( segid " " and resid 421 and name HE2 ))
OR { 3871}
(( segid " " and resid 421 and name HG2 ))
(( segid " " and resid 421 and name HE3 ))
OR { 3871}
(( segid " " and resid 226 and name HG2 ))
(( segid " " and resid 226 and name HE3 ))
ASSI { 750}
( segid " " and resid 266 and name HD1%)
(( segid " " and resid 244 and name HA ))
3.100 1.200 1.200 peak 750 spectrum 1 weight 0.10000E+01 volume 0.28167E-02 ppm1 0.890 ppm2 3.267 CV 1
OR { 750}
( segid " " and resid 266 and name HD1%)
(( segid " " and resid 240 and name HA ))
ASSI { 3915}
(( segid " " and resid 189 and name HG12))
( segid " " and resid 189 and name HD1%)
2.000 0.500 0.500 peak 3915 spectrum 1 weight 0.10000E+01 volume 0.13970E-01 ppm1 1.734 ppm2 0.750 CV 1
OR { 3915}
(( segid " " and resid 346 and name HG ))
( segid " " and resid 346 and name HD2%)
ASSI { 205}
( segid " " and resid 359 and name HG1%)
(( segid " " and resid 360 and name HB3 ))
4.200 2.200 1.800 peak 205 spectrum 1 weight 0.10000E+01 volume 0.11701E-02 ppm1 0.894 ppm2 3.091 CV 1
OR { 205}
( segid " " and resid 359 and name HG1%)
(( segid " " and resid 361 and name HB2 ))
ASSI { 1115}
( segid " " and resid 364 and name HG2%)
( segid " " and resid 322 and name HD1%)
3.400 1.400 1.400 peak 1115 spectrum 1 weight 0.10000E+01 volume 0.95018E-03 ppm1 0.905 ppm2 -0.172 CV 1
OR { 1115}
( segid " " and resid 364 and name HG2%)
( segid " " and resid 373 and name HD1%)
ASSI { 290}
(( segid " " and resid 339 and name HB ))
( segid " " and resid 358 and name HD% )
4.400 2.400 1.600 peak 290 spectrum 1 weight 0.10000E+01 volume 0.32142E-03 ppm1 1.538 ppm2 7.037 CV 1
OR { 290}
(( segid " " and resid 339 and name HB ))
( segid " " and resid 361 and name HE% )
ASSI { 1326}
(( segid " " and resid 334 and name HG3 ))
(( segid " " and resid 331 and name HD3 ))
3.000 1.100 1.100 peak 1326 spectrum 1 weight 0.10000E+01 volume 0.44352E-02 ppm1 2.149 ppm2 1.590 CV 1
OR { 1326}
(( segid " " and resid 334 and name HG3 ))
(( segid " " and resid 333 and name HB2 ))
OR { 1326}
(( segid " " and resid 334 and name HG3 ))
(( segid " " and resid 336 and name HD3 ))
ASSI { 1046}
( segid " " and resid 364 and name HG2%)
(( segid " " and resid 368 and name HB3 ))
3.900 1.900 1.900 peak 1046 spectrum 1 weight 0.10000E+01 volume 0.31945E-02 ppm1 0.909 ppm2 2.677 CV 1
OR { 1046}
( segid " " and resid 364 and name HG2%)
(( segid " " and resid 326 and name HB3 ))
ASSI { 341}
( segid " " and resid 211 and name HB% )
(( segid " " and resid 215 and name HG3 ))
3.700 1.700 1.700 peak 341 spectrum 1 weight 0.10000E+01 volume 0.98681E-03 ppm1 1.687 ppm2 2.677 CV 1
OR { 341}
( segid " " and resid 211 and name HB% )
(( segid " " and resid 213 and name HB3 ))
ASSI { 858}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 284 and name HA ))
2.800 1.000 1.000 peak 858 spectrum 1 weight 0.10000E+01 volume 0.60111E-02 ppm1 2.151 ppm2 4.316 CV 1
OR { 858}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 279 and name HA ))
ASSI { 401}
(( segid " " and resid 214 and name HD2 ))
(( segid " " and resid 207 and name H ))
4.400 2.400 1.600 peak 401 spectrum 1 weight 0.10000E+01 volume 0.48212E-03 ppm1 2.970 ppm2 6.856 CV 1
OR { 401}
(( segid " " and resid 214 and name HD2 ))
( segid " " and resid 204 and name HE% )
ASSI { 489}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 442 and name HE3 ))
4.400 2.400 1.600 peak 489 spectrum 1 weight 0.10000E+01 volume 0.10263E-02 ppm1 0.809 ppm2 2.864 CV 1
OR { 489}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 399 and name HE3 ))
OR { 489}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 399 and name HE2 ))
OR { 489}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 442 and name HE2 ))
OR { 489}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 440 and name HE2 ))
ASSI { 4157}
( segid " " and resid 243 and name HD2%)
( segid " " and resid 253 and name HG2%)
2.200 0.600 0.600 peak 4157 spectrum 1 weight 0.10000E+01 volume 0.14926E-01 ppm1 0.166 ppm2 0.609 CV 1
OR { 4157}
( segid " " and resid 243 and name HD2%)
( segid " " and resid 255 and name HD1%)
ASSI { 306}
( segid " " and resid 189 and name HD1%)
(( segid " " and resid 201 and name HA ))
4.300 2.300 1.700 peak 306 spectrum 1 weight 0.10000E+01 volume 0.60619E-03 ppm1 0.736 ppm2 4.892 CV 1
OR { 306}
( segid " " and resid 189 and name HD1%)
(( segid " " and resid 192 and name HA ))
ASSI { 502}
( segid " " and resid 377 and name HE% )
( segid " " and resid 408 and name HD2%)
3.100 1.200 1.200 peak 502 spectrum 1 weight 0.10000E+01 volume 0.38683E-02 ppm1 1.993 ppm2 0.883 CV 1
OR { 502}
( segid " " and resid 377 and name HE% )
( segid " " and resid 435 and name HG2%)
OR { 502}
( segid " " and resid 377 and name HE% )
( segid " " and resid 436 and name HD2%)
OR { 502}
( segid " " and resid 377 and name HE% )
( segid " " and resid 439 and name HD2%)
ASSI { 2323}
( segid " " and resid 297 and name HG2%)
(( segid " " and resid 297 and name HB ))
1.900 0.400 0.400 peak 2323 spectrum 1 weight 0.10000E+01 volume 0.27820E-01 ppm1 1.113 ppm2 3.975 CV 1
OR { 2323}
( segid " " and resid 387 and name HG2%)
(( segid " " and resid 387 and name HB ))
ASSI { 256}
(( segid " " and resid 307 and name HG ))
( segid " " and resid 315 and name HD% )
3.700 1.700 1.700 peak 256 spectrum 1 weight 0.10000E+01 volume 0.76410E-03 ppm1 2.319 ppm2 7.082 CV 1
OR { 256}
(( segid " " and resid 307 and name HG ))
(( segid " " and resid 308 and name H ))
OR { 256}
(( segid " " and resid 307 and name HG ))
(( segid " " and resid 310 and name H ))
OR { 256}
(( segid " " and resid 307 and name HG ))
( segid " " and resid 360 and name HE% )
ASSI { 1557}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 317 and name HB3 ))
3.700 1.700 1.700 peak 1557 spectrum 1 weight 0.10000E+01 volume 0.13787E-02 ppm1 0.551 ppm2 1.131 CV 1
OR { 1557}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 274 and name HB2 ))
OR { 1557}
( segid " " and resid 194 and name HD2%)
( segid " " and resid 280 and name HG2%)
OR { 1557}
( segid " " and resid 194 and name HD2%)
( segid " " and resid 310 and name HD1%)
ASSI { 1109}
(( segid " " and resid 360 and name HZ ))
( segid " " and resid 307 and name HD1%)
3.000 3.000 3.000 peak 1109 spectrum 1 weight 0.10000E+01 volume 0.51315E-03 ppm1 6.587 ppm2 1.208 CV 1
OR { 1109}
(( segid " " and resid 360 and name HZ ))
(( segid " " and resid 278 and name HB2 ))
ASSI { 613}
(( segid " " and resid 239 and name HD3 ))
( segid " " and resid 258 and name HD% )
3.100 1.200 1.200 peak 613 spectrum 1 weight 0.10000E+01 volume 0.15733E-02 ppm1 1.687 ppm2 7.086 CV 1
OR { 613}
(( segid " " and resid 239 and name HD3 ))
(( segid " " and resid 239 and name H ))
ASSI { 1440}
(( segid " " and resid 364 and name HA ))
( segid " " and resid 322 and name HG2%)
4.800 2.900 1.200 peak 1440 spectrum 1 weight 0.10000E+01 volume 0.65696E-03 ppm1 3.654 ppm2 0.394 CV 1
OR { 1440}
(( segid " " and resid 364 and name HA ))
( segid " " and resid 323 and name HG2%)
ASSI { 2123}
(( segid " " and resid 410 and name HB3 ))
(( segid " " and resid 410 and name HA ))
2.900 1.000 1.000 peak 2123 spectrum 1 weight 0.10000E+01 volume 0.32706E-02 ppm1 2.685 ppm2 4.333 CV 1
OR { 2123}
(( segid " " and resid 410 and name HB3 ))
(( segid " " and resid 407 and name HA ))
ASSI { 1122}
(( segid " " and resid 351 and name HG3 ))
(( segid " " and resid 348 and name HA ))
4.100 2.100 1.900 peak 1122 spectrum 1 weight 0.10000E+01 volume 0.68230E-03 ppm1 2.065 ppm2 4.560 CV 1
OR { 1122}
(( segid " " and resid 351 and name HG3 ))
(( segid " " and resid 350 and name HA ))
OR { 1122}
(( segid " " and resid 351 and name HG3 ))
(( segid " " and resid 277 and name HA ))
ASSI { 1438}
(( segid " " and resid 217 and name HA ))
( segid " " and resid 267 and name HD1%)
4.600 2.700 1.400 peak 1438 spectrum 1 weight 0.10000E+01 volume 0.74435E-03 ppm1 2.993 ppm2 0.895 CV 1
OR { 1438}
(( segid " " and resid 217 and name HA ))
( segid " " and resid 267 and name HD2%)
OR { 1438}
(( segid " " and resid 217 and name HA ))
( segid " " and resid 325 and name HE% )
OR { 1438}
(( segid " " and resid 217 and name HA ))
( segid " " and resid 321 and name HD1%)
ASSI { 460}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 392 and name HD2 ))
4.000 2.000 2.000 peak 460 spectrum 1 weight 0.10000E+01 volume 0.62593E-03 ppm1 0.557 ppm2 3.146 CV 1
OR { 460}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 444 and name HD3 ))
OR { 460}
( segid " " and resid 398 and name HD1%)
(( segid " " and resid 444 and name HD2 ))
ASSI { 852}
( segid " " and resid 220 and name HG2%)
( segid " " and resid 225 and name HE% )
2.900 1.100 1.100 peak 852 spectrum 1 weight 0.10000E+01 volume 0.59942E-02 ppm1 1.124 ppm2 1.915 CV 1
OR { 852}
( segid " " and resid 280 and name HG2%)
(( segid " " and resid 282 and name HB2 ))
OR { 852}
( segid " " and resid 220 and name HG1%)
( segid " " and resid 225 and name HE% )
OR { 852}
( segid " " and resid 220 and name HG2%)
(( segid " " and resid 221 and name HB3 ))
OR { 852}
( segid " " and resid 280 and name HG2%)
(( segid " " and resid 277 and name HB3 ))
OR { 852}
( segid " " and resid 220 and name HG1%)
(( segid " " and resid 221 and name HB3 ))
OR { 852}
( segid " " and resid 280 and name HG2%)
(( segid " " and resid 281 and name HB3 ))
ASSI { 1391}
(( segid " " and resid 285 and name HA ))
(( segid " " and resid 286 and name H ))
3.800 1.800 1.800 peak 1391 spectrum 1 weight 0.10000E+01 volume 0.53007E-03 ppm1 4.348 ppm2 7.466 CV 1
OR { 1391}
(( segid " " and resid 285 and name HA ))
(( segid " " and resid 288 and name H ))
ASSI { 945}
(( segid " " and resid 246 and name HA ))
(( segid " " and resid 251 and name HB2 ))
3.900 1.900 1.900 peak 945 spectrum 1 weight 0.10000E+01 volume 0.86842E-03 ppm1 3.842 ppm2 1.738 CV 1
OR { 945}
(( segid " " and resid 246 and name HA ))
(( segid " " and resid 249 and name HB3 ))
OR { 945}
(( segid " " and resid 246 and name HA ))
(( segid " " and resid 249 and name HG3 ))
ASSI { 465}
(( segid " " and resid 336 and name HD2 ))
(( segid " " and resid 335 and name HA ))
5.100 3.200 0.900 peak 465 spectrum 1 weight 0.10000E+01 volume 0.50187E-03 ppm1 1.461 ppm2 4.176 CV 1
OR { 465}
(( segid " " and resid 336 and name HD2 ))
(( segid " " and resid 335 and name HB ))
OR { 465}
(( segid " " and resid 336 and name HD2 ))
(( segid " " and resid 332 and name HA ))
ASSI { 116}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 414 and name H ))
3.900 1.900 1.900 peak 116 spectrum 1 weight 0.10000E+01 volume 0.22838E-02 ppm1 0.780 ppm2 7.652 CV 1
OR { 116}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 413 and name HE1 ))
ASSI { 645}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 402 and name HB ))
2.500 0.800 0.800 peak 645 spectrum 1 weight 0.10000E+01 volume 0.58983E-02 ppm1 0.703 ppm2 1.927 CV 1
OR { 645}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 439 and name HB3 ))
OR { 645}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 439 and name HG ))
ASSI { 1444}
( segid " " and resid 278 and name HD1%)
( segid " " and resid 317 and name HD1%)
3.100 1.200 1.200 peak 1444 spectrum 1 weight 0.10000E+01 volume 0.81737E-02 ppm1 0.658 ppm2 0.167 CV 1
OR { 1444}
( segid " " and resid 278 and name HD1%)
( segid " " and resid 279 and name HD1%)
OR { 1444}
( segid " " and resid 321 and name HD2%)
(( segid " " and resid 322 and name HG13))
OR { 1444}
( segid " " and resid 321 and name HD2%)
( segid " " and resid 279 and name HD1%)
ASSI { 227}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 393 and name HA ))
5.100 3.300 0.900 peak 227 spectrum 1 weight 0.10000E+01 volume 0.52161E-03 ppm1 0.806 ppm2 4.272 CV 1
OR { 227}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 444 and name HA ))
OR { 227}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 445 and name HA ))
ASSI { 1033}
( segid " " and resid 247 and name HD% )
( segid " " and resid 246 and name HB% )
4.000 2.000 2.000 peak 1033 spectrum 1 weight 0.10000E+01 volume 0.49340E-03 ppm1 7.323 ppm2 1.194 CV 1
OR { 1033}
( segid " " and resid 247 and name HD% )
(( segid " " and resid 212 and name HB ))
OR { 1033}
( segid " " and resid 247 and name HD% )
(( segid " " and resid 243 and name HB3 ))
ASSI { 849}
(( segid " " and resid 443 and name HA ))
(( segid " " and resid 443 and name HB2 ))
2.600 0.900 0.900 peak 849 spectrum 1 weight 0.10000E+01 volume 0.36454E-02 ppm1 4.141 ppm2 1.645 CV 1
OR { 849}
(( segid " " and resid 443 and name HA ))
(( segid " " and resid 443 and name HB3 ))
OR { 849}
(( segid " " and resid 443 and name HA ))
(( segid " " and resid 443 and name HG ))
OR { 849}
(( segid " " and resid 443 and name HA ))
(( segid " " and resid 444 and name HG2 ))
ASSI { 501}
(( segid " " and resid 365 and name HG2 ))
( segid " " and resid 323 and name HG2%)
4.900 3.000 1.100 peak 501 spectrum 1 weight 0.10000E+01 volume 0.86278E-03 ppm1 2.348 ppm2 0.401 CV 1
OR { 501}
(( segid " " and resid 365 and name HG3 ))
( segid " " and resid 323 and name HG2%)
OR { 501}
(( segid " " and resid 365 and name HG2 ))
( segid " " and resid 371 and name HG1%)
ASSI { 410}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 231 and name HB2 ))
4.400 2.500 1.600 peak 410 spectrum 1 weight 0.10000E+01 volume 0.91069E-03 ppm1 0.515 ppm2 2.802 CV 1
OR { 410}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 231 and name HB3 ))
OR { 410}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 341 and name HB3 ))
OR { 410}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 341 and name HB2 ))
ASSI { 101}
( segid " " and resid 436 and name HD2%)
(( segid " " and resid 409 and name H ))
3.500 1.500 1.500 peak 101 spectrum 1 weight 0.10000E+01 volume 0.12603E-02 ppm1 0.856 ppm2 8.730 CV 1
OR { 101}
( segid " " and resid 436 and name HD2%)
(( segid " " and resid 439 and name H ))
ASSI { 726}
(( segid " " and resid 191 and name HA3 ))
(( segid " " and resid 190 and name HB3 ))
4.900 3.000 1.100 peak 726 spectrum 1 weight 0.10000E+01 volume 0.36370E-03 ppm1 4.217 ppm2 3.091 CV 1
OR { 726}
(( segid " " and resid 191 and name HA3 ))
(( segid " " and resid 275 and name HD3 ))
ASSI { 1451}
( segid " " and resid 255 and name HD1%)
(( segid " " and resid 256 and name H ))
4.400 2.400 1.600 peak 1451 spectrum 1 weight 0.10000E+01 volume 0.10658E-02 ppm1 0.603 ppm2 8.232 CV 1
OR { 1451}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 208 and name H ))
OR { 1451}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 202 and name H ))
OR { 1451}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 203 and name H ))
ASSI { 1102}
( segid " " and resid 377 and name HE% )
(( segid " " and resid 378 and name HA ))
3.300 3.300 2.700 peak 1102 spectrum 1 weight 0.10000E+01 volume 0.59773E-03 ppm1 1.994 ppm2 4.390 CV 1
OR { 1102}
( segid " " and resid 377 and name HE% )
(( segid " " and resid 379 and name HA ))
OR { 1102}
( segid " " and resid 377 and name HE% )
(( segid " " and resid 410 and name HA ))
OR { 1102}
( segid " " and resid 377 and name HE% )
(( segid " " and resid 430 and name HA ))
ASSI { 3839}
(( segid " " and resid 270 and name HA ))
(( segid " " and resid 273 and name HB2 ))
3.800 1.800 1.800 peak 3839 spectrum 1 weight 0.10000E+01 volume 0.42575E-03 ppm1 3.674 ppm2 2.623 CV 1
OR { 3839}
(( segid " " and resid 270 and name HA ))
(( segid " " and resid 270 and name HB3 ))
ASSI { 203}
( segid " " and resid 209 and name HD1%)
( segid " " and resid 317 and name HD2%)
3.500 1.600 1.600 peak 203 spectrum 1 weight 0.10000E+01 volume 0.30563E-02 ppm1 0.190 ppm2 0.363 CV 1
OR { 203}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 317 and name HG ))
OR { 203}
( segid " " and resid 209 and name HD1%)
( segid " " and resid 318 and name HG2%)
ASSI { 1251}
(( segid " " and resid 210 and name HD2 ))
( segid " " and resid 209 and name HD1%)
3.700 1.700 1.700 peak 1251 spectrum 1 weight 0.10000E+01 volume 0.35244E-03 ppm1 3.331 ppm2 0.188 CV 1
OR { 1251}
(( segid " " and resid 210 and name HD2 ))
( segid " " and resid 317 and name HD1%)
ASSI { 1075}
( segid " " and resid 243 and name HD1%)
( segid " " and resid 266 and name HD2%)
2.600 0.900 0.900 peak 1075 spectrum 1 weight 0.10000E+01 volume 0.81032E-02 ppm1 0.013 ppm2 0.801 CV 1
OR { 1075}
( segid " " and resid 243 and name HD1%)
( segid " " and resid 240 and name HG2%)
OR { 1075}
( segid " " and resid 243 and name HD1%)
( segid " " and resid 263 and name HG2%)
ASSI { 3968}
( segid " " and resid 310 and name HD2%)
(( segid " " and resid 310 and name H ))
3.100 1.200 1.200 peak 3968 spectrum 1 weight 0.10000E+01 volume 0.35668E-02 ppm1 1.088 ppm2 7.058 CV 1
OR { 3968}
( segid " " and resid 310 and name HD2%)
( segid " " and resid 315 and name HD% )
ASSI { 715}
( segid " " and resid 429 and name HD2%)
(( segid " " and resid 426 and name HG2 ))
3.100 1.200 1.200 peak 715 spectrum 1 weight 0.10000E+01 volume 0.44521E-02 ppm1 0.642 ppm2 2.214 CV 1
OR { 715}
( segid " " and resid 429 and name HD2%)
(( segid " " and resid 433 and name HG2 ))
OR { 715}
( segid " " and resid 429 and name HD2%)
(( segid " " and resid 433 and name HB3 ))
ASSI { 805}
( segid " " and resid 201 and name HG2%)
(( segid " " and resid 197 and name HA ))
3.900 1.900 1.900 peak 805 spectrum 1 weight 0.10000E+01 volume 0.10235E-02 ppm1 1.296 ppm2 3.863 CV 1
OR { 805}
( segid " " and resid 201 and name HG2%)
(( segid " " and resid 211 and name HA ))
OR { 805}
( segid " " and resid 201 and name HG2%)
(( segid " " and resid 199 and name HA ))
ASSI { 2629}
(( segid " " and resid 258 and name HA ))
(( segid " " and resid 258 and name HB3 ))
3.600 1.600 1.600 peak 2629 spectrum 1 weight 0.10000E+01 volume 0.67666E-03 ppm1 4.412 ppm2 2.676 CV 1
OR { 2629}
(( segid " " and resid 258 and name HA ))
(( segid " " and resid 258 and name HB2 ))
OR { 2629}
(( segid " " and resid 326 and name HA ))
(( segid " " and resid 326 and name HB3 ))
ASSI { 1524}
(( segid " " and resid 348 and name HG3 ))
(( segid " " and resid 272 and name HD3 ))
4.100 2.100 1.900 peak 1524 spectrum 1 weight 0.10000E+01 volume 0.11729E-02 ppm1 1.944 ppm2 3.191 CV 1
OR { 1524}
(( segid " " and resid 348 and name HG3 ))
(( segid " " and resid 268 and name HE2 ))
OR { 1524}
(( segid " " and resid 348 and name HG3 ))
(( segid " " and resid 272 and name HD2 ))
OR { 1524}
(( segid " " and resid 340 and name HB2 ))
(( segid " " and resid 232 and name HD2 ))
ASSI { 690}
( segid " " and resid 345 and name HG2%)
(( segid " " and resid 232 and name HA ))
2.600 2.600 3.400 peak 690 spectrum 1 weight 0.10000E+01 volume 0.26729E-02 ppm1 0.918 ppm2 4.427 CV 1
OR { 690}
( segid " " and resid 345 and name HG2%)
(( segid " " and resid 341 and name HA ))
OR { 690}
( segid " " and resid 345 and name HG2%)
(( segid " " and resid 349 and name HB ))
OR { 690}
( segid " " and resid 345 and name HG2%)
(( segid " " and resid 326 and name HA ))
ASSI { 842}
(( segid " " and resid 320 and name HZ3 ))
( segid " " and resid 207 and name HD1%)
4.500 2.500 1.500 peak 842 spectrum 1 weight 0.10000E+01 volume 0.39754E-03 ppm1 7.045 ppm2 0.892 CV 1
OR { 842}
(( segid " " and resid 320 and name HZ3 ))
( segid " " and resid 376 and name HG2%)
ASSI { 393}
( segid " " and resid 279 and name HD1%)
( segid " " and resid 278 and name HD2%)
3.700 1.700 1.700 peak 393 spectrum 1 weight 0.10000E+01 volume 0.31860E-02 ppm1 0.167 ppm2 0.735 CV 1
OR { 393}
( segid " " and resid 279 and name HD1%)
( segid " " and resid 350 and name HG1%)
OR { 393}
( segid " " and resid 279 and name HD1%)
( segid " " and resid 356 and name HG1%)
OR { 393}
( segid " " and resid 279 and name HD1%)
( segid " " and resid 350 and name HG2%)
OR { 393}
( segid " " and resid 279 and name HD1%)
( segid " " and resid 367 and name HD2%)
OR { 393}
( segid " " and resid 279 and name HD1%)
( segid " " and resid 283 and name HD1%)
ASSI { 677}
( segid " " and resid 315 and name HD% )
( segid " " and resid 310 and name HD1%)
3.300 1.300 1.300 peak 677 spectrum 1 weight 0.10000E+01 volume 0.30112E-02 ppm1 7.031 ppm2 1.062 CV 1
OR { 677}
( segid " " and resid 315 and name HD% )
( segid " " and resid 307 and name HD2%)
ASSI { 1354}
(( segid " " and resid 345 and name HB ))
( segid " " and resid 342 and name HD1%)
4.400 2.400 1.600 peak 1354 spectrum 1 weight 0.10000E+01 volume 0.17424E-02 ppm1 2.139 ppm2 0.671 CV 1
OR { 1354}
(( segid " " and resid 345 and name HB ))
( segid " " and resid 357 and name HD1%)
ASSI { 2472}
( segid " " and resid 439 and name HD2%)
(( segid " " and resid 439 and name HG ))
2.000 0.500 0.500 peak 2472 spectrum 1 weight 0.10000E+01 volume 0.19116E-01 ppm1 0.884 ppm2 1.915 CV 1
OR { 2472}
( segid " " and resid 439 and name HD2%)
(( segid " " and resid 439 and name HB3 ))
OR { 2472}
( segid " " and resid 408 and name HD2%)
(( segid " " and resid 408 and name HB2 ))
ASSI { 1221}
(( segid " " and resid 278 and name HA ))
( segid " " and resid 279 and name HD2%)
4.300 2.300 1.700 peak 1221 spectrum 1 weight 0.10000E+01 volume 0.94454E-03 ppm1 3.811 ppm2 0.369 CV 1
OR { 1221}
(( segid " " and resid 278 and name HA ))
( segid " " and resid 318 and name HD1%)
OR { 1221}
(( segid " " and resid 278 and name HA ))
( segid " " and resid 318 and name HG2%)
OR { 1221}
(( segid " " and resid 278 and name HA ))
( segid " " and resid 317 and name HD2%)
ASSI { 444}
(( segid " " and resid 406 and name HG2 ))
( segid " " and resid 402 and name HG2%)
3.600 1.600 1.600 peak 444 spectrum 1 weight 0.10000E+01 volume 0.21795E-02 ppm1 2.582 ppm2 0.774 CV 1
OR { 444}
(( segid " " and resid 406 and name HG2 ))
( segid " " and resid 409 and name HD2%)
OR { 444}
(( segid " " and resid 406 and name HG2 ))
( segid " " and resid 409 and name HD1%)
ASSI { 1121}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 189 and name HB ))
4.800 2.800 1.200 peak 1121 spectrum 1 weight 0.10000E+01 volume 0.75564E-03 ppm1 -0.168 ppm2 2.213 CV 1
OR { 1121}
( segid " " and resid 212 and name HG2%)
( segid " " and resid 203 and name HE% )
OR { 1121}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 269 and name HB2 ))
OR { 1121}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 271 and name HG ))
ASSI { 156}
(( segid " " and resid 314 and name HA ))
( segid " " and resid 317 and name HD2%)
4.000 2.000 2.000 peak 156 spectrum 1 weight 0.10000E+01 volume 0.11926E-02 ppm1 3.861 ppm2 0.372 CV 1
OR { 156}
(( segid " " and resid 314 and name HA ))
( segid " " and resid 318 and name HG2%)
OR { 156}
(( segid " " and resid 314 and name HA ))
(( segid " " and resid 317 and name HG ))
ASSI { 2633}
( segid " " and resid 231 and name HD% )
( segid " " and resid 342 and name HD1%)
4.300 2.300 1.700 peak 2633 spectrum 1 weight 0.10000E+01 volume 0.54981E-03 ppm1 6.761 ppm2 0.660 CV 1
OR { 2633}
( segid " " and resid 231 and name HD% )
( segid " " and resid 230 and name HD1%)
ASSI { 268}
( segid " " and resid 266 and name HD2%)
(( segid " " and resid 240 and name HA ))
3.200 1.300 1.300 peak 268 spectrum 1 weight 0.10000E+01 volume 0.13872E-02 ppm1 0.820 ppm2 3.291 CV 1
OR { 268}
( segid " " and resid 266 and name HD2%)
(( segid " " and resid 244 and name HA ))
ASSI { 1591}
( segid " " and resid 245 and name HB% )
(( segid " " and resid 242 and name HG2 ))
2.400 2.400 3.600 peak 1591 spectrum 1 weight 0.10000E+01 volume 0.33129E-02 ppm1 1.330 ppm2 2.217 CV 1
OR { 1591}
( segid " " and resid 245 and name HB% )
(( segid " " and resid 242 and name HB3 ))
OR { 1591}
( segid " " and resid 245 and name HB% )
(( segid " " and resid 242 and name HB2 ))
OR { 1591}
( segid " " and resid 245 and name HB% )
(( segid " " and resid 251 and name HG2 ))
OR { 1591}
( segid " " and resid 245 and name HB% )
(( segid " " and resid 189 and name HB ))
ASSI { 245}
(( segid " " and resid 214 and name HD2 ))
(( segid " " and resid 211 and name HA ))
3.700 1.700 1.700 peak 245 spectrum 1 weight 0.10000E+01 volume 0.18327E-02 ppm1 2.968 ppm2 3.875 CV 1
OR { 245}
(( segid " " and resid 378 and name HE2 ))
(( segid " " and resid 379 and name HD3 ))
OR { 245}
(( segid " " and resid 378 and name HE3 ))
(( segid " " and resid 379 and name HD3 ))
OR { 245}
(( segid " " and resid 214 and name HD2 ))
(( segid " " and resid 215 and name HA ))
ASSI { 548}
( segid " " and resid 243 and name HD2%)
(( segid " " and resid 246 and name H ))
4.500 2.600 1.500 peak 548 spectrum 1 weight 0.10000E+01 volume 0.98117E-03 ppm1 0.169 ppm2 7.451 CV 1
OR { 548}
( segid " " and resid 243 and name HD2%)
(( segid " " and resid 257 and name H ))
ASSI { 1268}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 321 and name HG ))
3.300 1.300 1.300 peak 1268 spectrum 1 weight 0.10000E+01 volume 0.12603E-02 ppm1 -0.166 ppm2 1.714 CV 1
OR { 1268}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 346 and name HG ))
OR { 1268}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 325 and name HB2 ))
OR { 1268}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 346 and name HB2 ))
OR { 1268}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 323 and name HB ))
ASSI { 1335}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 405 and name H ))
4.800 2.900 1.200 peak 1335 spectrum 1 weight 0.10000E+01 volume 0.60337E-03 ppm1 0.770 ppm2 8.388 CV 1
OR { 1335}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 440 and name H ))
ASSI { 3251}
(( segid " " and resid 304 and name HG3 ))
( segid " " and resid 300 and name HG1%)
5.500 3.700 0.500 peak 3251 spectrum 1 weight 0.10000E+01 volume 0.82329E-03 ppm1 2.290 ppm2 0.070 CV 1
OR { 3251}
(( segid " " and resid 301 and name HG3 ))
( segid " " and resid 300 and name HG1%)
ASSI { 927}
( segid " " and resid 217 and name HD1%)
( segid " " and resid 213 and name HE% )
2.700 0.900 0.900 peak 927 spectrum 1 weight 0.10000E+01 volume 0.52443E-02 ppm1 -0.047 ppm2 7.145 CV 1
OR { 927}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 214 and name H ))
OR { 927}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 324 and name HD2 ))
ASSI { 417}
( segid " " and resid 357 and name HD2%)
( segid " " and resid 360 and name HD% )
3.300 1.400 1.400 peak 417 spectrum 1 weight 0.10000E+01 volume 0.27377E-02 ppm1 0.870 ppm2 7.059 CV 1
OR { 417}
( segid " " and resid 357 and name HD2%)
(( segid " " and resid 352 and name H ))
OR { 417}
( segid " " and resid 357 and name HD2%)
( segid " " and resid 360 and name HE% )
OR { 417}
( segid " " and resid 357 and name HD2%)
( segid " " and resid 361 and name HE% )
ASSI { 188}
(( segid " " and resid 198 and name HA ))
(( segid " " and resid 201 and name H ))
4.000 2.000 2.000 peak 188 spectrum 1 weight 0.10000E+01 volume 0.45395E-03 ppm1 2.896 ppm2 7.480 CV 1
OR { 188}
(( segid " " and resid 198 and name HA ))
(( segid " " and resid 211 and name H ))
OR { 188}
(( segid " " and resid 300 and name HA ))
(( segid " " and resid 299 and name H ))
ASSI { 601}
(( segid " " and resid 305 and name HD3 ))
(( segid " " and resid 309 and name H ))
3.600 1.600 1.600 peak 601 spectrum 1 weight 0.10000E+01 volume 0.21626E-02 ppm1 3.033 ppm2 7.454 CV 1
OR { 601}
(( segid " " and resid 305 and name HD3 ))
(( segid " " and resid 305 and name H ))
ASSI { 125}
(( segid " " and resid 311 and name HA ))
( segid " " and resid 310 and name HD2%)
5.500 3.800 0.500 peak 125 spectrum 1 weight 0.10000E+01 volume 0.39754E-03 ppm1 4.452 ppm2 1.124 CV 1
OR { 125}
(( segid " " and resid 311 and name HA ))
( segid " " and resid 310 and name HD1%)
OR { 125}
(( segid " " and resid 311 and name HA ))
( segid " " and resid 280 and name HG2%)
ASSI { 834}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 350 and name HA ))
4.000 2.000 2.000 peak 834 spectrum 1 weight 0.10000E+01 volume 0.16550E-02 ppm1 2.151 ppm2 4.507 CV 1
OR { 834}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 277 and name HA ))
ASSI { 372}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 363 and name H ))
4.800 2.900 1.200 peak 372 spectrum 1 weight 0.10000E+01 volume 0.43703E-03 ppm1 0.077 ppm2 7.297 CV 1
OR { 372}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 298 and name H ))
ASSI { 707}
( segid " " and resid 307 and name HD1%)
( segid " " and resid 318 and name HG2%)
2.500 0.800 0.800 peak 707 spectrum 1 weight 0.10000E+01 volume 0.75705E-02 ppm1 1.210 ppm2 0.361 CV 1
OR { 707}
( segid " " and resid 307 and name HD1%)
( segid " " and resid 318 and name HD1%)
OR { 707}
( segid " " and resid 307 and name HD1%)
( segid " " and resid 279 and name HD2%)
ASSI { 239}
(( segid " " and resid 281 and name HA ))
(( segid " " and resid 281 and name HB3 ))
2.000 0.500 0.500 peak 239 spectrum 1 weight 0.10000E+01 volume 0.12550E-01 ppm1 3.980 ppm2 1.894 CV 1
OR { 239}
(( segid " " and resid 301 and name HA ))
(( segid " " and resid 301 and name HB3 ))
OR { 239}
(( segid " " and resid 301 and name HA ))
(( segid " " and resid 304 and name HB3 ))
OR { 239}
(( segid " " and resid 301 and name HA ))
(( segid " " and resid 302 and name HB2 ))
ASSI { 719}
( segid " " and resid 236 and name HG2%)
(( segid " " and resid 240 and name H ))
4.000 2.000 2.000 peak 719 spectrum 1 weight 0.10000E+01 volume 0.16861E-02 ppm1 0.960 ppm2 8.010 CV 1
OR { 719}
( segid " " and resid 264 and name HB% )
(( segid " " and resid 267 and name H ))
ASSI { 1644}
(( segid " " and resid 232 and name HB2 ))
( segid " " and resid 345 and name HG1%)
4.000 2.000 2.000 peak 1644 spectrum 1 weight 0.10000E+01 volume 0.12406E-02 ppm1 1.505 ppm2 0.959 CV 1
OR { 1644}
(( segid " " and resid 232 and name HB2 ))
( segid " " and resid 233 and name HG2%)
OR { 1644}
(( segid " " and resid 232 and name HB2 ))
( segid " " and resid 230 and name HG2%)
OR { 1644}
(( segid " " and resid 232 and name HB2 ))
( segid " " and resid 345 and name HG2%)
ASSI { 775}
(( segid " " and resid 327 and name HB3 ))
(( segid " " and resid 331 and name HG2 ))
3.400 1.500 1.500 peak 775 spectrum 1 weight 0.10000E+01 volume 0.18580E-02 ppm1 3.131 ppm2 1.576 CV 1
OR { 775}
(( segid " " and resid 327 and name HB3 ))
( segid " " and resid 330 and name HB% )
OR { 775}
(( segid " " and resid 327 and name HB2 ))
(( segid " " and resid 331 and name HG2 ))
OR { 775}
(( segid " " and resid 327 and name HB2 ))
( segid " " and resid 330 and name HB% )
ASSI { 426}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 347 and name H ))
4.500 2.500 1.500 peak 426 spectrum 1 weight 0.10000E+01 volume 0.86278E-03 ppm1 0.730 ppm2 8.990 CV 1
OR { 426}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 353 and name H ))
OR { 426}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 346 and name H ))
ASSI { 554}
( segid " " and resid 315 and name HD% )
(( segid " " and resid 307 and name HG ))
3.700 1.700 1.700 peak 554 spectrum 1 weight 0.10000E+01 volume 0.61183E-03 ppm1 7.026 ppm2 2.308 CV 1
OR { 554}
( segid " " and resid 315 and name HD% )
(( segid " " and resid 319 and name HA ))
ASSI { 66}
(( segid " " and resid 286 and name HA ))
(( segid " " and resid 289 and name H ))
3.400 1.400 1.400 peak 66 spectrum 1 weight 0.10000E+01 volume 0.10517E-02 ppm1 4.115 ppm2 7.987 CV 1
OR { 66}
(( segid " " and resid 286 and name HA ))
(( segid " " and resid 287 and name H ))
ASSI { 1381}
( segid " " and resid 357 and name HD1%)
(( segid " " and resid 360 and name HB2 ))
4.600 2.600 1.400 peak 1381 spectrum 1 weight 0.10000E+01 volume 0.44831E-03 ppm1 0.680 ppm2 2.754 CV 1
OR { 1381}
( segid " " and resid 357 and name HD1%)
(( segid " " and resid 325 and name HG3 ))
ASSI { 225}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 286 and name HA ))
3.900 1.900 1.900 peak 225 spectrum 1 weight 0.10000E+01 volume 0.64567E-03 ppm1 -0.354 ppm2 4.117 CV 1
OR { 225}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 307 and name HA ))
ASSI { 833}
(( segid " " and resid 410 and name HB3 ))
( segid " " and resid 407 and name HD% )
5.200 3.300 0.800 peak 833 spectrum 1 weight 0.10000E+01 volume 0.52725E-03 ppm1 2.684 ppm2 7.322 CV 1
OR { 833}
(( segid " " and resid 354 and name HB3 ))
(( segid " " and resid 356 and name H ))
ASSI { 1092}
(( segid " " and resid 349 and name HA ))
(( segid " " and resid 348 and name HB2 ))
3.200 1.300 1.300 peak 1092 spectrum 1 weight 0.10000E+01 volume 0.93043E-03 ppm1 3.942 ppm2 1.942 CV 1
OR { 1092}
(( segid " " and resid 349 and name HA ))
(( segid " " and resid 272 and name HB3 ))
ASSI { 1017}
(( segid " " and resid 420 and name HA ))
(( segid " " and resid 421 and name HA ))
4.400 2.500 1.600 peak 1017 spectrum 1 weight 0.10000E+01 volume 0.95300E-03 ppm1 3.978 ppm2 4.289 CV 1
OR { 1017}
(( segid " " and resid 420 and name HA ))
(( segid " " and resid 416 and name HA ))
ASSI { 738}
(( segid " " and resid 360 and name HZ ))
( segid " " and resid 279 and name HD2%)
2.900 1.000 1.000 peak 738 spectrum 1 weight 0.10000E+01 volume 0.16832E-02 ppm1 6.605 ppm2 0.372 CV 1
OR { 738}
(( segid " " and resid 360 and name HZ ))
( segid " " and resid 318 and name HD1%)
ASSI { 2295}
(( segid " " and resid 301 and name HG3 ))
( segid " " and resid 300 and name HG2%)
3.700 1.800 1.800 peak 2295 spectrum 1 weight 0.10000E+01 volume 0.31945E-02 ppm1 2.296 ppm2 0.535 CV 1
OR { 2295}
(( segid " " and resid 304 and name HG3 ))
( segid " " and resid 300 and name HG2%)
ASSI { 574}
(( segid " " and resid 346 and name HB2 ))
(( segid " " and resid 345 and name H ))
4.700 2.800 1.300 peak 574 spectrum 1 weight 0.10000E+01 volume 0.44831E-03 ppm1 1.702 ppm2 7.034 CV 1
OR { 574}
(( segid " " and resid 346 and name HB2 ))
( segid " " and resid 361 and name HE% )
OR { 574}
(( segid " " and resid 346 and name HB2 ))
( segid " " and resid 360 and name HD% )
OR { 574}
(( segid " " and resid 346 and name HB2 ))
(( segid " " and resid 352 and name H ))
ASSI { 172}
( segid " " and resid 278 and name HD1%)
(( segid " " and resid 280 and name H ))
3.200 1.200 1.200 peak 172 spectrum 1 weight 0.10000E+01 volume 0.31465E-02 ppm1 0.644 ppm2 7.648 CV 1
OR { 172}
( segid " " and resid 278 and name HD1%)
(( segid " " and resid 277 and name HD21))
OR { 172}
( segid " " and resid 278 and name HD1%)
(( segid " " and resid 350 and name H ))
ASSI { 4166}
(( segid " " and resid 310 and name HB3 ))
(( segid " " and resid 310 and name HB2 ))
2.100 0.600 0.600 peak 4166 spectrum 1 weight 0.10000E+01 volume 0.10630E-02 ppm1 2.024 ppm2 1.420 CV 1
OR { 4166}
(( segid " " and resid 436 and name HB3 ))
(( segid " " and resid 436 and name HB2 ))
ASSI { 1641}
( segid " " and resid 212 and name HG1%)
(( segid " " and resid 267 and name HA ))
4.900 3.000 1.100 peak 1641 spectrum 1 weight 0.10000E+01 volume 0.31014E-03 ppm1 -0.350 ppm2 4.037 CV 1
OR { 1641}
( segid " " and resid 212 and name HG1%)
(( segid " " and resid 210 and name HA ))
OR { 1641}
( segid " " and resid 212 and name HG1%)
(( segid " " and resid 266 and name HA ))
ASSI { 550}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 274 and name HB3 ))
4.300 2.300 1.700 peak 550 spectrum 1 weight 0.10000E+01 volume 0.11926E-02 ppm1 1.459 ppm2 1.866 CV 1
OR { 550}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 199 and name HB2 ))
OR { 550}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 193 and name HG3 ))
OR { 550}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 276 and name HB3 ))
OR { 550}
( segid " " and resid 197 and name HB% )
( segid " " and resid 202 and name HE% )
OR { 550}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 276 and name HB2 ))
ASSI { 2675}
(( segid " " and resid 305 and name HB2 ))
(( segid " " and resid 305 and name H ))
2.500 0.800 0.800 peak 2675 spectrum 1 weight 0.10000E+01 volume 0.36736E-02 ppm1 1.840 ppm2 7.497 CV 1
OR { 2675}
(( segid " " and resid 309 and name HB2 ))
(( segid " " and resid 309 and name H ))
OR { 2675}
(( segid " " and resid 305 and name HB3 ))
(( segid " " and resid 305 and name H ))
OR { 2675}
(( segid " " and resid 309 and name HB3 ))
(( segid " " and resid 309 and name H ))
ASSI { 196}
(( segid " " and resid 373 and name HA ))
(( segid " " and resid 372 and name HA ))
4.600 2.700 1.400 peak 196 spectrum 1 weight 0.10000E+01 volume 0.46238E-03 ppm1 2.346 ppm2 3.796 CV 1
OR { 196}
(( segid " " and resid 373 and name HA ))
(( segid " " and resid 320 and name HA ))
ASSI { 630}
(( segid " " and resid 309 and name HG3 ))
( segid " " and resid 310 and name HD2%)
3.000 3.000 3.000 peak 630 spectrum 1 weight 0.10000E+01 volume 0.15394E-02 ppm1 2.160 ppm2 1.081 CV 1
OR { 630}
(( segid " " and resid 393 and name HG2 ))
(( segid " " and resid 391 and name HB2 ))
OR { 630}
(( segid " " and resid 288 and name HG3 ))
(( segid " " and resid 352 and name HB ))
ASSI { 744}
(( segid " " and resid 334 and name HG2 ))
(( segid " " and resid 334 and name HA ))
3.100 1.200 1.200 peak 744 spectrum 1 weight 0.10000E+01 volume 0.62565E-02 ppm1 2.197 ppm2 4.417 CV 1
OR { 744}
(( segid " " and resid 334 and name HG2 ))
(( segid " " and resid 226 and name HA ))
ASSI { 1387}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 278 and name HB3 ))
3.600 1.600 1.600 peak 1387 spectrum 1 weight 0.10000E+01 volume 0.19962E-02 ppm1 0.350 ppm2 1.573 CV 1
OR { 1387}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 307 and name HB2 ))
OR { 1387}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 321 and name HB3 ))
OR { 1387}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 316 and name HG ))
ASSI { 4549}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 217 and name HB ))
2.200 0.600 0.600 peak 4549 spectrum 1 weight 0.10000E+01 volume 0.65554E-02 ppm1 0.461 ppm2 1.623 CV 1
OR { 4549}
( segid " " and resid 207 and name HG2%)
(( segid " " and resid 207 and name HB ))
ASSI { 795}
( segid " " and resid 274 and name HD1%)
(( segid " " and resid 274 and name HB3 ))
2.500 0.800 0.800 peak 795 spectrum 1 weight 0.10000E+01 volume 0.45198E-02 ppm1 0.670 ppm2 1.849 CV 1
OR { 795}
( segid " " and resid 367 and name HD1%)
(( segid " " and resid 366 and name HB2 ))
OR { 795}
( segid " " and resid 367 and name HD1%)
(( segid " " and resid 366 and name HB3 ))
ASSI { 1610}
(( segid " " and resid 380 and name HA ))
(( segid " " and resid 380 and name HB2 ))
3.300 1.300 1.300 peak 1610 spectrum 1 weight 0.10000E+01 volume 0.13111E-02 ppm1 4.072 ppm2 1.200 CV 1
OR { 1610}
(( segid " " and resid 438 and name HA ))
( segid " " and resid 437 and name HG2%)
ASSI { 546}
( segid " " and resid 209 and name HD1%)
( segid " " and resid 213 and name HE% )
4.100 2.200 1.900 peak 546 spectrum 1 weight 0.10000E+01 volume 0.93325E-03 ppm1 0.187 ppm2 7.131 CV 1
OR { 546}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 214 and name H ))
OR { 546}
( segid " " and resid 209 and name HD1%)
(( segid " " and resid 320 and name HH2 ))
ASSI { 1566}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 398 and name HG13))
2.800 1.000 1.000 peak 1566 spectrum 1 weight 0.10000E+01 volume 0.72461E-02 ppm1 0.806 ppm2 1.634 CV 1
OR { 1566}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 443 and name HB2 ))
OR { 1566}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 443 and name HG ))
OR { 1566}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 443 and name HB3 ))
OR { 1566}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 399 and name HD3 ))
OR { 1566}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 440 and name HD3 ))
OR { 1566}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 442 and name HG2 ))
OR { 1566}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 399 and name HD2 ))
ASSI { 661}
( segid " " and resid 318 and name HG2%)
( segid " " and resid 315 and name HD% )
3.000 1.100 1.100 peak 661 spectrum 1 weight 0.10000E+01 volume 0.69866E-02 ppm1 0.350 ppm2 7.068 CV 1
OR { 661}
( segid " " and resid 318 and name HG2%)
( segid " " and resid 360 and name HE% )
OR { 661}
( segid " " and resid 318 and name HG2%)
( segid " " and resid 360 and name HD% )
ASSI { 424}
( segid " " and resid 267 and name HD2%)
(( segid " " and resid 217 and name HA ))
3.900 1.900 1.900 peak 424 spectrum 1 weight 0.10000E+01 volume 0.21767E-02 ppm1 0.905 ppm2 2.997 CV 1
OR { 424}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 305 and name HD3 ))
ASSI { 525}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 274 and name HB3 ))
2.600 2.600 3.400 peak 525 spectrum 1 weight 0.10000E+01 volume 0.11391E-02 ppm1 0.169 ppm2 1.850 CV 1
OR { 525}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 209 and name HB3 ))
OR { 525}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 276 and name HB3 ))
OR { 525}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 272 and name HG3 ))
OR { 525}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 268 and name HB2 ))
OR { 525}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 268 and name HB3 ))
OR { 525}
( segid " " and resid 317 and name HD1%)
( segid " " and resid 202 and name HE% )
OR { 525}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 215 and name HB2 ))
ASSI { 1334}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 444 and name H ))
4.600 2.700 1.400 peak 1334 spectrum 1 weight 0.10000E+01 volume 0.48776E-03 ppm1 0.701 ppm2 7.765 CV 1
OR { 1334}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 395 and name HE21))
OR { 1334}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 407 and name H ))
ASSI { 914}
( segid " " and resid 192 and name HD1%)
(( segid " " and resid 193 and name HD3 ))
4.500 2.500 1.500 peak 914 spectrum 1 weight 0.10000E+01 volume 0.16438E-02 ppm1 0.870 ppm2 3.627 CV 1
OR { 914}
( segid " " and resid 192 and name HD1%)
(( segid " " and resid 275 and name HD2 ))
ASSI { 1491}
( segid " " and resid 243 and name HD1%)
(( segid " " and resid 266 and name H ))
4.900 3.000 1.100 peak 1491 spectrum 1 weight 0.10000E+01 volume 0.42857E-03 ppm1 0.012 ppm2 8.223 CV 1
OR { 1491}
( segid " " and resid 243 and name HD1%)
(( segid " " and resid 253 and name H ))
OR { 1491}
( segid " " and resid 243 and name HD1%)
(( segid " " and resid 269 and name H ))
ASSI { 675}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 316 and name HB2 ))
3.400 1.400 1.400 peak 675 spectrum 1 weight 0.10000E+01 volume 0.18750E-02 ppm1 -0.905 ppm2 1.595 CV 1
OR { 675}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 316 and name HG ))
OR { 675}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 316 and name HB3 ))
OR { 675}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 207 and name HB ))
OR { 675}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 374 and name HB2 ))
OR { 675}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 210 and name HB2 ))
ASSI { 767}
(( segid " " and resid 210 and name HD3 ))
( segid " " and resid 209 and name HD1%)
4.200 2.200 1.800 peak 767 spectrum 1 weight 0.10000E+01 volume 0.49622E-03 ppm1 2.889 ppm2 0.169 CV 1
OR { 767}
(( segid " " and resid 210 and name HD3 ))
( segid " " and resid 317 and name HD1%)
ASSI { 1565}
(( segid " " and resid 324 and name HB2 ))
( segid " " and resid 373 and name HD2%)
4.000 2.000 2.000 peak 1565 spectrum 1 weight 0.10000E+01 volume 0.58362E-03 ppm1 2.880 ppm2 0.452 CV 1
OR { 1565}
(( segid " " and resid 324 and name HB2 ))
(( segid " " and resid 217 and name HG13))
OR { 1565}
(( segid " " and resid 324 and name HB2 ))
(( segid " " and resid 217 and name HG12))
OR { 1565}
(( segid " " and resid 324 and name HB2 ))
( segid " " and resid 217 and name HG2%)
OR { 1565}
(( segid " " and resid 324 and name HB2 ))
(( segid " " and resid 373 and name HB2 ))
ASSI { 2263}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 210 and name HD2 ))
3.000 1.100 1.100 peak 2263 spectrum 1 weight 0.10000E+01 volume 0.12378E-02 ppm1 0.169 ppm2 3.342 CV 1
OR { 2263}
( segid " " and resid 317 and name HD1%)
(( segid " " and resid 320 and name HB3 ))
ASSI { 582}
(( segid " " and resid 309 and name HG3 ))
( segid " " and resid 306 and name HD1%)
3.700 1.700 1.700 peak 582 spectrum 1 weight 0.10000E+01 volume 0.15846E-02 ppm1 2.159 ppm2 0.380 CV 1
OR { 582}
(( segid " " and resid 288 and name HG3 ))
( segid " " and resid 356 and name HG2%)
ASSI { 656}
( segid " " and resid 262 and name HG2%)
( segid " " and resid 258 and name HD% )
2.800 1.000 1.000 peak 656 spectrum 1 weight 0.10000E+01 volume 0.28674E-02 ppm1 1.076 ppm2 7.092 CV 1
OR { 656}
( segid " " and resid 262 and name HG2%)
(( segid " " and resid 263 and name H ))
ASSI { 1658}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 352 and name HB ))
4.800 2.900 1.200 peak 1658 spectrum 1 weight 0.10000E+01 volume 0.10742E-02 ppm1 2.584 ppm2 1.107 CV 1
OR { 1658}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 352 and name HB ))
OR { 1658}
(( segid " " and resid 284 and name HG3 ))
( segid " " and resid 310 and name HD2%)
ASSI { 577}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 402 and name HB ))
2.200 0.600 0.600 peak 577 spectrum 1 weight 0.10000E+01 volume 0.81060E-02 ppm1 0.768 ppm2 1.931 CV 1
OR { 577}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 406 and name HB2 ))
OR { 577}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 439 and name HB3 ))
OR { 577}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 406 and name HB3 ))
ASSI { 1196}
( segid " " and resid 345 and name HG1%)
( segid " " and resid 231 and name HD% )
2.700 2.700 3.300 peak 1196 spectrum 1 weight 0.10000E+01 volume 0.97271E-03 ppm1 1.009 ppm2 6.761 CV 1
OR { 1196}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 340 and name HE21))
OR { 1196}
( segid " " and resid 345 and name HG1%)
( segid " " and resid 231 and name HE% )
ASSI { 1117}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 401 and name HG3 ))
4.800 2.800 1.200 peak 1117 spectrum 1 weight 0.10000E+01 volume 0.79791E-03 ppm1 0.809 ppm2 2.281 CV 1
OR { 1117}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 401 and name HG2 ))
OR { 1117}
( segid " " and resid 398 and name HG2%)
(( segid " " and resid 395 and name HG2 ))
ASSI { 283}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 341 and name H ))
3.700 3.700 2.300 peak 283 spectrum 1 weight 0.10000E+01 volume 0.49340E-03 ppm1 1.012 ppm2 8.511 CV 1
OR { 283}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 358 and name H ))
OR { 283}
( segid " " and resid 345 and name HG1%)
(( segid " " and resid 325 and name H ))
ASSI { 376}
( segid " " and resid 236 and name HG2%)
(( segid " " and resid 239 and name H ))
2.400 0.700 0.700 peak 376 spectrum 1 weight 0.10000E+01 volume 0.60562E-02 ppm1 0.960 ppm2 7.088 CV 1
OR { 376}
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(( segid " " and resid 263 and name H ))
ASSI { 3507}
(( segid " " and resid 254 and name HB2 ))
( segid " " and resid 255 and name HD1%)
5.700 4.100 0.300 peak 3507 spectrum 1 weight 0.10000E+01 volume 0.65696E-03 ppm1 2.601 ppm2 0.612 CV 1
OR { 3507}
(( segid " " and resid 254 and name HB2 ))
( segid " " and resid 253 and name HG2%)
ASSI { 1306}
(( segid " " and resid 272 and name HG3 ))
(( segid " " and resid 269 and name HG2 ))
4.700 2.800 1.300 peak 1306 spectrum 1 weight 0.10000E+01 volume 0.75564E-03 ppm1 1.803 ppm2 2.499 CV 1
OR { 1306}
(( segid " " and resid 272 and name HG2 ))
(( segid " " and resid 269 and name HG2 ))
OR { 1306}
(( segid " " and resid 272 and name HG3 ))
(( segid " " and resid 273 and name HB3 ))
OR { 1306}
(( segid " " and resid 272 and name HG2 ))
(( segid " " and resid 350 and name HB ))
OR { 1306}
(( segid " " and resid 272 and name HG2 ))
(( segid " " and resid 273 and name HB3 ))
ASSI { 676}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 225 and name H ))
2.400 2.400 3.600 peak 676 spectrum 1 weight 0.10000E+01 volume 0.29125E-02 ppm1 1.914 ppm2 7.779 CV 1
OR { 676}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 323 and name H ))
OR { 676}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 265 and name H ))
ASSI { 3856}
( segid " " and resid 409 and name HD2%)
(( segid " " and resid 413 and name H ))
4.100 2.100 1.900 peak 3856 spectrum 1 weight 0.10000E+01 volume 0.17255E-02 ppm1 0.740 ppm2 8.458 CV 1
OR { 3856}
( segid " " and resid 409 and name HD2%)
(( segid " " and resid 432 and name H ))
ASSI { 827}
( segid " " and resid 349 and name HG2%)
( segid " " and resid 271 and name HD2%)
2.500 0.800 0.800 peak 827 spectrum 1 weight 0.10000E+01 volume 0.11269E-01 ppm1 1.252 ppm2 0.720 CV 1
OR { 827}
( segid " " and resid 349 and name HG2%)
( segid " " and resid 321 and name HD2%)
OR { 827}
( segid " " and resid 349 and name HG2%)
( segid " " and resid 350 and name HG1%)
OR { 827}
( segid " " and resid 349 and name HG2%)
( segid " " and resid 346 and name HD2%)
OR { 827}
( segid " " and resid 349 and name HG2%)
( segid " " and resid 350 and name HG2%)
OR { 827}
( segid " " and resid 349 and name HG2%)
( segid " " and resid 357 and name HD1%)
ASSI { 99}
( segid " " and resid 246 and name HB% )
(( segid " " and resid 251 and name HB2 ))
2.900 1.100 1.100 peak 99 spectrum 1 weight 0.10000E+01 volume 0.29971E-02 ppm1 1.176 ppm2 1.746 CV 1
OR { 99}
( segid " " and resid 246 and name HB% )
(( segid " " and resid 243 and name HB2 ))
OR { 99}
( segid " " and resid 246 and name HB% )
(( segid " " and resid 249 and name HB3 ))
OR { 99}
( segid " " and resid 246 and name HB% )
(( segid " " and resid 249 and name HG3 ))
ASSI { 55}
( segid " " and resid 189 and name HD1%)
(( segid " " and resid 200 and name HA ))
4.600 2.600 1.400 peak 55 spectrum 1 weight 0.10000E+01 volume 0.64003E-03 ppm1 0.734 ppm2 4.140 CV 1
OR { 55}
( segid " " and resid 189 and name HD1%)
(( segid " " and resid 191 and name HA2 ))
ASSI { 380}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 346 and name HA ))
4.000 2.000 2.000 peak 380 spectrum 1 weight 0.10000E+01 volume 0.11447E-02 ppm1 0.732 ppm2 4.087 CV 1
OR { 380}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 343 and name HA ))
ASSI { 694}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 305 and name H ))
3.800 1.800 1.800 peak 694 spectrum 1 weight 0.10000E+01 volume 0.13393E-02 ppm1 -0.357 ppm2 7.460 CV 1
OR { 694}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 309 and name H ))
ASSI { 940}
( segid " " and resid 359 and name HG2%)
(( segid " " and resid 300 and name HA ))
4.500 2.500 1.500 peak 940 spectrum 1 weight 0.10000E+01 volume 0.10517E-02 ppm1 -0.459 ppm2 2.900 CV 1
OR { 940}
( segid " " and resid 359 and name HG2%)
(( segid " " and resid 358 and name HB3 ))
ASSI { 649}
( segid " " and resid 396 and name HB% )
(( segid " " and resid 399 and name HB3 ))
3.700 1.700 1.700 peak 649 spectrum 1 weight 0.10000E+01 volume 0.25319E-02 ppm1 1.353 ppm2 1.840 CV 1
OR { 649}
( segid " " and resid 396 and name HB% )
(( segid " " and resid 399 and name HB2 ))
OR { 649}
( segid " " and resid 195 and name HB% )
(( segid " " and resid 199 and name HB2 ))
ASSI { 1343}
( segid " " and resid 262 and name HG2%)
( segid " " and resid 243 and name HD1%)
2.500 0.800 0.800 peak 1343 spectrum 1 weight 0.10000E+01 volume 0.63439E-02 ppm1 1.077 ppm2 0.021 CV 1
OR { 1343}
( segid " " and resid 262 and name HG2%)
( segid " " and resid 263 and name HG1%)
ASSI { 1104}
(( segid " " and resid 305 and name HA ))
(( segid " " and resid 305 and name HB3 ))
2.300 0.700 0.700 peak 1104 spectrum 1 weight 0.10000E+01 volume 0.65498E-02 ppm1 3.825 ppm2 1.850 CV 1
OR { 1104}
(( segid " " and resid 305 and name HA ))
(( segid " " and resid 305 and name HB2 ))
OR { 1104}
(( segid " " and resid 305 and name HA ))
(( segid " " and resid 308 and name HB3 ))
OR { 1104}
(( segid " " and resid 305 and name HA ))
(( segid " " and resid 308 and name HB2 ))
ASSI { 78}
( segid " " and resid 357 and name HD1%)
(( segid " " and resid 361 and name HZ ))
4.100 2.100 1.900 peak 78 spectrum 1 weight 0.10000E+01 volume 0.54699E-03 ppm1 0.680 ppm2 6.631 CV 1
OR { 78}
( segid " " and resid 357 and name HD1%)
(( segid " " and resid 360 and name HZ ))
ASSI { 494}
( segid " " and resid 271 and name HD1%)
(( segid " " and resid 320 and name HB2 ))
3.700 1.700 1.700 peak 494 spectrum 1 weight 0.10000E+01 volume 0.28505E-02 ppm1 0.848 ppm2 2.896 CV 1
OR { 494}
( segid " " and resid 271 and name HD1%)
(( segid " " and resid 210 and name HD3 ))
OR { 494}
( segid " " and resid 271 and name HD1%)
(( segid " " and resid 324 and name HB2 ))
ASSI { 252}
( segid " " and resid 360 and name HD% )
(( segid " " and resid 357 and name HA ))
2.900 1.000 1.000 peak 252 spectrum 1 weight 0.10000E+01 volume 0.15507E-02 ppm1 7.079 ppm2 3.838 CV 1
OR { 252}
( segid " " and resid 303 and name HD% )
(( segid " " and resid 303 and name HA ))
ASSI { 3648}
( segid " " and resid 236 and name HD1%)
(( segid " " and resid 239 and name H ))
4.100 2.100 1.900 peak 3648 spectrum 1 weight 0.10000E+01 volume 0.22838E-02 ppm1 0.831 ppm2 7.086 CV 1
OR { 3648}
( segid " " and resid 236 and name HD1%)
( segid " " and resid 258 and name HD% )
ASSI { 141}
(( segid " " and resid 399 and name HB3 ))
( segid " " and resid 398 and name HG2%)
3.500 1.500 1.500 peak 141 spectrum 1 weight 0.10000E+01 volume 0.63044E-02 ppm1 1.810 ppm2 0.805 CV 1
OR { 141}
(( segid " " and resid 399 and name HB3 ))
( segid " " and resid 443 and name HD2%)
OR { 141}
(( segid " " and resid 399 and name HB3 ))
( segid " " and resid 443 and name HD1%)
OR { 141}
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( segid " " and resid 443 and name HD2%)
OR { 141}
(( segid " " and resid 440 and name HB3 ))
( segid " " and resid 402 and name HG2%)
OR { 141}
(( segid " " and resid 440 and name HB2 ))
( segid " " and resid 402 and name HG2%)
OR { 141}
(( segid " " and resid 440 and name HB3 ))
( segid " " and resid 443 and name HD1%)
OR { 141}
(( segid " " and resid 440 and name HB2 ))
( segid " " and resid 436 and name HD2%)
OR { 141}
(( segid " " and resid 440 and name HB2 ))
( segid " " and resid 443 and name HD2%)
OR { 141}
(( segid " " and resid 440 and name HB3 ))
( segid " " and resid 436 and name HD2%)
OR { 141}
(( segid " " and resid 440 and name HB2 ))
( segid " " and resid 443 and name HD1%)
OR { 141}
(( segid " " and resid 399 and name HB3 ))
( segid " " and resid 402 and name HG2%)
ASSI { 1539}
(( segid " " and resid 316 and name HA ))
( segid " " and resid 209 and name HD1%)
5.000 3.200 1.000 peak 1539 spectrum 1 weight 0.10000E+01 volume 0.36652E-03 ppm1 3.577 ppm2 0.191 CV 1
OR { 1539}
(( segid " " and resid 316 and name HA ))
( segid " " and resid 317 and name HD1%)
ASSI { 482}
( segid " " and resid 350 and name HG2%)
( segid " " and resid 279 and name HD2%)
4.000 2.000 2.000 peak 482 spectrum 1 weight 0.10000E+01 volume 0.20018E-02 ppm1 0.729 ppm2 0.372 CV 1
OR { 482}
( segid " " and resid 350 and name HG2%)
( segid " " and resid 318 and name HD1%)
OR { 482}
( segid " " and resid 350 and name HG2%)
( segid " " and resid 356 and name HG2%)
ASSI { 900}
( segid " " and resid 360 and name HE% )
(( segid " " and resid 318 and name HG12))
3.000 1.100 1.100 peak 900 spectrum 1 weight 0.10000E+01 volume 0.26616E-02 ppm1 7.079 ppm2 1.029 CV 1
OR { 900}
( segid " " and resid 303 and name HD% )
( segid " " and resid 307 and name HD2%)
OR { 900}
( segid " " and resid 360 and name HD% )
( segid " " and resid 364 and name HG1%)
OR { 900}
( segid " " and resid 360 and name HD% )
(( segid " " and resid 318 and name HG12))
OR { 900}
( segid " " and resid 303 and name HD% )
(( segid " " and resid 367 and name HB2 ))
ASSI { 191}
(( segid " " and resid 312 and name HG2 ))
(( segid " " and resid 208 and name HG3 ))
2.900 1.100 1.100 peak 191 spectrum 1 weight 0.10000E+01 volume 0.34229E-02 ppm1 2.349 ppm2 0.762 CV 1
OR { 191}
(( segid " " and resid 312 and name HG2 ))
(( segid " " and resid 208 and name HG2 ))
OR { 191}
(( segid " " and resid 312 and name HG2 ))
( segid " " and resid 316 and name HD2%)
OR { 191}
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( segid " " and resid 328 and name HG2%)
OR { 191}
(( segid " " and resid 221 and name HG3 ))
(( segid " " and resid 222 and name HB3 ))
ASSI { 862}
( segid " " and resid 303 and name HD% )
(( segid " " and resid 302 and name HG2 ))
4.900 3.000 1.100 peak 862 spectrum 1 weight 0.10000E+01 volume 0.62029E-03 ppm1 7.088 ppm2 2.265 CV 1
OR { 862}
( segid " " and resid 303 and name HD% )
(( segid " " and resid 304 and name HG3 ))
OR { 862}
( segid " " and resid 303 and name HD% )
(( segid " " and resid 304 and name HB2 ))
OR { 862}
( segid " " and resid 303 and name HD% )
(( segid " " and resid 307 and name HG ))
ASSI { 434}
(( segid " " and resid 413 and name HB3 ))
( segid " " and resid 429 and name HD2%)
4.600 2.700 1.400 peak 434 spectrum 1 weight 0.10000E+01 volume 0.83175E-03 ppm1 2.994 ppm2 0.662 CV 1
OR { 434}
(( segid " " and resid 413 and name HB3 ))
( segid " " and resid 416 and name HD2%)
ASSI { 159}
(( segid " " and resid 320 and name HE3 ))
( segid " " and resid 207 and name HD1%)
6.000 4.600 0.000 peak 159 spectrum 1 weight 0.10000E+01 volume 0.32988E-03 ppm1 6.054 ppm2 0.922 CV 1
OR { 159}
(( segid " " and resid 320 and name HE3 ))
( segid " " and resid 267 and name HD2%)
OR { 159}
(( segid " " and resid 320 and name HE3 ))
( segid " " and resid 321 and name HD1%)
OR { 159}
(( segid " " and resid 320 and name HE3 ))
( segid " " and resid 325 and name HE% )
ASSI { 632}
( segid " " and resid 371 and name HG2%)
(( segid " " and resid 368 and name HB2 ))
3.000 1.100 1.100 peak 632 spectrum 1 weight 0.10000E+01 volume 0.39670E-02 ppm1 0.964 ppm2 3.280 CV 1
OR { 632}
( segid " " and resid 371 and name HG2%)
(( segid " " and resid 319 and name HB2 ))
ASSI { 2052}
(( segid " " and resid 239 and name HB2 ))
(( segid " " and resid 239 and name HE2 ))
3.700 1.700 1.700 peak 2052 spectrum 1 weight 0.10000E+01 volume 0.26024E-02 ppm1 1.908 ppm2 2.956 CV 1
OR { 2052}
(( segid " " and resid 281 and name HB3 ))
(( segid " " and resid 281 and name HE2 ))
OR { 2052}
(( segid " " and resid 281 and name HB3 ))
(( segid " " and resid 281 and name HE3 ))
OR { 2052}
(( segid " " and resid 239 and name HB2 ))
(( segid " " and resid 239 and name HE3 ))
ASSI { 654}
(( segid " " and resid 360 and name HB2 ))
( segid " " and resid 322 and name HG2%)
4.300 2.300 1.700 peak 654 spectrum 1 weight 0.10000E+01 volume 0.89095E-03 ppm1 2.765 ppm2 0.385 CV 1
OR { 654}
(( segid " " and resid 314 and name HB3 ))
( segid " " and resid 318 and name HG2%)
OR { 654}
(( segid " " and resid 360 and name HB2 ))
( segid " " and resid 318 and name HD1%)
OR { 654}
(( segid " " and resid 370 and name HB3 ))
( segid " " and resid 371 and name HG1%)
OR { 654}
(( segid " " and resid 314 and name HB3 ))
( segid " " and resid 317 and name HD2%)
OR { 654}
(( segid " " and resid 370 and name HB2 ))
( segid " " and resid 371 and name HG1%)
OR { 654}
(( segid " " and resid 314 and name HB3 ))
( segid " " and resid 318 and name HD1%)
OR { 654}
(( segid " " and resid 314 and name HB3 ))
( segid " " and resid 279 and name HD2%)
OR { 654}
(( segid " " and resid 314 and name HB3 ))
(( segid " " and resid 317 and name HG ))
OR { 654}
(( segid " " and resid 360 and name HB2 ))
( segid " " and resid 323 and name HG2%)
ASSI { 182}
( segid " " and resid 279 and name HD2%)
(( segid " " and resid 352 and name HG12))
4.000 2.000 2.000 peak 182 spectrum 1 weight 0.10000E+01 volume 0.14661E-02 ppm1 0.364 ppm2 1.715 CV 1
OR { 182}
( segid " " and resid 279 and name HD2%)
(( segid " " and resid 278 and name HG ))
OR { 182}
( segid " " and resid 279 and name HD2%)
(( segid " " and resid 281 and name HD3 ))
ASSI { 1358}
( segid " " and resid 315 and name HE% )
( segid " " and resid 316 and name HD1%)
3.700 1.700 1.700 peak 1358 spectrum 1 weight 0.10000E+01 volume 0.21202E-02 ppm1 6.874 ppm2 0.811 CV 1
OR { 1358}
( segid " " and resid 315 and name HE% )
( segid " " and resid 367 and name HD2%)
ASSI { 1537}
( segid " " and resid 325 and name HE% )
(( segid " " and resid 217 and name HA ))
3.400 3.400 2.600 peak 1537 spectrum 1 weight 0.10000E+01 volume 0.11081E-02 ppm1 0.929 ppm2 2.980 CV 1
OR { 1537}
( segid " " and resid 325 and name HE% )
(( segid " " and resid 339 and name HA ))
ASSI { 995}
(( segid " " and resid 368 and name HB3 ))
(( segid " " and resid 367 and name HB2 ))
4.900 3.000 1.100 peak 995 spectrum 1 weight 0.10000E+01 volume 0.58644E-03 ppm1 2.667 ppm2 1.029 CV 1
OR { 995}
(( segid " " and resid 368 and name HB3 ))
( segid " " and resid 364 and name HG1%)
OR { 995}
(( segid " " and resid 368 and name HB3 ))
( segid " " and resid 307 and name HD2%)
ASSI { 1863}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 320 and name HB2 ))
4.200 2.200 1.800 peak 1863 spectrum 1 weight 0.10000E+01 volume 0.62875E-03 ppm1 -0.906 ppm2 2.901 CV 1
OR { 1863}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 210 and name HD3 ))
ASSI { 1645}
( segid " " and resid 322 and name HD1%)
( segid " " and resid 346 and name HD1%)
3.300 1.400 1.400 peak 1645 spectrum 1 weight 0.10000E+01 volume 0.48607E-02 ppm1 -0.167 ppm2 0.884 CV 1
OR { 1645}
( segid " " and resid 322 and name HD1%)
( segid " " and resid 364 and name HG2%)
OR { 1645}
( segid " " and resid 322 and name HD1%)
( segid " " and resid 321 and name HD1%)
OR { 1645}
( segid " " and resid 322 and name HD1%)
( segid " " and resid 325 and name HE% )
OR { 1645}
( segid " " and resid 322 and name HD1%)
( segid " " and resid 357 and name HD2%)
ASSI { 1107}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 345 and name H ))
4.600 2.700 1.400 peak 1107 spectrum 1 weight 0.10000E+01 volume 0.12011E-02 ppm1 0.656 ppm2 7.014 CV 1
OR { 1107}
( segid " " and resid 342 and name HD1%)
( segid " " and resid 361 and name HE% )
ASSI { 507}
(( segid " " and resid 367 and name HB3 ))
(( segid " " and resid 367 and name HB2 ))
2.500 0.800 0.800 peak 507 spectrum 1 weight 0.10000E+01 volume 0.66260E-03 ppm1 0.010 ppm2 1.009 CV 1
OR { 507}
(( segid " " and resid 367 and name HB3 ))
( segid " " and resid 307 and name HD2%)
ASSI { 942}
(( segid " " and resid 374 and name HG3 ))
( segid " " and resid 207 and name HG2%)
3.600 1.700 1.700 peak 942 spectrum 1 weight 0.10000E+01 volume 0.86560E-03 ppm1 1.368 ppm2 0.462 CV 1
OR { 942}
(( segid " " and resid 374 and name HG2 ))
( segid " " and resid 207 and name HG2%)
OR { 942}
(( segid " " and resid 374 and name HG2 ))
( segid " " and resid 217 and name HG2%)
ASSI { 1182}
(( segid " " and resid 185 and name HB2 ))
( segid " " and resid 186 and name HD2%)
4.500 2.500 1.500 peak 1182 spectrum 1 weight 0.10000E+01 volume 0.19342E-02 ppm1 2.761 ppm2 0.773 CV 1
OR { 1182}
(( segid " " and resid 185 and name HB2 ))
( segid " " and resid 186 and name HD1%)
OR { 1182}
(( segid " " and resid 370 and name HB2 ))
( segid " " and resid 372 and name HG2%)
OR { 1182}
(( segid " " and resid 370 and name HB2 ))
( segid " " and resid 323 and name HG1%)
ASSI { 1528}
(( segid " " and resid 358 and name HA ))
( segid " " and resid 361 and name HD% )
3.000 1.100 1.100 peak 1528 spectrum 1 weight 0.10000E+01 volume 0.10883E-02 ppm1 4.003 ppm2 7.164 CV 1
OR { 1528}
(( segid " " and resid 358 and name HA ))
(( segid " " and resid 359 and name H ))
ASSI { 2419}
(( segid " " and resid 410 and name HB2 ))
(( segid " " and resid 410 and name HA ))
2.700 0.900 0.900 peak 2419 spectrum 1 weight 0.10000E+01 volume 0.25968E-02 ppm1 2.801 ppm2 4.348 CV 1
OR { 2419}
(( segid " " and resid 341 and name HB2 ))
(( segid " " and resid 341 and name HA ))
OR { 2419}
(( segid " " and resid 341 and name HB3 ))
(( segid " " and resid 341 and name HA ))
ASSI { 553}
( segid " " and resid 203 and name HE% )
( segid " " and resid 201 and name HG2%)
4.700 2.800 1.300 peak 553 spectrum 1 weight 0.10000E+01 volume 0.17537E-02 ppm1 2.219 ppm2 1.307 CV 1
OR { 553}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 207 and name HG12))
OR { 553}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 374 and name HG3 ))
ASSI { 832}
(( segid " " and resid 351 and name HG2 ))
(( segid " " and resid 350 and name HA ))
4.800 2.900 1.200 peak 832 spectrum 1 weight 0.10000E+01 volume 0.66260E-03 ppm1 2.169 ppm2 4.533 CV 1
OR { 832}
(( segid " " and resid 351 and name HG2 ))
(( segid " " and resid 348 and name HA ))
OR { 832}
(( segid " " and resid 351 and name HG2 ))
(( segid " " and resid 277 and name HA ))
ASSI { 821}
( segid " " and resid 307 and name HD2%)
( segid " " and resid 318 and name HG2%)
3.200 1.300 1.300 peak 821 spectrum 1 weight 0.10000E+01 volume 0.28420E-02 ppm1 1.031 ppm2 0.376 CV 1
OR { 821}
( segid " " and resid 307 and name HD2%)
( segid " " and resid 318 and name HD1%)
OR { 821}
( segid " " and resid 307 and name HD2%)
( segid " " and resid 323 and name HG2%)
OR { 821}
( segid " " and resid 307 and name HD2%)
( segid " " and resid 279 and name HD2%)
ASSI { 578}
( segid " " and resid 290 and name HB% )
(( segid " " and resid 293 and name HD2 ))
4.300 2.300 1.700 peak 578 spectrum 1 weight 0.10000E+01 volume 0.12660E-02 ppm1 1.533 ppm2 3.099 CV 1
OR { 578}
( segid " " and resid 290 and name HB% )
(( segid " " and resid 287 and name HB2 ))
OR { 578}
( segid " " and resid 290 and name HB% )
(( segid " " and resid 293 and name HD3 ))
OR { 578}
( segid " " and resid 290 and name HB% )
(( segid " " and resid 291 and name HB3 ))
ASSI { 351}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 325 and name H ))
4.500 2.600 1.500 peak 351 spectrum 1 weight 0.10000E+01 volume 0.10658E-02 ppm1 -0.167 ppm2 8.533 CV 1
OR { 351}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 321 and name H ))
OR { 351}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 324 and name H ))
ASSI { 79}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 338 and name HD21))
5.900 4.300 0.100 peak 79 spectrum 1 weight 0.10000E+01 volume 0.44831E-03 ppm1 0.748 ppm2 6.659 CV 1
OR { 79}
( segid " " and resid 329 and name HG2%)
( segid " " and resid 358 and name HE% )
OR { 79}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 361 and name HZ ))
ASSI { 572}
( segid " " and resid 207 and name HG2%)
(( segid " " and resid 205 and name HB2 ))
3.800 1.800 1.800 peak 572 spectrum 1 weight 0.10000E+01 volume 0.15986E-02 ppm1 0.462 ppm2 2.728 CV 1
OR { 572}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 218 and name HB2 ))
OR { 572}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 216 and name HB3 ))
ASSI { 780}
(( segid " " and resid 228 and name HG3 ))
(( segid " " and resid 336 and name HE2 ))
4.000 2.000 2.000 peak 780 spectrum 1 weight 0.10000E+01 volume 0.13280E-02 ppm1 1.969 ppm2 2.865 CV 1
OR { 780}
(( segid " " and resid 228 and name HG3 ))
(( segid " " and resid 336 and name HE3 ))
OR { 780}
(( segid " " and resid 228 and name HG3 ))
(( segid " " and resid 227 and name HB3 ))
ASSI { 990}
( segid " " and resid 231 and name HD% )
( segid " " and resid 230 and name HG2%)
3.000 1.100 1.100 peak 990 spectrum 1 weight 0.10000E+01 volume 0.13364E-02 ppm1 6.768 ppm2 0.930 CV 1
OR { 990}
( segid " " and resid 231 and name HD% )
( segid " " and resid 264 and name HB% )
OR { 990}
( segid " " and resid 231 and name HD% )
(( segid " " and resid 230 and name HG13))
OR { 990}
( segid " " and resid 231 and name HD% )
( segid " " and resid 345 and name HG2%)
ASSI { 294}
( segid " " and resid 230 and name HD1%)
(( segid " " and resid 230 and name H ))
3.700 1.800 1.800 peak 294 spectrum 1 weight 0.10000E+01 volume 0.33665E-02 ppm1 0.649 ppm2 7.118 CV 1
OR { 294}
( segid " " and resid 230 and name HD1%)
(( segid " " and resid 227 and name H ))
ASSI { 1321}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 210 and name HB3 ))
4.600 2.600 1.400 peak 1321 spectrum 1 weight 0.10000E+01 volume 0.16804E-02 ppm1 2.219 ppm2 1.397 CV 1
OR { 1321}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 374 and name HG3 ))
OR { 1321}
( segid " " and resid 203 and name HE% )
( segid " " and resid 197 and name HB% )
OR { 1321}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 374 and name HG2 ))
OR { 1321}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 373 and name HB3 ))
ASSI { 1609}
(( segid " " and resid 415 and name HB3 ))
(( segid " " and resid 416 and name HB3 ))
4.700 2.800 1.300 peak 1609 spectrum 1 weight 0.10000E+01 volume 0.62593E-03 ppm1 2.587 ppm2 1.593 CV 1
OR { 1609}
(( segid " " and resid 415 and name HB3 ))
(( segid " " and resid 416 and name HG ))
OR { 1609}
(( segid " " and resid 415 and name HB3 ))
(( segid " " and resid 425 and name HD2 ))
OR { 1609}
(( segid " " and resid 415 and name HB3 ))
(( segid " " and resid 425 and name HD3 ))
ASSI { 1542}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 317 and name HA ))
5.400 3.600 0.600 peak 1542 spectrum 1 weight 0.10000E+01 volume 0.42575E-03 ppm1 0.543 ppm2 3.101 CV 1
OR { 1542}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 275 and name HD3 ))
OR { 1542}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 311 and name HD3 ))
OR { 1542}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 315 and name HB2 ))
ASSI { 2529}
( segid " " and resid 329 and name HD1%)
( segid " " and resid 329 and name HG2%)
2.200 0.600 0.600 peak 2529 spectrum 1 weight 0.10000E+01 volume 0.10249E-01 ppm1 0.118 ppm2 0.735 CV 1
OR { 2529}
( segid " " and resid 329 and name HD1%)
( segid " " and resid 339 and name HG2%)
ASSI { 745}
( segid " " and resid 278 and name HD2%)
(( segid " " and resid 280 and name H ))
4.000 2.000 2.000 peak 745 spectrum 1 weight 0.10000E+01 volume 0.23007E-02 ppm1 0.747 ppm2 7.635 CV 1
OR { 745}
( segid " " and resid 278 and name HD2%)
(( segid " " and resid 277 and name HD21))
OR { 745}
( segid " " and resid 278 and name HD2%)
(( segid " " and resid 350 and name H ))
OR { 745}
( segid " " and resid 409 and name HD2%)
(( segid " " and resid 414 and name H ))
ASSI { 1030}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 232 and name HD3 ))
3.000 1.100 1.100 peak 1030 spectrum 1 weight 0.10000E+01 volume 0.14436E-02 ppm1 1.802 ppm2 2.983 CV 1
OR { 1030}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 339 and name HA ))
ASSI { 757}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 350 and name HA ))
3.000 3.000 3.000 peak 757 spectrum 1 weight 0.10000E+01 volume 0.48776E-03 ppm1 0.610 ppm2 4.547 CV 1
OR { 757}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 277 and name HA ))
ASSI { 1518}
(( segid " " and resid 322 and name HA ))
( segid " " and resid 325 and name HE% )
4.700 2.800 1.300 peak 1518 spectrum 1 weight 0.10000E+01 volume 0.51597E-03 ppm1 3.382 ppm2 0.906 CV 1
OR { 1518}
(( segid " " and resid 322 and name HA ))
( segid " " and resid 364 and name HG2%)
OR { 1518}
(( segid " " and resid 322 and name HA ))
( segid " " and resid 321 and name HD1%)
ASSI { 903}
( segid " " and resid 300 and name HG2%)
(( segid " " and resid 366 and name H ))
4.600 2.600 1.400 peak 903 spectrum 1 weight 0.10000E+01 volume 0.13280E-02 ppm1 0.542 ppm2 8.326 CV 1
OR { 903}
( segid " " and resid 300 and name HG2%)
(( segid " " and resid 365 and name H ))
ASSI { 1353}
( segid " " and resid 194 and name HD1%)
(( segid " " and resid 313 and name HB3 ))
3.300 1.300 1.300 peak 1353 spectrum 1 weight 0.10000E+01 volume 0.19652E-02 ppm1 0.750 ppm2 2.871 CV 1
OR { 1353}
( segid " " and resid 194 and name HD1%)
(( segid " " and resid 313 and name HB2 ))
OR { 1353}
( segid " " and resid 194 and name HD1%)
(( segid " " and resid 210 and name HD3 ))
OR { 1353}
( segid " " and resid 194 and name HD1%)
(( segid " " and resid 314 and name HB2 ))
OR { 1353}
( segid " " and resid 194 and name HD1%)
(( segid " " and resid 198 and name HA ))
ASSI { 924}
( segid " " and resid 352 and name HD1%)
( segid " " and resid 360 and name HE% )
2.700 0.900 0.900 peak 924 spectrum 1 weight 0.10000E+01 volume 0.26136E-02 ppm1 0.603 ppm2 7.066 CV 1
OR { 924}
( segid " " and resid 352 and name HD1%)
( segid " " and resid 360 and name HD% )
OR { 924}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 352 and name H ))
ASSI { 105}
( segid " " and resid 367 and name HD2%)
(( segid " " and resid 363 and name HB3 ))
3.300 1.400 1.400 peak 105 spectrum 1 weight 0.10000E+01 volume 0.13223E-02 ppm1 0.779 ppm2 2.647 CV 1
OR { 105}
( segid " " and resid 367 and name HD2%)
(( segid " " and resid 368 and name HB3 ))
ASSI { 3518}
( segid " " and resid 317 and name HD2%)
( segid " " and resid 317 and name HD1%)
2.100 0.600 0.600 peak 3518 spectrum 1 weight 0.10000E+01 volume 0.18674E-01 ppm1 0.343 ppm2 0.169 CV 1
OR { 3518}
( segid " " and resid 317 and name HD2%)
( segid " " and resid 209 and name HD1%)
ASSI { 218}
( segid " " and resid 358 and name HE% )
( segid " " and resid 339 and name HD1%)
2.700 0.900 0.900 peak 218 spectrum 1 weight 0.10000E+01 volume 0.42265E-02 ppm1 6.702 ppm2 0.593 CV 1
OR { 218}
( segid " " and resid 358 and name HE% )
( segid " " and resid 362 and name HG2%)
ASSI { 505}
( segid " " and resid 337 and name HE% )
( segid " " and resid 230 and name HG2%)
2.400 0.700 0.700 peak 505 spectrum 1 weight 0.10000E+01 volume 0.81539E-02 ppm1 1.802 ppm2 0.982 CV 1
OR { 505}
( segid " " and resid 337 and name HE% )
( segid " " and resid 345 and name HG1%)
ASSI { 794}
( segid " " and resid 195 and name HB% )
(( segid " " and resid 193 and name HB2 ))
2.900 1.100 1.100 peak 794 spectrum 1 weight 0.10000E+01 volume 0.31268E-02 ppm1 1.358 ppm2 2.285 CV 1
OR { 794}
( segid " " and resid 195 and name HB% )
(( segid " " and resid 199 and name HG3 ))
OR { 794}
( segid " " and resid 195 and name HB% )
(( segid " " and resid 199 and name HG2 ))
ASSI { 898}
(( segid " " and resid 302 and name HG2 ))
(( segid " " and resid 302 and name H ))
3.700 1.700 1.700 peak 898 spectrum 1 weight 0.10000E+01 volume 0.33947E-02 ppm1 2.256 ppm2 7.990 CV 1
OR { 898}
(( segid " " and resid 302 and name HG2 ))
(( segid " " and resid 306 and name H ))
ASSI { 1324}
(( segid " " and resid 400 and name HA ))
(( segid " " and resid 401 and name H ))
3.300 1.400 1.400 peak 1324 spectrum 1 weight 0.10000E+01 volume 0.18270E-02 ppm1 3.902 ppm2 7.797 CV 1
OR { 1324}
(( segid " " and resid 289 and name HA ))
(( segid " " and resid 290 and name H ))
OR { 1324}
(( segid " " and resid 289 and name HA ))
(( segid " " and resid 292 and name H ))
ASSI { 930}
(( segid " " and resid 433 and name HG2 ))
(( segid " " and resid 409 and name HG ))
4.100 2.100 1.900 peak 930 spectrum 1 weight 0.10000E+01 volume 0.10742E-02 ppm1 2.240 ppm2 1.388 CV 1
OR { 930}
(( segid " " and resid 433 and name HG2 ))
(( segid " " and resid 429 and name HG ))
OR { 930}
(( segid " " and resid 433 and name HG2 ))
(( segid " " and resid 436 and name HB2 ))
OR { 930}
(( segid " " and resid 433 and name HG2 ))
(( segid " " and resid 429 and name HB2 ))
ASSI { 565}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 350 and name HB ))
4.100 2.200 1.900 peak 565 spectrum 1 weight 0.10000E+01 volume 0.52443E-03 ppm1 0.378 ppm2 2.457 CV 1
OR { 565}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 325 and name HG2 ))
OR { 565}
( segid " " and resid 318 and name HD1%)
(( segid " " and resid 287 and name HB3 ))
ASSI { 4193}
(( segid " " and resid 385 and name HA ))
(( segid " " and resid 385 and name HB2 ))
3.100 1.200 1.200 peak 4193 spectrum 1 weight 0.10000E+01 volume 0.12096E-02 ppm1 4.169 ppm2 2.696 CV 1
OR { 4193}
(( segid " " and resid 354 and name HA ))
(( segid " " and resid 354 and name HB3 ))
OR { 4193}
(( segid " " and resid 354 and name HA ))
(( segid " " and resid 354 and name HB2 ))
ASSI { 932}
( segid " " and resid 263 and name HG1%)
(( segid " " and resid 255 and name HB3 ))
2.400 0.700 0.700 peak 932 spectrum 1 weight 0.10000E+01 volume 0.41108E-02 ppm1 0.070 ppm2 1.093 CV 1
OR { 932}
( segid " " and resid 263 and name HG1%)
( segid " " and resid 262 and name HG2%)
ASSI { 1037}
(( segid " " and resid 306 and name HA ))
(( segid " " and resid 308 and name H ))
3.900 1.900 1.900 peak 1037 spectrum 1 weight 0.10000E+01 volume 0.58362E-03 ppm1 3.647 ppm2 7.081 CV 1
OR { 1037}
(( segid " " and resid 306 and name HA ))
(( segid " " and resid 310 and name H ))
OR { 1037}
(( segid " " and resid 306 and name HA ))
( segid " " and resid 303 and name HD% )
ASSI { 1180}
( segid " " and resid 412 and name HD2%)
( segid " " and resid 432 and name HG1%)
2.400 0.700 0.700 peak 1180 spectrum 1 weight 0.10000E+01 volume 0.96343E-02 ppm1 0.646 ppm2 1.113 CV 1
OR { 1180}
( segid " " and resid 429 and name HD2%)
( segid " " and resid 432 and name HG1%)
OR { 1180}
( segid " " and resid 429 and name HD2%)
( segid " " and resid 432 and name HG2%)
ASSI { 226}
( segid " " and resid 372 and name HG2%)
( segid " " and resid 371 and name HG1%)
3.400 1.500 1.500 peak 226 spectrum 1 weight 0.10000E+01 volume 0.52725E-02 ppm1 0.745 ppm2 0.379 CV 1
OR { 226}
( segid " " and resid 372 and name HG2%)
(( segid " " and resid 373 and name HB2 ))
ASSI { 242}
( segid " " and resid 429 and name HD2%)
(( segid " " and resid 430 and name HD1 ))
3.700 1.700 1.700 peak 242 spectrum 1 weight 0.10000E+01 volume 0.18834E-02 ppm1 0.651 ppm2 7.160 CV 1
OR { 242}
( segid " " and resid 278 and name HD1%)
( segid " " and resid 213 and name HE% )
ASSI { 1446}
( segid " " and resid 207 and name HG2%)
(( segid " " and resid 205 and name H ))
4.900 3.000 1.100 peak 1446 spectrum 1 weight 0.10000E+01 volume 0.60619E-03 ppm1 0.463 ppm2 6.322 CV 1
OR { 1446}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 374 and name H ))
OR { 1446}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 213 and name HZ ))
ASSI { 605}
(( segid " " and resid 377 and name HG2 ))
(( segid " " and resid 376 and name HA ))
4.000 2.000 2.000 peak 605 spectrum 1 weight 0.10000E+01 volume 0.11222E-02 ppm1 2.518 ppm2 3.873 CV 1
OR { 605}
(( segid " " and resid 183 and name HG2 ))
(( segid " " and resid 182 and name HA ))
OR { 605}
(( segid " " and resid 377 and name HG2 ))
(( segid " " and resid 405 and name HA ))
ASSI { 1233}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 309 and name HA ))
4.000 2.000 2.000 peak 1233 spectrum 1 weight 0.10000E+01 volume 0.26701E-02 ppm1 0.903 ppm2 4.167 CV 1
OR { 1233}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 307 and name HA ))
OR { 1233}
( segid " " and resid 267 and name HD2%)
(( segid " " and resid 265 and name HA ))
ASSI { 339}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 210 and name HB2 ))
4.100 2.100 1.900 peak 339 spectrum 1 weight 0.10000E+01 volume 0.22782E-02 ppm1 2.220 ppm2 1.551 CV 1
OR { 339}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 210 and name HG3 ))
OR { 339}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 378 and name HG2 ))
OR { 339}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 374 and name HD2 ))
OR { 339}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 374 and name HD3 ))
OR { 339}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 267 and name HB2 ))
ASSI { 3407}
( segid " " and resid 243 and name HD2%)
(( segid " " and resid 243 and name HG ))
2.200 0.600 0.600 peak 3407 spectrum 1 weight 0.10000E+01 volume 0.90420E-02 ppm1 0.165 ppm2 1.159 CV 1
OR { 3407}
( segid " " and resid 243 and name HD2%)
( segid " " and resid 246 and name HB% )
ASSI { 322}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 189 and name HA ))
4.400 2.400 1.600 peak 322 spectrum 1 weight 0.10000E+01 volume 0.89095E-03 ppm1 1.457 ppm2 4.386 CV 1
OR { 322}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 196 and name HA ))
OR { 322}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 201 and name HB ))
OR { 322}
( segid " " and resid 197 and name HB% )
(( segid " " and resid 209 and name HA ))
ASSI { 896}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 194 and name HG ))
3.000 1.100 1.100 peak 896 spectrum 1 weight 0.10000E+01 volume 0.33777E-02 ppm1 0.623 ppm2 1.344 CV 1
OR { 896}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 210 and name HB3 ))
OR { 896}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 208 and name HB2 ))
OR { 896}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 317 and name HB2 ))
OR { 896}
( segid " " and resid 198 and name HG2%)
( segid " " and resid 201 and name HG2%)
ASSI { 1285}
(( segid " " and resid 272 and name HG3 ))
(( segid " " and resid 273 and name H ))
3.700 1.700 1.700 peak 1285 spectrum 1 weight 0.10000E+01 volume 0.25911E-02 ppm1 1.798 ppm2 7.680 CV 1
OR { 1285}
(( segid " " and resid 272 and name HG3 ))
(( segid " " and resid 271 and name H ))
OR { 1285}
(( segid " " and resid 272 and name HG2 ))
(( segid " " and resid 273 and name H ))
OR { 1285}
(( segid " " and resid 272 and name HG2 ))
(( segid " " and resid 271 and name H ))
ASSI { 4201}
( segid " " and resid 329 and name HD1%)
(( segid " " and resid 342 and name HB ))
2.800 1.000 1.000 peak 4201 spectrum 1 weight 0.10000E+01 volume 0.35725E-02 ppm1 0.117 ppm2 1.716 CV 1
OR { 4201}
( segid " " and resid 329 and name HD1%)
(( segid " " and resid 329 and name HB ))
ASSI { 132}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 209 and name HA ))
4.500 2.500 1.500 peak 132 spectrum 1 weight 0.10000E+01 volume 0.60337E-03 ppm1 0.558 ppm2 4.380 CV 1
OR { 132}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 313 and name HA ))
OR { 132}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 276 and name HA ))
OR { 132}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 310 and name HA ))
ASSI { 1516}
( segid " " and resid 212 and name HG1%)
( segid " " and resid 274 and name HD2%)
3.600 1.600 1.600 peak 1516 spectrum 1 weight 0.10000E+01 volume 0.23571E-02 ppm1 -0.342 ppm2 0.768 CV 1
OR { 1516}
( segid " " and resid 212 and name HG1%)
( segid " " and resid 266 and name HD2%)
OR { 1516}
( segid " " and resid 212 and name HG1%)
( segid " " and resid 271 and name HD2%)
OR { 1516}
( segid " " and resid 212 and name HG1%)
(( segid " " and resid 209 and name HG ))
OR { 1516}
( segid " " and resid 212 and name HG1%)
( segid " " and resid 255 and name HD2%)
OR { 1516}
( segid " " and resid 212 and name HG1%)
( segid " " and resid 194 and name HD1%)
ASSI { 1118}
(( segid " " and resid 346 and name HB2 ))
(( segid " " and resid 346 and name H ))
2.800 1.000 1.000 peak 1118 spectrum 1 weight 0.10000E+01 volume 0.11673E-02 ppm1 1.704 ppm2 8.993 CV 1
OR { 1118}
(( segid " " and resid 346 and name HB2 ))
(( segid " " and resid 347 and name H ))
ASSI { 1194}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 199 and name HG2 ))
4.100 2.100 1.900 peak 1194 spectrum 1 weight 0.10000E+01 volume 0.19652E-02 ppm1 0.626 ppm2 2.274 CV 1
OR { 1194}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 199 and name HG3 ))
OR { 1194}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 202 and name HG2 ))
OR { 1194}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 213 and name HB2 ))
OR { 1194}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 202 and name HB3 ))
ASSI { 305}
( segid " " and resid 317 and name HD2%)
( segid " " and resid 373 and name HD1%)
4.800 2.900 1.200 peak 305 spectrum 1 weight 0.10000E+01 volume 0.65696E-03 ppm1 0.344 ppm2 -0.163 CV 1
OR { 305}
( segid " " and resid 317 and name HD2%)
( segid " " and resid 322 and name HD1%)
ASSI { 835}
(( segid " " and resid 234 and name HA ))
(( segid " " and resid 235 and name H ))
3.600 1.600 1.600 peak 835 spectrum 1 weight 0.10000E+01 volume 0.73871E-03 ppm1 4.186 ppm2 7.947 CV 1
OR { 835}
(( segid " " and resid 413 and name HA ))
(( segid " " and resid 416 and name H ))
ASSI { 2720}
(( segid " " and resid 239 and name HB3 ))
(( segid " " and resid 239 and name HE2 ))
3.900 1.900 1.900 peak 2720 spectrum 1 weight 0.10000E+01 volume 0.21879E-02 ppm1 1.757 ppm2 2.954 CV 1
OR { 2720}
(( segid " " and resid 239 and name HB3 ))
(( segid " " and resid 239 and name HE3 ))
OR { 2720}
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OR { 2720}
(( segid " " and resid 281 and name HB2 ))
(( segid " " and resid 281 and name HE3 ))
ASSI { 724}
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(( segid " " and resid 426 and name H ))
4.200 2.200 1.800 peak 724 spectrum 1 weight 0.10000E+01 volume 0.12237E-02 ppm1 3.905 ppm2 8.010 CV 1
OR { 724}
(( segid " " and resid 424 and name HB3 ))
(( segid " " and resid 426 and name H ))
OR { 724}
(( segid " " and resid 424 and name HB3 ))
(( segid " " and resid 427 and name H ))
OR { 724}
(( segid " " and resid 424 and name HB2 ))
(( segid " " and resid 427 and name H ))
ASSI { 1424}
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( segid " " and resid 357 and name HD2%)
2.100 0.600 0.600 peak 1424 spectrum 1 weight 0.10000E+01 volume 0.13908E-01 ppm1 0.676 ppm2 0.880 CV 1
OR { 1424}
( segid " " and resid 357 and name HD1%)
( segid " " and resid 346 and name HD1%)
ASSI { 751}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 198 and name HA ))
2.400 0.700 0.700 peak 751 spectrum 1 weight 0.10000E+01 volume 0.45508E-02 ppm1 0.624 ppm2 2.888 CV 1
OR { 751}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 210 and name HD3 ))
OR { 751}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 313 and name HB2 ))
OR { 751}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 313 and name HB3 ))
ASSI { 607}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 364 and name HG2%)
2.600 0.800 0.800 peak 607 spectrum 1 weight 0.10000E+01 volume 0.45734E-02 ppm1 0.399 ppm2 0.906 CV 1
OR { 607}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 325 and name HE% )
OR { 607}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 321 and name HD1%)
OR { 607}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 371 and name HG2%)
ASSI { 216}
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(( segid " " and resid 334 and name HA ))
2.900 1.100 1.100 peak 216 spectrum 1 weight 0.10000E+01 volume 0.55179E-02 ppm1 2.146 ppm2 4.418 CV 1
OR { 216}
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(( segid " " and resid 226 and name HA ))
ASSI { 175}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 342 and name HB ))
2.100 0.600 0.600 peak 175 spectrum 1 weight 0.10000E+01 volume 0.85009E-02 ppm1 0.514 ppm2 1.716 CV 1
OR { 175}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 346 and name HB2 ))
OR { 175}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 325 and name HB2 ))
OR { 175}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 346 and name HG ))
ASSI { 873}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 278 and name HG ))
4.500 2.500 1.500 peak 873 spectrum 1 weight 0.10000E+01 volume 0.12970E-02 ppm1 0.169 ppm2 1.704 CV 1
OR { 873}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 352 and name HG12))
OR { 873}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 321 and name HG ))
OR { 873}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 286 and name HG3 ))
OR { 873}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 281 and name HD3 ))
OR { 873}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 286 and name HG2 ))
OR { 873}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 281 and name HD2 ))
ASSI { 1622}
(( segid " " and resid 252 and name HB2 ))
(( segid " " and resid 251 and name HG3 ))
3.200 3.200 2.800 peak 1622 spectrum 1 weight 0.10000E+01 volume 0.43421E-03 ppm1 3.735 ppm2 2.180 CV 1
OR { 1622}
(( segid " " and resid 252 and name HB2 ))
(( segid " " and resid 251 and name HG2 ))
OR { 1622}
(( segid " " and resid 252 and name HB2 ))
(( segid " " and resid 242 and name HG2 ))
OR { 1622}
(( segid " " and resid 252 and name HB2 ))
(( segid " " and resid 242 and name HB3 ))
ASSI { 1011}
( segid " " and resid 359 and name HG2%)
(( segid " " and resid 363 and name HB3 ))
3.800 1.800 1.800 peak 1011 spectrum 1 weight 0.10000E+01 volume 0.72743E-03 ppm1 -0.458 ppm2 2.586 CV 1
OR { 1011}
( segid " " and resid 359 and name HG2%)
(( segid " " and resid 361 and name HB3 ))
ASSI { 1169}
(( segid " " and resid 346 and name HB2 ))
( segid " " and resid 346 and name HD1%)
2.700 0.900 0.900 peak 1169 spectrum 1 weight 0.10000E+01 volume 0.36426E-02 ppm1 1.708 ppm2 0.842 CV 1
OR { 1169}
(( segid " " and resid 346 and name HB2 ))
( segid " " and resid 357 and name HD2%)
ASSI { 292}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 310 and name HB3 ))
5.000 3.100 1.000 peak 292 spectrum 1 weight 0.10000E+01 volume 0.69923E-03 ppm1 0.169 ppm2 1.980 CV 1
OR { 292}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 277 and name HB3 ))
OR { 292}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 321 and name HB2 ))
OR { 292}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 356 and name HB ))
OR { 292}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 351 and name HB2 ))
ASSI { 891}
(( segid " " and resid 276 and name HG2 ))
(( segid " " and resid 281 and name HG2 ))
4.100 2.100 1.900 peak 891 spectrum 1 weight 0.10000E+01 volume 0.19708E-02 ppm1 2.358 ppm2 1.396 CV 1
OR { 891}
(( segid " " and resid 276 and name HG2 ))
(( segid " " and resid 281 and name HG3 ))
OR { 891}
(( segid " " and resid 276 and name HG2 ))
(( segid " " and resid 279 and name HB3 ))
OR { 891}
(( segid " " and resid 276 and name HG2 ))
(( segid " " and resid 310 and name HB2 ))
OR { 891}
(( segid " " and resid 276 and name HG2 ))
(( segid " " and resid 279 and name HG ))
ASSI { 823}
( segid " " and resid 255 and name HD1%)
(( segid " " and resid 263 and name HA ))
4.000 2.000 2.000 peak 823 spectrum 1 weight 0.10000E+01 volume 0.13928E-02 ppm1 0.599 ppm2 3.178 CV 1
OR { 823}
( segid " " and resid 255 and name HD1%)
(( segid " " and resid 219 and name HB3 ))
OR { 823}
( segid " " and resid 255 and name HD1%)
(( segid " " and resid 219 and name HB2 ))
ASSI { 955}
(( segid " " and resid 319 and name HA ))
( segid " " and resid 318 and name HG2%)
3.700 1.700 1.700 peak 955 spectrum 1 weight 0.10000E+01 volume 0.10319E-02 ppm1 2.283 ppm2 0.370 CV 1
OR { 955}
(( segid " " and resid 319 and name HA ))
( segid " " and resid 371 and name HG1%)
OR { 955}
(( segid " " and resid 319 and name HA ))
( segid " " and resid 318 and name HD1%)
OR { 955}
(( segid " " and resid 319 and name HA ))
( segid " " and resid 322 and name HG2%)
ASSI { 840}
( segid " " and resid 438 and name HB% )
( segid " " and resid 435 and name HG2%)
3.000 1.100 1.100 peak 840 spectrum 1 weight 0.10000E+01 volume 0.44041E-02 ppm1 1.601 ppm2 0.880 CV 1
OR { 840}
( segid " " and resid 438 and name HB% )
( segid " " and resid 435 and name HD1%)
OR { 840}
( segid " " and resid 438 and name HB% )
( segid " " and resid 439 and name HD2%)
ASSI { 198}
( segid " " and resid 357 and name HD2%)
( segid " " and resid 356 and name HG2%)
3.300 1.300 1.300 peak 198 spectrum 1 weight 0.10000E+01 volume 0.17453E-02 ppm1 0.867 ppm2 0.386 CV 1
OR { 198}
( segid " " and resid 357 and name HD2%)
( segid " " and resid 279 and name HD2%)
OR { 198}
( segid " " and resid 357 and name HD2%)
( segid " " and resid 322 and name HG2%)
OR { 198}
( segid " " and resid 357 and name HD2%)
( segid " " and resid 318 and name HD1%)
ASSI { 1592}
( segid " " and resid 323 and name HG1%)
(( segid " " and resid 371 and name HB ))
2.500 0.800 0.800 peak 1592 spectrum 1 weight 0.10000E+01 volume 0.95469E-02 ppm1 0.777 ppm2 1.947 CV 1
OR { 1592}
( segid " " and resid 323 and name HG1%)
(( segid " " and resid 365 and name HB3 ))
OR { 1592}
( segid " " and resid 323 and name HG1%)
(( segid " " and resid 365 and name HB2 ))
ASSI { 983}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 351 and name HG3 ))
4.400 2.400 1.600 peak 983 spectrum 1 weight 0.10000E+01 volume 0.10742E-02 ppm1 0.731 ppm2 2.045 CV 1
OR { 983}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 351 and name HB2 ))
OR { 983}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 357 and name HB2 ))
ASSI { 1184}
( segid " " and resid 352 and name HG2%)
(( segid " " and resid 356 and name HA ))
4.200 2.300 1.800 peak 1184 spectrum 1 weight 0.10000E+01 volume 0.16099E-02 ppm1 0.905 ppm2 3.619 CV 1
OR { 1184}
( segid " " and resid 435 and name HG2%)
(( segid " " and resid 432 and name HA ))
ASSI { 397}
(( segid " " and resid 195 and name HA ))
(( segid " " and resid 198 and name HB ))
3.300 1.400 1.400 peak 397 spectrum 1 weight 0.10000E+01 volume 0.13759E-02 ppm1 3.895 ppm2 2.049 CV 1
OR { 397}
(( segid " " and resid 197 and name HA ))
(( segid " " and resid 200 and name HB3 ))
OR { 397}
(( segid " " and resid 197 and name HA ))
(( segid " " and resid 200 and name HB2 ))
OR { 397}
(( segid " " and resid 197 and name HA ))
(( segid " " and resid 198 and name HB ))
OR { 397}
(( segid " " and resid 195 and name HA ))
(( segid " " and resid 199 and name HB3 ))
OR { 397}
(( segid " " and resid 195 and name HA ))
(( segid " " and resid 193 and name HG2 ))
ASSI { 258}
( segid " " and resid 279 and name HD2%)
(( segid " " and resid 279 and name HB2 ))
2.700 0.900 0.900 peak 258 spectrum 1 weight 0.10000E+01 volume 0.22274E-02 ppm1 0.367 ppm2 1.573 CV 1
OR { 258}
( segid " " and resid 279 and name HD2%)
(( segid " " and resid 278 and name HB3 ))
OR { 258}
( segid " " and resid 279 and name HD2%)
(( segid " " and resid 352 and name HG13))
ASSI { 2278}
(( segid " " and resid 281 and name HD2 ))
(( segid " " and resid 281 and name HB3 ))
2.300 0.700 0.700 peak 2278 spectrum 1 weight 0.10000E+01 volume 0.80806E-02 ppm1 1.663 ppm2 1.901 CV 1
OR { 2278}
(( segid " " and resid 344 and name HG12))
(( segid " " and resid 344 and name HB ))
OR { 2278}
(( segid " " and resid 281 and name HD3 ))
(( segid " " and resid 281 and name HB3 ))
ASSI { 1288}
(( segid " " and resid 346 and name HA ))
( segid " " and resid 342 and name HG2%)
4.400 2.400 1.600 peak 1288 spectrum 1 weight 0.10000E+01 volume 0.10939E-02 ppm1 4.066 ppm2 0.546 CV 1
OR { 1288}
(( segid " " and resid 218 and name HA ))
(( segid " " and resid 217 and name HG12))
OR { 1288}
(( segid " " and resid 218 and name HA ))
( segid " " and resid 373 and name HD2%)
ASSI { 894}
( segid " " and resid 315 and name HE% )
( segid " " and resid 318 and name HG2%)
4.100 2.100 1.900 peak 894 spectrum 1 weight 0.10000E+01 volume 0.15733E-02 ppm1 6.874 ppm2 0.360 CV 1
OR { 894}
( segid " " and resid 315 and name HE% )
( segid " " and resid 371 and name HG1%)
OR { 894}
( segid " " and resid 315 and name HE% )
( segid " " and resid 318 and name HD1%)
ASSI { 1648}
(( segid " " and resid 199 and name HG3 ))
( segid " " and resid 195 and name HB% )
2.500 2.500 3.500 peak 1648 spectrum 1 weight 0.10000E+01 volume 0.48551E-02 ppm1 2.281 ppm2 1.356 CV 1
OR { 1648}
(( segid " " and resid 199 and name HG2 ))
( segid " " and resid 195 and name HB% )
OR { 1648}
(( segid " " and resid 401 and name HG2 ))
(( segid " " and resid 404 and name HG3 ))
OR { 1648}
(( segid " " and resid 401 and name HG3 ))
(( segid " " and resid 404 and name HG3 ))
OR { 1648}
(( segid " " and resid 199 and name HG3 ))
(( segid " " and resid 194 and name HG ))
OR { 1648}
(( segid " " and resid 199 and name HG2 ))
(( segid " " and resid 194 and name HG ))
OR { 1648}
(( segid " " and resid 199 and name HG2 ))
(( segid " " and resid 210 and name HB3 ))
OR { 1648}
(( segid " " and resid 199 and name HG3 ))
(( segid " " and resid 210 and name HB3 ))
OR { 1648}
(( segid " " and resid 401 and name HG3 ))
(( segid " " and resid 440 and name HG2 ))
ASSI { 1029}
(( segid " " and resid 318 and name HB ))
( segid " " and resid 360 and name HE% )
5.100 3.300 0.900 peak 1029 spectrum 1 weight 0.10000E+01 volume 0.62029E-03 ppm1 1.351 ppm2 7.050 CV 1
OR { 1029}
(( segid " " and resid 318 and name HB ))
( segid " " and resid 315 and name HD% )
OR { 1029}
(( segid " " and resid 318 and name HB ))
( segid " " and resid 360 and name HD% )
ASSI { 1386}
(( segid " " and resid 430 and name HZ2 ))
(( segid " " and resid 423 and name HG ))
3.200 3.200 2.800 peak 1386 spectrum 1 weight 0.10000E+01 volume 0.35244E-03 ppm1 7.308 ppm2 1.614 CV 1
OR { 1386}
(( segid " " and resid 430 and name HZ2 ))
(( segid " " and resid 423 and name HB3 ))
OR { 1386}
(( segid " " and resid 430 and name HZ2 ))
(( segid " " and resid 425 and name HB2 ))
OR { 1386}
(( segid " " and resid 430 and name HZ2 ))
(( segid " " and resid 416 and name HG ))
OR { 1386}
(( segid " " and resid 430 and name HZ2 ))
(( segid " " and resid 421 and name HD2 ))
OR { 1386}
(( segid " " and resid 430 and name HZ2 ))
(( segid " " and resid 416 and name HB3 ))
ASSI { 1429}
(( segid " " and resid 346 and name HB3 ))
( segid " " and resid 361 and name HE% )
5.100 3.300 0.900 peak 1429 spectrum 1 weight 0.10000E+01 volume 0.38908E-03 ppm1 1.478 ppm2 7.015 CV 1
OR { 1429}
(( segid " " and resid 346 and name HB3 ))
(( segid " " and resid 345 and name H ))
OR { 1429}
(( segid " " and resid 346 and name HB3 ))
(( segid " " and resid 352 and name H ))
ASSI { 1006}
(( segid " " and resid 413 and name HE1 ))
( segid " " and resid 416 and name HD2%)
4.300 2.300 1.700 peak 1006 spectrum 1 weight 0.10000E+01 volume 0.10489E-02 ppm1 7.621 ppm2 0.758 CV 1
OR { 1006}
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( segid " " and resid 409 and name HD2%)
OR { 1006}
(( segid " " and resid 413 and name HE1 ))
( segid " " and resid 409 and name HD1%)
ASSI { 4205}
(( segid " " and resid 406 and name HG3 ))
(( segid " " and resid 406 and name HA ))
3.900 1.900 1.900 peak 4205 spectrum 1 weight 0.10000E+01 volume 0.54981E-03 ppm1 2.095 ppm2 4.089 CV 1
OR { 4205}
(( segid " " and resid 406 and name HG3 ))
(( segid " " and resid 403 and name HA ))
ASSI { 982}
( segid " " and resid 317 and name HD2%)
(( segid " " and resid 314 and name HA ))
3.400 1.400 1.400 peak 982 spectrum 1 weight 0.10000E+01 volume 0.22838E-02 ppm1 0.345 ppm2 3.817 CV 1
OR { 982}
( segid " " and resid 317 and name HD2%)
(( segid " " and resid 278 and name HA ))
OR { 982}
( segid " " and resid 317 and name HD2%)
(( segid " " and resid 315 and name HA ))
ASSI { 181}
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(( segid " " and resid 392 and name HB3 ))
4.500 2.500 1.500 peak 181 spectrum 1 weight 0.10000E+01 volume 0.85714E-03 ppm1 3.163 ppm2 1.662 CV 1
OR { 181}
(( segid " " and resid 392 and name HD2 ))
(( segid " " and resid 391 and name HG ))
ASSI { 4790}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 325 and name H ))
3.600 1.700 1.700 peak 4790 spectrum 1 weight 0.10000E+01 volume 0.33101E-02 ppm1 -0.047 ppm2 8.496 CV 1
OR { 4790}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 324 and name H ))
ASSI { 1568}
(( segid " " and resid 272 and name HD3 ))
(( segid " " and resid 349 and name HA ))
2.600 0.800 0.800 peak 1568 spectrum 1 weight 0.10000E+01 volume 0.49228E-02 ppm1 3.227 ppm2 3.936 CV 1
OR { 1568}
(( segid " " and resid 272 and name HD2 ))
(( segid " " and resid 349 and name HA ))
OR { 1568}
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(( segid " " and resid 197 and name HA ))
OR { 1568}
(( segid " " and resid 200 and name HD2 ))
(( segid " " and resid 197 and name HA ))
OR { 1568}
(( segid " " and resid 403 and name HD2 ))
(( segid " " and resid 400 and name HA ))
OR { 1568}
(( segid " " and resid 403 and name HD3 ))
(( segid " " and resid 400 and name HA ))
ASSI { 161}
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( segid " " and resid 315 and name HD% )
3.100 1.200 1.200 peak 161 spectrum 1 weight 0.10000E+01 volume 0.58926E-02 ppm1 1.029 ppm2 7.069 CV 1
OR { 161}
( segid " " and resid 307 and name HD2%)
( segid " " and resid 360 and name HE% )
OR { 161}
( segid " " and resid 307 and name HD2%)
( segid " " and resid 303 and name HD% )
OR { 161}
( segid " " and resid 307 and name HD2%)
(( segid " " and resid 308 and name H ))
OR { 161}
( segid " " and resid 307 and name HD2%)
(( segid " " and resid 310 and name H ))
ASSI { 347}
(( segid " " and resid 185 and name HB2 ))
(( segid " " and resid 184 and name HB2 ))
4.300 2.300 1.700 peak 347 spectrum 1 weight 0.10000E+01 volume 0.55827E-03 ppm1 2.754 ppm2 2.174 CV 1
OR { 347}
(( segid " " and resid 185 and name HB2 ))
(( segid " " and resid 188 and name HB3 ))
OR { 347}
(( segid " " and resid 185 and name HB2 ))
(( segid " " and resid 188 and name HB2 ))
ASSI { 3753}
(( segid " " and resid 415 and name HA ))
(( segid " " and resid 415 and name HB3 ))
3.400 1.500 1.500 peak 3753 spectrum 1 weight 0.10000E+01 volume 0.12660E-02 ppm1 4.394 ppm2 2.593 CV 1
OR { 3753}
(( segid " " and resid 196 and name HA ))
(( segid " " and resid 196 and name HB2 ))
ASSI { 871}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 277 and name HD21))
4.500 2.600 1.500 peak 871 spectrum 1 weight 0.10000E+01 volume 0.10009E-02 ppm1 2.588 ppm2 7.644 CV 1
OR { 871}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 277 and name HD21))
OR { 871}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 280 and name H ))
OR { 871}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 280 and name H ))
ASSI { 4662}
(( segid " " and resid 288 and name HG3 ))
(( segid " " and resid 288 and name H ))
3.100 1.200 1.200 peak 4662 spectrum 1 weight 0.10000E+01 volume 0.47620E-02 ppm1 2.162 ppm2 7.491 CV 1
OR { 4662}
(( segid " " and resid 309 and name HG3 ))
(( segid " " and resid 309 and name H ))
ASSI { 1556}
(( segid " " and resid 305 and name HD2 ))
(( segid " " and resid 305 and name H ))
3.900 1.900 1.900 peak 1556 spectrum 1 weight 0.10000E+01 volume 0.26672E-02 ppm1 3.144 ppm2 7.451 CV 1
OR { 1556}
(( segid " " and resid 305 and name HD2 ))
(( segid " " and resid 309 and name H ))
ASSI { 1576}
( segid " " and resid 303 and name HE% )
(( segid " " and resid 303 and name HA ))
4.400 2.400 1.600 peak 1576 spectrum 1 weight 0.10000E+01 volume 0.50469E-03 ppm1 6.807 ppm2 3.835 CV 1
OR { 1576}
( segid " " and resid 303 and name HE% )
(( segid " " and resid 288 and name HA ))
OR { 1576}
( segid " " and resid 303 and name HE% )
(( segid " " and resid 357 and name HA ))
ASSI { 944}
(( segid " " and resid 415 and name HB2 ))
( segid " " and resid 420 and name HG2%)
4.300 2.300 1.700 peak 944 spectrum 1 weight 0.10000E+01 volume 0.85150E-03 ppm1 2.759 ppm2 0.849 CV 1
OR { 944}
(( segid " " and resid 415 and name HB2 ))
( segid " " and resid 416 and name HD1%)
ASSI { 2540}
(( segid " " and resid 330 and name HA ))
(( segid " " and resid 330 and name H ))
3.100 1.200 1.200 peak 2540 spectrum 1 weight 0.10000E+01 volume 0.15761E-02 ppm1 4.117 ppm2 8.629 CV 1
OR { 2540}
(( segid " " and resid 330 and name HA ))
(( segid " " and resid 333 and name H ))
ASSI { 2344}
(( segid " " and resid 281 and name HB2 ))
(( segid " " and resid 281 and name HG3 ))
2.000 0.500 0.500 peak 2344 spectrum 1 weight 0.10000E+01 volume 0.13985E-01 ppm1 1.753 ppm2 1.396 CV 1
OR { 2344}
(( segid " " and resid 281 and name HB2 ))
(( segid " " and resid 281 and name HG2 ))
OR { 2344}
(( segid " " and resid 239 and name HB3 ))
(( segid " " and resid 239 and name HG2 ))
ASSI { 966}
(( segid " " and resid 367 and name HA ))
(( segid " " and resid 304 and name HE22))
4.500 2.600 1.500 peak 966 spectrum 1 weight 0.10000E+01 volume 0.63721E-03 ppm1 4.033 ppm2 7.039 CV 1
OR { 966}
(( segid " " and resid 367 and name HA ))
( segid " " and resid 303 and name HD% )
ASSI { 4142}
(( segid " " and resid 370 and name HB3 ))
(( segid " " and resid 370 and name HD22))
3.700 1.700 1.700 peak 4142 spectrum 1 weight 0.10000E+01 volume 0.22443E-02 ppm1 2.757 ppm2 7.534 CV 1
OR { 4142}
(( segid " " and resid 370 and name HB2 ))
(( segid " " and resid 370 and name HD22))
OR { 4142}
(( segid " " and resid 370 and name HB3 ))
(( segid " " and resid 371 and name H ))
OR { 4142}
(( segid " " and resid 370 and name HB2 ))
(( segid " " and resid 371 and name H ))
ASSI { 886}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 351 and name H ))
3.100 3.100 2.900 peak 886 spectrum 1 weight 0.10000E+01 volume 0.45113E-03 ppm1 0.602 ppm2 7.872 CV 1
OR { 886}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 367 and name H ))
ASSI { 977}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 351 and name HB3 ))
4.500 2.500 1.500 peak 977 spectrum 1 weight 0.10000E+01 volume 0.13139E-02 ppm1 0.732 ppm2 2.140 CV 1
OR { 977}
( segid " " and resid 350 and name HG2%)
( segid " " and resid 284 and name HE% )
OR { 977}
( segid " " and resid 350 and name HG2%)
(( segid " " and resid 351 and name HG2 ))
ASSI { 1510}
(( segid " " and resid 364 and name HB ))
( segid " " and resid 322 and name HG2%)
2.700 0.900 0.900 peak 1510 spectrum 1 weight 0.10000E+01 volume 0.92761E-03 ppm1 2.120 ppm2 0.400 CV 1
OR { 1510}
(( segid " " and resid 364 and name HB ))
( segid " " and resid 323 and name HG2%)
ASSI { 527}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 218 and name HA ))
3.300 1.400 1.400 peak 527 spectrum 1 weight 0.10000E+01 volume 0.11588E-02 ppm1 0.462 ppm2 4.045 CV 1
OR { 527}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 374 and name HA ))
ASSI { 432}
(( segid " " and resid 268 and name HG2 ))
(( segid " " and resid 268 and name HB3 ))
2.400 0.700 0.700 peak 432 spectrum 1 weight 0.10000E+01 volume 0.62114E-02 ppm1 1.252 ppm2 1.818 CV 1
OR { 432}
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(( segid " " and resid 268 and name HB2 ))
OR { 432}
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(( segid " " and resid 268 and name HB3 ))
OR { 432}
(( segid " " and resid 268 and name HG3 ))
(( segid " " and resid 268 and name HB3 ))
OR { 432}
(( segid " " and resid 268 and name HG2 ))
(( segid " " and resid 268 and name HB2 ))
OR { 432}
( segid " " and resid 349 and name HG2%)
(( segid " " and resid 268 and name HB2 ))
OR { 432}
( segid " " and resid 349 and name HG2%)
(( segid " " and resid 272 and name HG3 ))
OR { 432}
( segid " " and resid 349 and name HG2%)
(( segid " " and resid 272 and name HG2 ))
ASSI { 469}
(( segid " " and resid 302 and name HG3 ))
(( segid " " and resid 305 and name HD2 ))
3.700 1.700 1.700 peak 469 spectrum 1 weight 0.10000E+01 volume 0.74999E-03 ppm1 2.072 ppm2 3.082 CV 1
OR { 469}
(( segid " " and resid 302 and name HG3 ))
(( segid " " and resid 305 and name HD3 ))
OR { 469}
(( segid " " and resid 302 and name HG3 ))
(( segid " " and resid 286 and name HD3 ))
OR { 469}
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(( segid " " and resid 327 and name HB3 ))
OR { 469}
(( segid " " and resid 221 and name HG2 ))
(( segid " " and resid 327 and name HB2 ))
OR { 469}
(( segid " " and resid 302 and name HG3 ))
(( segid " " and resid 287 and name HB2 ))
ASSI { 1560}
( segid " " and resid 367 and name HD2%)
(( segid " " and resid 363 and name H ))
2.700 2.700 3.300 peak 1560 spectrum 1 weight 0.10000E+01 volume 0.16297E-02 ppm1 0.780 ppm2 7.281 CV 1
OR { 1560}
( segid " " and resid 367 and name HD2%)
(( segid " " and resid 360 and name H ))
OR { 1560}
( segid " " and resid 367 and name HD2%)
(( segid " " and resid 320 and name HD1 ))
ASSI { 369}
(( segid " " and resid 357 and name HA ))
( segid " " and resid 360 and name HD% )
3.000 1.200 1.200 peak 369 spectrum 1 weight 0.10000E+01 volume 0.12349E-02 ppm1 3.874 ppm2 7.078 CV 1
OR { 369}
(( segid " " and resid 357 and name HA ))
( segid " " and resid 361 and name HE% )
OR { 369}
(( segid " " and resid 357 and name HA ))
( segid " " and resid 360 and name HE% )
ASSI { 296}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 325 and name HG2 ))
3.000 1.100 1.100 peak 296 spectrum 1 weight 0.10000E+01 volume 0.23627E-02 ppm1 0.515 ppm2 2.396 CV 1
OR { 296}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 328 and name HB ))
ASSI { 4544}
(( segid " " and resid 358 and name HB2 ))
(( segid " " and resid 358 and name HA ))
2.800 1.000 1.000 peak 4544 spectrum 1 weight 0.10000E+01 volume 0.15817E-02 ppm1 3.275 ppm2 4.008 CV 1
OR { 4544}
(( segid " " and resid 358 and name HB2 ))
(( segid " " and resid 355 and name HA ))
ASSI { 1558}
( segid " " and resid 432 and name HG2%)
( segid " " and resid 436 and name HD2%)
2.400 0.700 0.700 peak 1558 spectrum 1 weight 0.10000E+01 volume 0.11244E-01 ppm1 1.088 ppm2 0.851 CV 1
OR { 1558}
( segid " " and resid 432 and name HG2%)
( segid " " and resid 408 and name HD2%)
OR { 1558}
( segid " " and resid 432 and name HG1%)
( segid " " and resid 436 and name HD2%)
OR { 1558}
( segid " " and resid 432 and name HG2%)
( segid " " and resid 435 and name HG2%)
OR { 1558}
( segid " " and resid 432 and name HG1%)
( segid " " and resid 408 and name HD2%)
OR { 1558}
( segid " " and resid 432 and name HG1%)
( segid " " and resid 435 and name HG2%)
OR { 1558}
( segid " " and resid 432 and name HG2%)
( segid " " and resid 435 and name HD1%)
OR { 1558}
( segid " " and resid 432 and name HG1%)
( segid " " and resid 435 and name HD1%)
ASSI { 383}
( segid " " and resid 253 and name HG2%)
(( segid " " and resid 244 and name HA ))
3.800 1.800 1.800 peak 383 spectrum 1 weight 0.10000E+01 volume 0.81483E-03 ppm1 0.614 ppm2 3.235 CV 1
OR { 383}
( segid " " and resid 253 and name HG2%)
(( segid " " and resid 240 and name HA ))
OR { 383}
( segid " " and resid 253 and name HG2%)
(( segid " " and resid 219 and name HB3 ))
OR { 383}
( segid " " and resid 253 and name HG2%)
(( segid " " and resid 219 and name HB2 ))
ASSI { 409}
(( segid " " and resid 350 and name HB ))
(( segid " " and resid 352 and name H ))
4.500 2.600 1.500 peak 409 spectrum 1 weight 0.10000E+01 volume 0.51879E-03 ppm1 2.490 ppm2 7.043 CV 1
OR { 409}
(( segid " " and resid 350 and name HB ))
( segid " " and resid 360 and name HE% )
ASSI { 439}
(( segid " " and resid 392 and name HD2 ))
(( segid " " and resid 391 and name HA ))
3.700 1.800 1.800 peak 439 spectrum 1 weight 0.10000E+01 volume 0.61465E-03 ppm1 3.161 ppm2 4.355 CV 1
OR { 439}
(( segid " " and resid 392 and name HD2 ))
(( segid " " and resid 392 and name HA ))
ASSI { 1366}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 283 and name HB2 ))
3.500 1.500 1.500 peak 1366 spectrum 1 weight 0.10000E+01 volume 0.31014E-02 ppm1 0.379 ppm2 2.293 CV 1
OR { 1366}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 309 and name HG2 ))
OR { 1366}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 302 and name HG2 ))
ASSI { 1007}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 230 and name H ))
3.700 1.700 1.700 peak 1007 spectrum 1 weight 0.10000E+01 volume 0.10122E-02 ppm1 0.656 ppm2 7.133 CV 1
OR { 1007}
( segid " " and resid 342 and name HD1%)
( segid " " and resid 361 and name HD% )
OR { 1007}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 349 and name H ))
OR { 1007}
( segid " " and resid 342 and name HD1%)
( segid " " and resid 360 and name HD% )
ASSI { 1632}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 198 and name HB ))
4.500 2.500 1.500 peak 1632 spectrum 1 weight 0.10000E+01 volume 0.61465E-03 ppm1 0.550 ppm2 2.044 CV 1
OR { 1632}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 311 and name HB2 ))
OR { 1632}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 310 and name HB3 ))
OR { 1632}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 193 and name HG2 ))
OR { 1632}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 275 and name HB2 ))
ASSI { 1023}
(( segid " " and resid 283 and name HB2 ))
(( segid " " and resid 283 and name HG ))
2.800 1.000 1.000 peak 1023 spectrum 1 weight 0.10000E+01 volume 0.10573E-02 ppm1 2.326 ppm2 1.579 CV 1
OR { 1023}
(( segid " " and resid 283 and name HB2 ))
(( segid " " and resid 279 and name HB2 ))
ASSI { 4391}
(( segid " " and resid 304 and name HG3 ))
(( segid " " and resid 304 and name HE21))
2.400 0.700 0.700 peak 4391 spectrum 1 weight 0.10000E+01 volume 0.35862E-02 ppm1 2.294 ppm2 6.671 CV 1
OR { 4391}
(( segid " " and resid 301 and name HG3 ))
(( segid " " and resid 301 and name HE21))
ASSI { 1538}
( segid " " and resid 267 and name HD2%)
( segid " " and resid 213 and name HE% )
3.100 1.200 1.200 peak 1538 spectrum 1 weight 0.10000E+01 volume 0.38542E-02 ppm1 0.904 ppm2 7.069 CV 1
OR { 1538}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 310 and name H ))
OR { 1538}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 308 and name H ))
OR { 1538}
( segid " " and resid 267 and name HD2%)
( segid " " and resid 361 and name HE% )
ASSI { 576}
(( segid " " and resid 318 and name HB ))
(( segid " " and resid 318 and name HG13))
2.900 1.000 1.000 peak 576 spectrum 1 weight 0.10000E+01 volume 0.37526E-02 ppm1 1.355 ppm2 0.628 CV 1
OR { 576}
(( segid " " and resid 318 and name HB ))
( segid " " and resid 278 and name HD1%)
OR { 576}
(( segid " " and resid 318 and name HB ))
( segid " " and resid 321 and name HD2%)
ASSI { 4208}
( segid " " and resid 344 and name HD1%)
(( segid " " and resid 346 and name H ))
2.800 2.800 3.200 peak 4208 spectrum 1 weight 0.10000E+01 volume 0.76128E-03 ppm1 0.818 ppm2 8.993 CV 1
OR { 4208}
( segid " " and resid 344 and name HD1%)
(( segid " " and resid 347 and name H ))
ASSI { 392}
(( segid " " and resid 232 and name HA ))
(( segid " " and resid 232 and name HB2 ))
3.300 1.400 1.400 peak 392 spectrum 1 weight 0.10000E+01 volume 0.11983E-02 ppm1 4.431 ppm2 1.505 CV 1
OR { 392}
(( segid " " and resid 232 and name HA ))
(( segid " " and resid 232 and name HG3 ))
OR { 392}
(( segid " " and resid 232 and name HA ))
(( segid " " and resid 232 and name HG2 ))
OR { 392}
(( segid " " and resid 327 and name HA ))
( segid " " and resid 330 and name HB% )
ASSI { 993}
( segid " " and resid 198 and name HG1%)
(( segid " " and resid 198 and name HA ))
2.700 0.900 0.900 peak 993 spectrum 1 weight 0.10000E+01 volume 0.41926E-02 ppm1 0.598 ppm2 2.901 CV 1
OR { 993}
( segid " " and resid 198 and name HG1%)
(( segid " " and resid 208 and name HD3 ))
OR { 993}
( segid " " and resid 198 and name HG1%)
(( segid " " and resid 210 and name HD3 ))
ASSI { 1371}
(( segid " " and resid 291 and name HA ))
( segid " " and resid 290 and name HB% )
3.500 1.500 1.500 peak 1371 spectrum 1 weight 0.10000E+01 volume 0.16889E-02 ppm1 3.960 ppm2 1.533 CV 1
OR { 1371}
(( segid " " and resid 291 and name HA ))
(( segid " " and resid 293 and name HG2 ))
ASSI { 4566}
(( segid " " and resid 242 and name HA ))
(( segid " " and resid 242 and name H ))
2.700 0.900 0.900 peak 4566 spectrum 1 weight 0.10000E+01 volume 0.41813E-02 ppm1 4.005 ppm2 7.547 CV 1
OR { 4566}
(( segid " " and resid 242 and name HA ))
(( segid " " and resid 245 and name H ))
ASSI { 108}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 221 and name HB3 ))
3.600 1.600 1.600 peak 108 spectrum 1 weight 0.10000E+01 volume 0.21428E-02 ppm1 0.462 ppm2 1.912 CV 1
OR { 108}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 375 and name HB3 ))
OR { 108}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 375 and name HB2 ))
OR { 108}
( segid " " and resid 207 and name HG2%)
(( segid " " and resid 209 and name HB3 ))
OR { 108}
( segid " " and resid 217 and name HG2%)
( segid " " and resid 225 and name HE% )
OR { 108}
( segid " " and resid 207 and name HG2%)
(( segid " " and resid 203 and name HB3 ))
OR { 108}
( segid " " and resid 217 and name HG2%)
(( segid " " and resid 321 and name HB2 ))
ASSI { 1569}
( segid " " and resid 240 and name HG2%)
(( segid " " and resid 237 and name HG3 ))
2.800 2.800 3.200 peak 1569 spectrum 1 weight 0.10000E+01 volume 0.20413E-02 ppm1 0.773 ppm2 1.330 CV 1
OR { 1569}
( segid " " and resid 240 and name HG2%)
( segid " " and resid 245 and name HB% )
ASSI { 3035}
( segid " " and resid 247 and name HE% )
( segid " " and resid 253 and name HG2%)
3.300 1.300 1.300 peak 3035 spectrum 1 weight 0.10000E+01 volume 0.17960E-02 ppm1 6.477 ppm2 0.608 CV 1
OR { 3035}
( segid " " and resid 247 and name HE% )
( segid " " and resid 255 and name HD1%)
ASSI { 220}
(( segid " " and resid 439 and name HA ))
(( segid " " and resid 442 and name H ))
4.000 2.000 2.000 peak 220 spectrum 1 weight 0.10000E+01 volume 0.45677E-03 ppm1 3.815 ppm2 7.552 CV 1
OR { 220}
(( segid " " and resid 439 and name HA ))
(( segid " " and resid 438 and name H ))
ASSI { 1129}
( segid " " and resid 219 and name HE% )
(( segid " " and resid 255 and name HB3 ))
4.100 2.100 1.900 peak 1129 spectrum 1 weight 0.10000E+01 volume 0.75564E-03 ppm1 6.393 ppm2 1.109 CV 1
OR { 1129}
( segid " " and resid 219 and name HE% )
( segid " " and resid 220 and name HG1%)
OR { 1129}
( segid " " and resid 219 and name HE% )
( segid " " and resid 220 and name HG2%)
ASSI { 1249}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 299 and name H ))
4.200 2.200 1.800 peak 1249 spectrum 1 weight 0.10000E+01 volume 0.12547E-02 ppm1 0.076 ppm2 7.493 CV 1
OR { 1249}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 364 and name H ))
ASSI { 1416}
(( segid " " and resid 244 and name HD2 ))
(( segid " " and resid 240 and name HB ))
3.400 1.400 1.400 peak 1416 spectrum 1 weight 0.10000E+01 volume 0.50751E-03 ppm1 0.964 ppm2 2.186 CV 1
OR { 1416}
(( segid " " and resid 244 and name HD2 ))
(( segid " " and resid 269 and name HB2 ))
ASSI { 1176}
(( segid " " and resid 440 and name HA ))
(( segid " " and resid 441 and name H ))
3.500 1.600 1.600 peak 1176 spectrum 1 weight 0.10000E+01 volume 0.69077E-03 ppm1 3.745 ppm2 7.639 CV 1
OR { 1176}
(( segid " " and resid 440 and name HA ))
(( segid " " and resid 443 and name H ))
ASSI { 4667}
(( segid " " and resid 208 and name HA ))
(( segid " " and resid 209 and name H ))
3.100 1.200 1.200 peak 4667 spectrum 1 weight 0.10000E+01 volume 0.95018E-03 ppm1 3.883 ppm2 7.845 CV 1
OR { 4667}
(( segid " " and resid 243 and name HA ))
(( segid " " and resid 243 and name H ))
ASSI { 596}
( segid " " and resid 357 and name HD1%)
( segid " " and resid 360 and name HD% )
2.700 0.900 0.900 peak 596 spectrum 1 weight 0.10000E+01 volume 0.66006E-02 ppm1 0.676 ppm2 7.073 CV 1
OR { 596}
( segid " " and resid 357 and name HD1%)
( segid " " and resid 361 and name HE% )
OR { 596}
( segid " " and resid 357 and name HD1%)
( segid " " and resid 360 and name HE% )
OR { 596}
( segid " " and resid 357 and name HD1%)
(( segid " " and resid 352 and name H ))
ASSI { 686}
( segid " " and resid 367 and name HD1%)
(( segid " " and resid 367 and name HB3 ))
3.200 1.300 1.300 peak 686 spectrum 1 weight 0.10000E+01 volume 0.37667E-02 ppm1 0.666 ppm2 0.060 CV 1
OR { 686}
( segid " " and resid 367 and name HD1%)
( segid " " and resid 300 and name HG1%)
ASSI { 1043}
(( segid " " and resid 210 and name HB3 ))
( segid " " and resid 274 and name HD2%)
4.300 2.400 1.700 peak 1043 spectrum 1 weight 0.10000E+01 volume 0.63157E-03 ppm1 1.407 ppm2 0.750 CV 1
OR { 1043}
(( segid " " and resid 210 and name HB3 ))
( segid " " and resid 194 and name HD1%)
OR { 1043}
(( segid " " and resid 210 and name HB3 ))
(( segid " " and resid 209 and name HG ))
ASSI { 440}
( segid " " and resid 362 and name HG2%)
( segid " " and resid 358 and name HD% )
3.100 1.200 1.200 peak 440 spectrum 1 weight 0.10000E+01 volume 0.29182E-02 ppm1 0.554 ppm2 7.028 CV 1
OR { 440}
( segid " " and resid 362 and name HG2%)
(( segid " " and resid 363 and name HD2 ))
ASSI { 1135}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 361 and name HD% )
2.400 0.700 0.700 peak 1135 spectrum 1 weight 0.10000E+01 volume 0.41531E-02 ppm1 0.397 ppm2 7.110 CV 1
OR { 1135}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 360 and name HD% )
OR { 1135}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 361 and name HE% )
OR { 1135}
( segid " " and resid 322 and name HG2%)
( segid " " and resid 368 and name HD% )
ASSI { 1596}
(( segid " " and resid 313 and name HA ))
(( segid " " and resid 208 and name HB2 ))
4.000 2.000 2.000 peak 1596 spectrum 1 weight 0.10000E+01 volume 0.50469E-03 ppm1 4.386 ppm2 1.340 CV 1
OR { 1596}
(( segid " " and resid 313 and name HA ))
(( segid " " and resid 194 and name HG ))
ASSI { 1541}
(( segid " " and resid 398 and name HB ))
( segid " " and resid 398 and name HG2%)
1.800 0.400 0.400 peak 1541 spectrum 1 weight 0.10000E+01 volume 0.28113E-01 ppm1 1.768 ppm2 0.798 CV 1
OR { 1541}
(( segid " " and resid 420 and name HB ))
( segid " " and resid 420 and name HG2%)
OR { 1541}
(( segid " " and resid 420 and name HB ))
( segid " " and resid 420 and name HD1%)
OR { 1541}
(( segid " " and resid 420 and name HB ))
( segid " " and resid 416 and name HD1%)
ASSI { 115}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 326 and name HA ))
4.800 2.900 1.200 peak 115 spectrum 1 weight 0.10000E+01 volume 0.57234E-03 ppm1 0.515 ppm2 4.408 CV 1
OR { 115}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 341 and name HA ))
OR { 115}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 349 and name HB ))
ASSI { 3}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 373 and name HB3 ))
4.400 2.400 1.600 peak 3 spectrum 1 weight 0.10000E+01 volume 0.75282E-03 ppm1 0.368 ppm2 1.348 CV 1
OR { 3}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 374 and name HG3 ))
OR { 3}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 374 and name HG2 ))
ASSI { 1453}
(( segid " " and resid 236 and name HB ))
(( segid " " and resid 239 and name H ))
3.700 1.700 1.700 peak 1453 spectrum 1 weight 0.10000E+01 volume 0.38626E-03 ppm1 1.745 ppm2 7.098 CV 1
OR { 1453}
(( segid " " and resid 236 and name HB ))
( segid " " and resid 258 and name HD% )
ASSI { 528}
( segid " " and resid 357 and name HD1%)
(( segid " " and resid 343 and name HA ))
3.600 1.600 1.600 peak 528 spectrum 1 weight 0.10000E+01 volume 0.16522E-02 ppm1 0.679 ppm2 4.016 CV 1
OR { 528}
( segid " " and resid 357 and name HD1%)
(( segid " " and resid 358 and name HA ))
OR { 528}
( segid " " and resid 357 and name HD1%)
(( segid " " and resid 355 and name HA ))
ASSI { 1367}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 318 and name H ))
5.100 3.300 0.900 peak 1367 spectrum 1 weight 0.10000E+01 volume 0.54981E-03 ppm1 0.168 ppm2 8.041 CV 1
OR { 1367}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 287 and name H ))
OR { 1367}
( segid " " and resid 279 and name HD1%)
(( segid " " and resid 306 and name H ))
ASSI { 1179}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 332 and name H ))
4.400 2.400 1.600 peak 1179 spectrum 1 weight 0.10000E+01 volume 0.82329E-03 ppm1 0.748 ppm2 7.425 CV 1
OR { 1179}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 338 and name HD22))
ASSI { 130}
( segid " " and resid 279 and name HD2%)
(( segid " " and resid 350 and name HB ))
3.800 1.800 1.800 peak 130 spectrum 1 weight 0.10000E+01 volume 0.62875E-03 ppm1 0.374 ppm2 2.449 CV 1
OR { 130}
( segid " " and resid 279 and name HD2%)
(( segid " " and resid 287 and name HB3 ))
ASSI { 817}
( segid " " and resid 361 and name HD% )
(( segid " " and resid 339 and name HB ))
3.800 1.800 1.800 peak 817 spectrum 1 weight 0.10000E+01 volume 0.38908E-03 ppm1 7.133 ppm2 1.536 CV 1
OR { 817}
( segid " " and resid 361 and name HD% )
(( segid " " and resid 339 and name HG13))
OR { 817}
( segid " " and resid 361 and name HD% )
(( segid " " and resid 346 and name HB3 ))
ASSI { 1035}
( segid " " and resid 346 and name HD2%)
(( segid " " and resid 346 and name HG ))
2.000 0.500 0.500 peak 1035 spectrum 1 weight 0.10000E+01 volume 0.16243E-01 ppm1 0.748 ppm2 1.730 CV 1
OR { 1035}
( segid " " and resid 346 and name HD2%)
(( segid " " and resid 346 and name HB2 ))
OR { 1035}
( segid " " and resid 346 and name HD2%)
(( segid " " and resid 325 and name HB2 ))
OR { 1035}
( segid " " and resid 346 and name HD2%)
(( segid " " and resid 357 and name HG ))
OR { 1035}
( segid " " and resid 346 and name HD2%)
(( segid " " and resid 357 and name HB3 ))
ASSI { 1309}
( segid " " and resid 230 and name HD1%)
(( segid " " and resid 227 and name HA ))
3.200 1.300 1.300 peak 1309 spectrum 1 weight 0.10000E+01 volume 0.14661E-02 ppm1 0.645 ppm2 4.196 CV 1
OR { 1309}
( segid " " and resid 339 and name HD1%)
(( segid " " and resid 361 and name HA ))
OR { 1309}
( segid " " and resid 230 and name HD1%)
(( segid " " and resid 234 and name HA ))
OR { 1309}
( segid " " and resid 230 and name HD1%)
(( segid " " and resid 332 and name HA ))
ASSI { 512}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 361 and name HA ))
4.600 2.700 1.400 peak 512 spectrum 1 weight 0.10000E+01 volume 0.98681E-03 ppm1 -0.168 ppm2 4.238 CV 1
OR { 512}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 360 and name HA ))
ASSI { 3332}
(( segid " " and resid 379 and name HD3 ))
(( segid " " and resid 379 and name HB3 ))
4.300 2.300 1.700 peak 3332 spectrum 1 weight 0.10000E+01 volume 0.72743E-03 ppm1 3.836 ppm2 1.644 CV 1
OR { 3332}
(( segid " " and resid 379 and name HD3 ))
(( segid " " and resid 378 and name HB2 ))
OR { 3332}
(( segid " " and resid 379 and name HD3 ))
(( segid " " and resid 378 and name HB3 ))
ASSI { 1171}
( segid " " and resid 412 and name HD1%)
(( segid " " and resid 415 and name HB2 ))
2.400 2.400 3.600 peak 1171 spectrum 1 weight 0.10000E+01 volume 0.18355E-02 ppm1 0.841 ppm2 2.777 CV 1
OR { 1171}
( segid " " and resid 412 and name HD1%)
(( segid " " and resid 411 and name HB2 ))
ASSI { 1120}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 267 and name HA ))
4.300 2.300 1.700 peak 1120 spectrum 1 weight 0.10000E+01 volume 0.59208E-03 ppm1 -0.160 ppm2 4.011 CV 1
OR { 1120}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 266 and name HA ))
OR { 1120}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 210 and name HA ))
ASSI { 854}
(( segid " " and resid 426 and name HG2 ))
( segid " " and resid 416 and name HD2%)
3.000 1.100 1.100 peak 854 spectrum 1 weight 0.10000E+01 volume 0.24868E-02 ppm1 2.263 ppm2 0.677 CV 1
OR { 854}
(( segid " " and resid 426 and name HG2 ))
( segid " " and resid 429 and name HD2%)
ASSI { 806}
( segid " " and resid 339 and name HG2%)
( segid " " and resid 361 and name HE% )
2.300 0.700 0.700 peak 806 spectrum 1 weight 0.10000E+01 volume 0.74464E-02 ppm1 0.705 ppm2 7.021 CV 1
OR { 806}
( segid " " and resid 339 and name HG2%)
( segid " " and resid 358 and name HD% )
ASSI { 1041}
(( segid " " and resid 329 and name HA ))
(( segid " " and resid 331 and name H ))
4.300 2.300 1.700 peak 1041 spectrum 1 weight 0.10000E+01 volume 0.50469E-03 ppm1 3.857 ppm2 7.182 CV 1
OR { 1041}
(( segid " " and resid 329 and name HA ))
(( segid " " and resid 328 and name H ))
OR { 1041}
(( segid " " and resid 329 and name HA ))
( segid " " and resid 361 and name HD% )
ASSI { 1275}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 279 and name HG ))
2.700 0.900 0.900 peak 1275 spectrum 1 weight 0.10000E+01 volume 0.25178E-02 ppm1 0.602 ppm2 1.433 CV 1
OR { 1275}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 322 and name HG12))
ASSI { 1113}
(( segid " " and resid 346 and name HG ))
( segid " " and resid 361 and name HE% )
4.600 2.600 1.400 peak 1113 spectrum 1 weight 0.10000E+01 volume 0.91351E-03 ppm1 1.747 ppm2 7.035 CV 1
OR { 1113}
(( segid " " and resid 346 and name HG ))
(( segid " " and resid 345 and name H ))
OR { 1113}
(( segid " " and resid 346 and name HG ))
( segid " " and resid 360 and name HD% )
OR { 1113}
(( segid " " and resid 346 and name HG ))
(( segid " " and resid 352 and name H ))
ASSI { 1369}
(( segid " " and resid 227 and name HB2 ))
(( segid " " and resid 230 and name HB ))
3.600 1.600 1.600 peak 1369 spectrum 1 weight 0.10000E+01 volume 0.23825E-02 ppm1 3.126 ppm2 1.771 CV 1
OR { 1369}
(( segid " " and resid 227 and name HB2 ))
(( segid " " and resid 228 and name HB2 ))
OR { 1369}
(( segid " " and resid 327 and name HB2 ))
(( segid " " and resid 329 and name HB ))
OR { 1369}
(( segid " " and resid 327 and name HB3 ))
(( segid " " and resid 329 and name HB ))
ASSI { 956}
( segid " " and resid 315 and name HE% )
( segid " " and resid 307 and name HD2%)
2.800 1.000 1.000 peak 956 spectrum 1 weight 0.10000E+01 volume 0.51230E-02 ppm1 6.874 ppm2 1.032 CV 1
OR { 956}
( segid " " and resid 315 and name HE% )
( segid " " and resid 310 and name HD1%)
ASSI { 584}
( segid " " and resid 283 and name HD1%)
(( segid " " and resid 306 and name H ))
4.500 2.500 1.500 peak 584 spectrum 1 weight 0.10000E+01 volume 0.15789E-02 ppm1 0.717 ppm2 8.025 CV 1
OR { 584}
( segid " " and resid 283 and name HD1%)
(( segid " " and resid 287 and name H ))
ASSI { 1406}
(( segid " " and resid 271 and name HA ))
( segid " " and resid 274 and name HD2%)
3.500 1.600 1.600 peak 1406 spectrum 1 weight 0.10000E+01 volume 0.19737E-02 ppm1 3.673 ppm2 0.784 CV 1
OR { 1406}
(( segid " " and resid 271 and name HA ))
( segid " " and resid 271 and name HD2%)
OR { 1406}
(( segid " " and resid 271 and name HA ))
( segid " " and resid 271 and name HD1%)
ASSI { 1602}
(( segid " " and resid 247 and name HA ))
(( segid " " and resid 251 and name H ))
4.100 2.100 1.900 peak 1602 spectrum 1 weight 0.10000E+01 volume 0.40600E-03 ppm1 4.122 ppm2 7.848 CV 1
OR { 1602}
(( segid " " and resid 247 and name HA ))
( segid " " and resid 190 and name HD% )
ASSI { 1301}
(( segid " " and resid 413 and name HB2 ))
( segid " " and resid 429 and name HD2%)
4.300 2.300 1.700 peak 1301 spectrum 1 weight 0.10000E+01 volume 0.50469E-03 ppm1 3.091 ppm2 0.654 CV 1
OR { 1301}
(( segid " " and resid 413 and name HB2 ))
( segid " " and resid 416 and name HD2%)
ASSI { 1247}
( segid " " and resid 364 and name HG1%)
( segid " " and resid 323 and name HG2%)
1.900 0.400 0.400 peak 1247 spectrum 1 weight 0.10000E+01 volume 0.10393E-01 ppm1 1.056 ppm2 0.398 CV 1
OR { 1247}
( segid " " and resid 364 and name HG1%)
( segid " " and resid 322 and name HG2%)
OR { 1247}
( segid " " and resid 364 and name HG1%)
( segid " " and resid 371 and name HG1%)
ASSI { 1126}
( segid " " and resid 266 and name HD1%)
( segid " " and resid 190 and name HD% )
3.800 1.800 1.800 peak 1126 spectrum 1 weight 0.10000E+01 volume 0.20300E-02 ppm1 0.894 ppm2 7.852 CV 1
OR { 1126}
( segid " " and resid 266 and name HD1%)
(( segid " " and resid 268 and name H ))
ASSI { 357}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 304 and name HE21))
5.500 3.800 0.500 peak 357 spectrum 1 weight 0.10000E+01 volume 0.30169E-03 ppm1 0.070 ppm2 6.661 CV 1
OR { 357}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 301 and name HE21))
ASSI { 1607}
(( segid " " and resid 202 and name HG3 ))
(( segid " " and resid 199 and name HA ))
3.700 1.700 1.700 peak 1607 spectrum 1 weight 0.10000E+01 volume 0.58644E-03 ppm1 2.773 ppm2 3.805 CV 1
OR { 1607}
(( segid " " and resid 202 and name HG3 ))
(( segid " " and resid 206 and name HA3 ))
ASSI { 761}
(( segid " " and resid 357 and name HB2 ))
( segid " " and resid 357 and name HD1%)
4.300 2.300 1.700 peak 761 spectrum 1 weight 0.10000E+01 volume 0.65978E-03 ppm1 2.014 ppm2 0.675 CV 1
OR { 761}
(( segid " " and resid 357 and name HB2 ))
( segid " " and resid 350 and name HG2%)
OR { 761}
(( segid " " and resid 357 and name HB2 ))
( segid " " and resid 350 and name HG1%)
ASSI { 883}
( segid " " and resid 359 and name HG2%)
(( segid " " and resid 360 and name HB3 ))
4.900 3.000 1.100 peak 883 spectrum 1 weight 0.10000E+01 volume 0.47930E-03 ppm1 -0.460 ppm2 3.084 CV 1
OR { 883}
( segid " " and resid 359 and name HG2%)
(( segid " " and resid 361 and name HB2 ))
ASSI { 964}
(( segid " " and resid 271 and name HG ))
( segid " " and resid 271 and name HD2%)
2.900 1.000 1.000 peak 964 spectrum 1 weight 0.10000E+01 volume 0.20977E-02 ppm1 2.188 ppm2 0.721 CV 1
OR { 964}
(( segid " " and resid 271 and name HG ))
( segid " " and resid 278 and name HD2%)
OR { 964}
(( segid " " and resid 271 and name HG ))
( segid " " and resid 274 and name HD1%)
ASSI { 1325}
(( segid " " and resid 225 and name HG3 ))
( segid " " and resid 225 and name HE% )
3.200 1.300 1.300 peak 1325 spectrum 1 weight 0.10000E+01 volume 0.17763E-02 ppm1 2.685 ppm2 1.918 CV 1
OR { 1325}
(( segid " " and resid 225 and name HG3 ))
(( segid " " and resid 221 and name HB3 ))
ASSI { 913}
( segid " " and resid 318 and name HG2%)
( segid " " and resid 307 and name HD1%)
2.400 0.700 0.700 peak 913 spectrum 1 weight 0.10000E+01 volume 0.88474E-02 ppm1 0.349 ppm2 1.208 CV 1
OR { 913}
( segid " " and resid 318 and name HG2%)
(( segid " " and resid 278 and name HB2 ))
ASSI { 1463}
( segid " " and resid 279 and name HD2%)
(( segid " " and resid 351 and name HE21))
4.900 3.000 1.100 peak 1463 spectrum 1 weight 0.10000E+01 volume 0.49622E-03 ppm1 0.370 ppm2 6.807 CV 1
OR { 1463}
( segid " " and resid 279 and name HD2%)
( segid " " and resid 303 and name HE% )
OR { 1463}
( segid " " and resid 279 and name HD2%)
( segid " " and resid 368 and name HE% )
ASSI { 26}
(( segid " " and resid 268 and name HA ))
( segid " " and resid 349 and name HG2%)
3.300 1.300 1.300 peak 26 spectrum 1 weight 0.10000E+01 volume 0.13026E-02 ppm1 3.705 ppm2 1.267 CV 1
OR { 26}
(( segid " " and resid 268 and name HA ))
(( segid " " and resid 268 and name HG3 ))
OR { 26}
(( segid " " and resid 268 and name HA ))
(( segid " " and resid 268 and name HG2 ))
ASSI { 788}
(( segid " " and resid 192 and name HG12))
( segid " " and resid 192 and name HD1%)
2.300 0.700 0.700 peak 788 spectrum 1 weight 0.10000E+01 volume 0.58814E-02 ppm1 1.353 ppm2 0.878 CV 1
OR { 788}
(( segid " " and resid 374 and name HG3 ))
( segid " " and resid 207 and name HD1%)
OR { 788}
(( segid " " and resid 192 and name HG12))
( segid " " and resid 189 and name HG2%)
ASSI { 497}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 332 and name HG3 ))
4.500 2.500 1.500 peak 497 spectrum 1 weight 0.10000E+01 volume 0.80355E-03 ppm1 0.515 ppm2 1.934 CV 1
OR { 497}
( segid " " and resid 342 and name HG2%)
(( segid " " and resid 344 and name HB ))
ASSI { 496}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 338 and name H ))
5.100 3.200 0.900 peak 496 spectrum 1 weight 0.10000E+01 volume 0.46238E-03 ppm1 0.753 ppm2 7.713 CV 1
OR { 496}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 344 and name H ))
ASSI { 1414}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 277 and name HD21))
1.800 0.400 0.400 peak 1414 spectrum 1 weight 0.10000E+01 volume 0.70712E-02 ppm1 2.151 ppm2 7.658 CV 1
OR { 1414}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 280 and name H ))
ASSI { 1236}
( segid " " and resid 360 and name HD% )
(( segid " " and resid 322 and name HG13))
3.300 1.300 1.300 peak 1236 spectrum 1 weight 0.10000E+01 volume 0.81201E-03 ppm1 7.074 ppm2 0.153 CV 1
OR { 1236}
( segid " " and resid 360 and name HE% )
(( segid " " and resid 322 and name HG13))
OR { 1236}
( segid " " and resid 360 and name HE% )
( segid " " and resid 279 and name HD1%)
OR { 1236}
( segid " " and resid 361 and name HE% )
( segid " " and resid 329 and name HD1%)
ASSI { 991}
( segid " " and resid 307 and name HD2%)
(( segid " " and resid 307 and name HG ))
2.500 0.800 0.800 peak 991 spectrum 1 weight 0.10000E+01 volume 0.39754E-02 ppm1 1.029 ppm2 2.285 CV 1
OR { 991}
( segid " " and resid 307 and name HD2%)
(( segid " " and resid 304 and name HG3 ))
OR { 991}
( segid " " and resid 307 and name HD2%)
(( segid " " and resid 304 and name HB2 ))
ASSI { 1581}
(( segid " " and resid 435 and name HA ))
( segid " " and resid 438 and name HB% )
3.400 1.400 1.400 peak 1581 spectrum 1 weight 0.10000E+01 volume 0.90223E-03 ppm1 3.845 ppm2 1.608 CV 1
OR { 1581}
(( segid " " and resid 435 and name HA ))
(( segid " " and resid 436 and name HG ))
ASSI { 168}
(( segid " " and resid 299 and name HE3 ))
(( segid " " and resid 296 and name HA ))
3.100 1.200 1.200 peak 168 spectrum 1 weight 0.10000E+01 volume 0.13223E-02 ppm1 2.563 ppm2 3.747 CV 1
OR { 168}
(( segid " " and resid 299 and name HE3 ))
(( segid " " and resid 292 and name HA2 ))
ASSI { 1586}
(( segid " " and resid 184 and name HG3 ))
(( segid " " and resid 184 and name HB2 ))
1.900 0.500 0.500 peak 1586 spectrum 1 weight 0.10000E+01 volume 0.22728E-01 ppm1 1.938 ppm2 2.215 CV 1
OR { 1586}
(( segid " " and resid 188 and name HG3 ))
(( segid " " and resid 188 and name HB3 ))
OR { 1586}
(( segid " " and resid 184 and name HG2 ))
(( segid " " and resid 184 and name HB2 ))
OR { 1586}
(( segid " " and resid 188 and name HG2 ))
(( segid " " and resid 188 and name HB3 ))
ASSI { 317}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 216 and name HB3 ))
3.400 1.500 1.500 peak 317 spectrum 1 weight 0.10000E+01 volume 0.20610E-02 ppm1 -0.047 ppm2 2.742 CV 1
OR { 317}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 213 and name HB3 ))
OR { 317}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 216 and name HG ))
OR { 317}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 218 and name HB2 ))
ASSI { 1394}
( segid " " and resid 274 and name HD1%)
(( segid " " and resid 274 and name H ))
3.400 1.400 1.400 peak 1394 spectrum 1 weight 0.10000E+01 volume 0.48410E-02 ppm1 0.668 ppm2 7.045 CV 1
OR { 1394}
( segid " " and resid 367 and name HD1%)
( segid " " and resid 303 and name HD% )
OR { 1394}
( segid " " and resid 367 and name HD1%)
(( segid " " and resid 304 and name HE22))
ASSI { 1629}
( segid " " and resid 266 and name HD2%)
(( segid " " and resid 266 and name HA ))
1.900 0.400 0.400 peak 1629 spectrum 1 weight 0.10000E+01 volume 0.19683E-01 ppm1 0.830 ppm2 4.012 CV 1
OR { 1629}
( segid " " and resid 333 and name HD2%)
(( segid " " and resid 333 and name HA ))
ASSI { 1498}
( segid " " and resid 267 and name HD2%)
(( segid " " and resid 213 and name HA ))
3.700 1.700 1.700 peak 1498 spectrum 1 weight 0.10000E+01 volume 0.26419E-02 ppm1 0.903 ppm2 3.641 CV 1
OR { 1498}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 306 and name HA ))
OR { 1498}
( segid " " and resid 267 and name HD2%)
(( segid " " and resid 268 and name HA ))
OR { 1498}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 285 and name HD3 ))
ASSI { 921}
( segid " " and resid 391 and name HD2%)
( segid " " and resid 439 and name HD2%)
2.500 0.800 0.800 peak 921 spectrum 1 weight 0.10000E+01 volume 0.81145E-02 ppm1 0.531 ppm2 0.881 CV 1
OR { 921}
( segid " " and resid 391 and name HD2%)
( segid " " and resid 435 and name HG2%)
OR { 921}
( segid " " and resid 391 and name HD2%)
( segid " " and resid 435 and name HD1%)
ASSI { 1235}
(( segid " " and resid 232 and name HA ))
( segid " " and resid 345 and name HG1%)
3.500 1.500 1.500 peak 1235 spectrum 1 weight 0.10000E+01 volume 0.10207E-02 ppm1 4.430 ppm2 0.986 CV 1
OR { 1235}
(( segid " " and resid 232 and name HA ))
( segid " " and resid 233 and name HG2%)
ASSI { 1337}
(( segid " " and resid 239 and name HD2 ))
(( segid " " and resid 242 and name HB2 ))
3.700 1.700 1.700 peak 1337 spectrum 1 weight 0.10000E+01 volume 0.22725E-02 ppm1 1.755 ppm2 2.212 CV 1
OR { 1337}
(( segid " " and resid 239 and name HD2 ))
(( segid " " and resid 242 and name HB3 ))
OR { 1337}
(( segid " " and resid 239 and name HD2 ))
(( segid " " and resid 242 and name HG2 ))
OR { 1337}
(( segid " " and resid 239 and name HD2 ))
(( segid " " and resid 240 and name HB ))
ASSI { 446}
( segid " " and resid 322 and name HD1%)
(( segid " " and resid 318 and name HG12))
4.300 2.300 1.700 peak 446 spectrum 1 weight 0.10000E+01 volume 0.23712E-02 ppm1 -0.167 ppm2 1.027 CV 1
OR { 446}
( segid " " and resid 322 and name HD1%)
( segid " " and resid 364 and name HG1%)
ASSI { 952}
( segid " " and resid 359 and name HG2%)
( segid " " and resid 322 and name HG2%)
3.900 1.900 1.900 peak 952 spectrum 1 weight 0.10000E+01 volume 0.11024E-02 ppm1 -0.461 ppm2 0.386 CV 1
OR { 952}
( segid " " and resid 359 and name HG2%)
( segid " " and resid 318 and name HD1%)
OR { 952}
( segid " " and resid 359 and name HG2%)
( segid " " and resid 279 and name HD2%)
OR { 952}
( segid " " and resid 359 and name HG2%)
( segid " " and resid 323 and name HG2%)
ASSI { 1265}
(( segid " " and resid 399 and name HE3 ))
(( segid " " and resid 399 and name HA ))
3.300 1.400 1.400 peak 1265 spectrum 1 weight 0.10000E+01 volume 0.45452E-02 ppm1 2.848 ppm2 3.793 CV 1
OR { 1265}
(( segid " " and resid 399 and name HE2 ))
(( segid " " and resid 399 and name HA ))
OR { 1265}
(( segid " " and resid 440 and name HE2 ))
(( segid " " and resid 440 and name HA ))
ASSI { 4318}
(( segid " " and resid 426 and name HG3 ))
(( segid " " and resid 426 and name H ))
2.400 0.700 0.700 peak 4318 spectrum 1 weight 0.10000E+01 volume 0.23120E-02 ppm1 1.991 ppm2 7.996 CV 1
OR { 4318}
(( segid " " and resid 426 and name HG3 ))
(( segid " " and resid 427 and name H ))
ASSI { 1437}
( segid " " and resid 189 and name HD1%)
( segid " " and resid 197 and name HB% )
3.400 1.400 1.400 peak 1437 spectrum 1 weight 0.10000E+01 volume 0.33157E-02 ppm1 0.736 ppm2 1.454 CV 1
OR { 1437}
( segid " " and resid 189 and name HD1%)
(( segid " " and resid 210 and name HB3 ))
ASSI { 627}
(( segid " " and resid 444 and name HA ))
(( segid " " and resid 444 and name HG2 ))
2.700 0.900 0.900 peak 627 spectrum 1 weight 0.10000E+01 volume 0.94397E-02 ppm1 4.234 ppm2 1.630 CV 1
OR { 627}
(( segid " " and resid 444 and name HA ))
(( segid " " and resid 444 and name HG3 ))
OR { 627}
(( segid " " and resid 444 and name HA ))
(( segid " " and resid 443 and name HB3 ))
ASSI { 618}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 303 and name H ))
4.100 2.100 1.900 peak 618 spectrum 1 weight 0.10000E+01 volume 0.10489E-02 ppm1 -0.359 ppm2 8.726 CV 1
OR { 618}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 307 and name H ))
OR { 618}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 304 and name H ))
ASSI { 928}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 332 and name HB3 ))
2.700 2.700 3.300 peak 928 spectrum 1 weight 0.10000E+01 volume 0.81483E-03 ppm1 0.656 ppm2 2.592 CV 1
OR { 928}
( segid " " and resid 342 and name HD1%)
(( segid " " and resid 331 and name HB2 ))
ASSI { 1216}
(( segid " " and resid 281 and name HG2 ))
(( segid " " and resid 281 and name HA ))
2.800 1.000 1.000 peak 1216 spectrum 1 weight 0.10000E+01 volume 0.95497E-02 ppm1 1.402 ppm2 3.990 CV 1
OR { 1216}
(( segid " " and resid 281 and name HG2 ))
(( segid " " and resid 280 and name HA ))
OR { 1216}
(( segid " " and resid 281 and name HG3 ))
(( segid " " and resid 281 and name HA ))
OR { 1216}
(( segid " " and resid 281 and name HG3 ))
(( segid " " and resid 280 and name HA ))
ASSI { 1174}
( segid " " and resid 342 and name HD1%)
( segid " " and resid 345 and name HG2%)
2.500 0.800 0.800 peak 1174 spectrum 1 weight 0.10000E+01 volume 0.97778E-02 ppm1 0.657 ppm2 0.940 CV 1
OR { 1174}
( segid " " and resid 342 and name HD1%)
( segid " " and resid 230 and name HG2%)
ASSI { 1532}
( segid " " and resid 295 and name HG2%)
(( segid " " and resid 298 and name H ))
3.400 1.400 1.400 peak 1532 spectrum 1 weight 0.10000E+01 volume 0.37752E-02 ppm1 1.182 ppm2 7.371 CV 1
OR { 1532}
( segid " " and resid 295 and name HG2%)
(( segid " " and resid 295 and name H ))
ASSI { 1472}
(( segid " " and resid 213 and name HZ ))
( segid " " and resid 321 and name HD1%)
3.600 1.600 1.600 peak 1472 spectrum 1 weight 0.10000E+01 volume 0.15564E-02 ppm1 6.329 ppm2 0.913 CV 1
OR { 1472}
(( segid " " and resid 213 and name HZ ))
( segid " " and resid 267 and name HD2%)
OR { 1472}
(( segid " " and resid 213 and name HZ ))
( segid " " and resid 325 and name HE% )
ASSI { 838}
(( segid " " and resid 315 and name HA ))
(( segid " " and resid 310 and name HB2 ))
3.800 1.800 1.800 peak 838 spectrum 1 weight 0.10000E+01 volume 0.62029E-03 ppm1 3.775 ppm2 1.363 CV 1
OR { 838}
(( segid " " and resid 315 and name HA ))
(( segid " " and resid 318 and name HB ))
OR { 838}
(( segid " " and resid 315 and name HA ))
(( segid " " and resid 317 and name HB2 ))
ASSI { 535}
( segid " " and resid 315 and name HE% )
(( segid " " and resid 310 and name HG ))
3.000 3.000 3.000 peak 535 spectrum 1 weight 0.10000E+01 volume 0.14041E-02 ppm1 6.877 ppm2 2.175 CV 1
OR { 535}
( segid " " and resid 315 and name HE% )
(( segid " " and resid 364 and name HB ))
OR { 535}
( segid " " and resid 315 and name HE% )
(( segid " " and resid 366 and name HG3 ))
ASSI { 920}
(( segid " " and resid 239 and name HD3 ))
( segid " " and resid 243 and name HD1%)
4.600 2.600 1.400 peak 920 spectrum 1 weight 0.10000E+01 volume 0.37780E-03 ppm1 1.678 ppm2 0.011 CV 1
OR { 920}
(( segid " " and resid 239 and name HD3 ))
( segid " " and resid 263 and name HG1%)
ASSI { 1034}
(( segid " " and resid 293 and name HD2 ))
(( segid " " and resid 295 and name H ))
5.400 3.600 0.600 peak 1034 spectrum 1 weight 0.10000E+01 volume 0.41447E-03 ppm1 3.083 ppm2 7.355 CV 1
OR { 1034}
(( segid " " and resid 293 and name HD2 ))
(( segid " " and resid 298 and name H ))
ASSI { 4616}
( segid " " and resid 373 and name HD1%)
(( segid " " and resid 320 and name HB3 ))
3.400 1.500 1.500 peak 4616 spectrum 1 weight 0.10000E+01 volume 0.11955E-02 ppm1 -0.195 ppm2 3.294 CV 1
OR { 4616}
( segid " " and resid 373 and name HD1%)
(( segid " " and resid 324 and name HB3 ))
ASSI { 1332}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 283 and name H ))
5.300 3.600 0.700 peak 1332 spectrum 1 weight 0.10000E+01 volume 0.75564E-03 ppm1 2.584 ppm2 7.327 CV 1
OR { 1332}
(( segid " " and resid 284 and name HG2 ))
(( segid " " and resid 283 and name H ))
OR { 1332}
(( segid " " and resid 284 and name HG3 ))
(( segid " " and resid 356 and name H ))
ASSI { 1057}
(( segid " " and resid 228 and name HG3 ))
(( segid " " and resid 335 and name HB ))
3.600 1.700 1.700 peak 1057 spectrum 1 weight 0.10000E+01 volume 0.12547E-02 ppm1 1.967 ppm2 4.190 CV 1
OR { 1057}
(( segid " " and resid 228 and name HG3 ))
(( segid " " and resid 335 and name HA ))
OR { 1057}
(( segid " " and resid 228 and name HG3 ))
(( segid " " and resid 227 and name HA ))
ASSI { 86}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 233 and name H ))
3.500 3.500 2.500 peak 86 spectrum 1 weight 0.10000E+01 volume 0.77816E-03 ppm1 1.803 ppm2 7.972 CV 1
OR { 86}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 329 and name H ))
ASSI { 703}
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( segid " " and resid 192 and name HG2%)
2.300 0.600 0.600 peak 703 spectrum 1 weight 0.10000E+01 volume 0.10235E-01 ppm1 0.871 ppm2 0.711 CV 1
OR { 703}
( segid " " and resid 192 and name HD1%)
( segid " " and resid 189 and name HD1%)
ASSI { 1597}
(( segid " " and resid 339 and name HA ))
(( segid " " and resid 339 and name HG12))
3.100 1.200 1.200 peak 1597 spectrum 1 weight 0.10000E+01 volume 0.98963E-03 ppm1 2.993 ppm2 0.533 CV 1
OR { 1597}
(( segid " " and resid 339 and name HA ))
( segid " " and resid 342 and name HG2%)
ASSI { 588}
( segid " " and resid 361 and name HD% )
( segid " " and resid 339 and name HG2%)
2.700 0.900 0.900 peak 588 spectrum 1 weight 0.10000E+01 volume 0.23120E-02 ppm1 7.140 ppm2 0.687 CV 1
OR { 588}
( segid " " and resid 361 and name HD% )
( segid " " and resid 357 and name HD1%)
ASSI { 4077}
( segid " " and resid 377 and name HE% )
( segid " " and resid 412 and name HD2%)
4.200 2.200 1.800 peak 4077 spectrum 1 weight 0.10000E+01 volume 0.13787E-02 ppm1 1.992 ppm2 0.671 CV 1
OR { 4077}
( segid " " and resid 377 and name HE% )
( segid " " and resid 402 and name HD1%)
ASSI { 91}
(( segid " " and resid 340 and name HB3 ))
(( segid " " and resid 340 and name HA ))
2.700 0.900 0.900 peak 91 spectrum 1 weight 0.10000E+01 volume 0.48720E-02 ppm1 2.054 ppm2 4.015 CV 1
OR { 91}
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(( segid " " and resid 345 and name HA ))
OR { 91}
(( segid " " and resid 348 and name HG2 ))
(( segid " " and resid 346 and name HA ))
ASSI { 1123}
( segid " " and resid 364 and name HG1%)
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3.300 1.300 1.300 peak 1123 spectrum 1 weight 0.10000E+01 volume 0.40318E-02 ppm1 1.065 ppm2 2.674 CV 1
OR { 1123}
( segid " " and resid 364 and name HG1%)
(( segid " " and resid 368 and name HB3 ))
OR { 1123}
( segid " " and resid 364 and name HG1%)
(( segid " " and resid 363 and name HB3 ))
ASSI { 1198}
(( segid " " and resid 346 and name HB3 ))
(( segid " " and resid 346 and name H ))
3.000 1.100 1.100 peak 1198 spectrum 1 weight 0.10000E+01 volume 0.15789E-02 ppm1 1.482 ppm2 8.998 CV 1
OR { 1198}
(( segid " " and resid 346 and name HB3 ))
(( segid " " and resid 347 and name H ))
ASSI { 359}
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(( segid " " and resid 185 and name HA ))
5.600 3.900 0.400 peak 359 spectrum 1 weight 0.10000E+01 volume 0.80919E-03 ppm1 0.776 ppm2 4.567 CV 1
OR { 359}
( segid " " and resid 186 and name HD1%)
(( segid " " and resid 187 and name HA ))
ASSI { 893}
( segid " " and resid 432 and name HG1%)
(( segid " " and resid 431 and name H ))
4.200 2.200 1.800 peak 893 spectrum 1 weight 0.10000E+01 volume 0.11391E-02 ppm1 1.089 ppm2 7.946 CV 1
OR { 893}
( segid " " and resid 432 and name HG1%)
(( segid " " and resid 434 and name H ))
OR { 893}
( segid " " and resid 432 and name HG2%)
(( segid " " and resid 434 and name H ))
OR { 893}
( segid " " and resid 432 and name HG2%)
(( segid " " and resid 431 and name H ))
ASSI { 720}
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3.800 1.800 1.800 peak 720 spectrum 1 weight 0.10000E+01 volume 0.20469E-02 ppm1 1.087 ppm2 3.110 CV 1
OR { 720}
( segid " " and resid 310 and name HD2%)
(( segid " " and resid 315 and name HB2 ))
ASSI { 1352}
(( segid " " and resid 390 and name HB ))
(( segid " " and resid 391 and name HG ))
4.200 2.200 1.800 peak 1352 spectrum 1 weight 0.10000E+01 volume 0.91633E-03 ppm1 3.843 ppm2 1.614 CV 1
OR { 1352}
(( segid " " and resid 390 and name HB ))
(( segid " " and resid 389 and name HB2 ))
ASSI { 106}
( segid " " and resid 284 and name HE% )
(( segid " " and resid 352 and name H ))
4.200 2.200 1.800 peak 106 spectrum 1 weight 0.10000E+01 volume 0.23120E-02 ppm1 2.151 ppm2 7.046 CV 1
OR { 106}
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( segid " " and resid 360 and name HE% )
OR { 106}
( segid " " and resid 284 and name HE% )
( segid " " and resid 360 and name HD% )
ASSI { 730}
( segid " " and resid 230 and name HD1%)
(( segid " " and resid 224 and name HA3 ))
3.800 1.800 1.800 peak 730 spectrum 1 weight 0.10000E+01 volume 0.14013E-02 ppm1 0.650 ppm2 3.591 CV 1
OR { 730}
( segid " " and resid 230 and name HD1%)
(( segid " " and resid 231 and name HA ))
ASSI { 109}
(( segid " " and resid 377 and name HG2 ))
(( segid " " and resid 377 and name HB2 ))
2.100 0.600 0.600 peak 109 spectrum 1 weight 0.10000E+01 volume 0.22745E-01 ppm1 2.522 ppm2 1.989 CV 1
OR { 109}
(( segid " " and resid 183 and name HG2 ))
(( segid " " and resid 183 and name HB2 ))
OR { 109}
(( segid " " and resid 377 and name HG2 ))
(( segid " " and resid 377 and name HB3 ))
OR { 109}
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( segid " " and resid 183 and name HE% )
OR { 109}
(( segid " " and resid 377 and name HG2 ))
( segid " " and resid 377 and name HE% )
ASSI { 327}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 317 and name HG ))
3.600 1.600 1.600 peak 327 spectrum 1 weight 0.10000E+01 volume 0.36342E-02 ppm1 -0.905 ppm2 0.458 CV 1
OR { 327}
( segid " " and resid 209 and name HD2%)
( segid " " and resid 207 and name HG2%)
OR { 327}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 217 and name HG12))
OR { 327}
( segid " " and resid 209 and name HD2%)
( segid " " and resid 217 and name HG2%)
OR { 327}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 217 and name HG13))
ASSI { 273}
(( segid " " and resid 343 and name HA ))
(( segid " " and resid 357 and name HG ))
3.000 1.100 1.100 peak 273 spectrum 1 weight 0.10000E+01 volume 0.12406E-02 ppm1 4.019 ppm2 1.746 CV 1
OR { 273}
(( segid " " and resid 343 and name HA ))
(( segid " " and resid 357 and name HB3 ))
OR { 273}
(( segid " " and resid 343 and name HA ))
(( segid " " and resid 346 and name HB2 ))
OR { 273}
(( segid " " and resid 343 and name HA ))
(( segid " " and resid 342 and name HB ))
OR { 273}
(( segid " " and resid 343 and name HA ))
(( segid " " and resid 346 and name HG ))
OR { 273}
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(( segid " " and resid 281 and name HB2 ))
ASSI { 51}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 332 and name HB3 ))
4.400 2.400 1.600 peak 51 spectrum 1 weight 0.10000E+01 volume 0.94172E-03 ppm1 0.748 ppm2 2.633 CV 1
OR { 51}
( segid " " and resid 329 and name HG2%)
(( segid " " and resid 326 and name HB3 ))
ASSI { 1026}
( segid " " and resid 290 and name HB% )
(( segid " " and resid 302 and name H ))
3.800 1.800 1.800 peak 1026 spectrum 1 weight 0.10000E+01 volume 0.26616E-02 ppm1 1.529 ppm2 7.991 CV 1
OR { 1026}
( segid " " and resid 290 and name HB% )
(( segid " " and resid 289 and name H ))
OR { 1026}
( segid " " and resid 290 and name HB% )
(( segid " " and resid 306 and name H ))
ASSI { 1273}
( segid " " and resid 371 and name HG2%)
(( segid " " and resid 368 and name HB3 ))
2.300 0.600 0.600 peak 1273 spectrum 1 weight 0.10000E+01 volume 0.31550E-02 ppm1 0.960 ppm2 2.706 CV 1
OR { 1273}
( segid " " and resid 376 and name HG1%)
(( segid " " and resid 218 and name HB2 ))
ASSI { 700}
(( segid " " and resid 363 and name HA ))
(( segid " " and resid 363 and name HD2 ))
4.400 2.400 1.600 peak 700 spectrum 1 weight 0.10000E+01 volume 0.36652E-03 ppm1 5.101 ppm2 7.089 CV 1
OR { 700}
(( segid " " and resid 363 and name HA ))
( segid " " and resid 303 and name HD% )
ASSI { 1652}
( segid " " and resid 266 and name HD2%)
(( segid " " and resid 270 and name HB2 ))
3.000 1.100 1.100 peak 1652 spectrum 1 weight 0.10000E+01 volume 0.53148E-02 ppm1 0.818 ppm2 2.890 CV 1
OR { 1652}
( segid " " and resid 316 and name HD1%)
(( segid " " and resid 320 and name HB2 ))
OR { 1652}
( segid " " and resid 316 and name HD1%)
(( segid " " and resid 210 and name HD3 ))
ASSI { 1567}
(( segid " " and resid 299 and name HB2 ))
(( segid " " and resid 299 and name HB3 ))
2.100 0.600 0.600 peak 1567 spectrum 1 weight 0.10000E+01 volume 0.14210E-02 ppm1 1.468 ppm2 1.712 CV 1
OR { 1567}
(( segid " " and resid 299 and name HB2 ))
(( segid " " and resid 293 and name HB2 ))
OR { 1567}
(( segid " " and resid 299 and name HB2 ))
(( segid " " and resid 300 and name HB ))
ASSI { 1519}
(( segid " " and resid 440 and name HG2 ))
(( segid " " and resid 440 and name HA ))
2.800 1.000 1.000 peak 1519 spectrum 1 weight 0.10000E+01 volume 0.37893E-02 ppm1 1.357 ppm2 3.763 CV 1
OR { 1519}
(( segid " " and resid 440 and name HG3 ))
(( segid " " and resid 437 and name HA ))
OR { 1519}
(( segid " " and resid 440 and name HG3 ))
(( segid " " and resid 440 and name HA ))
OR { 1519}
(( segid " " and resid 440 and name HG2 ))
(( segid " " and resid 437 and name HA ))
ASSI { 646}
(( segid " " and resid 426 and name HG2 ))
( segid " " and resid 416 and name HD1%)
3.000 1.100 1.100 peak 646 spectrum 1 weight 0.10000E+01 volume 0.39557E-02 ppm1 2.259 ppm2 0.847 CV 1
OR { 646}
(( segid " " and resid 426 and name HG2 ))
( segid " " and resid 423 and name HD2%)
OR { 646}
(( segid " " and resid 426 and name HG2 ))
( segid " " and resid 423 and name HD1%)
ASSI { 284}
(( segid " " and resid 268 and name HG2 ))
(( segid " " and resid 268 and name HE3 ))
3.200 1.300 1.300 peak 284 spectrum 1 weight 0.10000E+01 volume 0.15253E-02 ppm1 1.252 ppm2 3.231 CV 1
OR { 284}
(( segid " " and resid 268 and name HG2 ))
(( segid " " and resid 268 and name HE2 ))
OR { 284}
(( segid " " and resid 268 and name HG3 ))
(( segid " " and resid 268 and name HE2 ))
OR { 284}
(( segid " " and resid 268 and name HG3 ))
(( segid " " and resid 268 and name HE3 ))
OR { 284}
( segid " " and resid 349 and name HG2%)
(( segid " " and resid 272 and name HD2 ))
ASSI { 467}
(( segid " " and resid 307 and name HA ))
( segid " " and resid 310 and name HD1%)
2.800 1.000 1.000 peak 467 spectrum 1 weight 0.10000E+01 volume 0.19878E-02 ppm1 4.156 ppm2 1.069 CV 1
OR { 467}
(( segid " " and resid 307 and name HA ))
( segid " " and resid 307 and name HD2%)
OR { 467}
(( segid " " and resid 307 and name HA ))
( segid " " and resid 310 and name HD2%)
ASSI { 600}
( segid " " and resid 198 and name HG1%)
(( segid " " and resid 209 and name H ))
3.100 1.200 1.200 peak 600 spectrum 1 weight 0.10000E+01 volume 0.19595E-02 ppm1 0.597 ppm2 7.790 CV 1
OR { 600}
( segid " " and resid 198 and name HG1%)
(( segid " " and resid 199 and name H ))
ASSI { 445}
( segid " " and resid 220 and name HG2%)
(( segid " " and resid 227 and name H ))
4.200 2.200 1.800 peak 445 spectrum 1 weight 0.10000E+01 volume 0.19793E-02 ppm1 1.115 ppm2 7.140 CV 1
OR { 445}
( segid " " and resid 220 and name HG2%)
(( segid " " and resid 324 and name HD2 ))
OR { 445}
( segid " " and resid 220 and name HG1%)
(( segid " " and resid 324 and name HD2 ))
OR { 445}
( segid " " and resid 220 and name HG2%)
(( segid " " and resid 328 and name H ))
OR { 445}
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OR { 445}
( segid " " and resid 220 and name HG1%)
(( segid " " and resid 328 and name H ))
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(( segid " " and resid 263 and name H ))
OR { 445}
( segid " " and resid 220 and name HG2%)
( segid " " and resid 213 and name HE% )
OR { 445}
( segid " " and resid 220 and name HG1%)
(( segid " " and resid 230 and name H ))
OR { 445}
( segid " " and resid 220 and name HG1%)
(( segid " " and resid 331 and name H ))
ASSI { 1281}
( segid " " and resid 364 and name HG2%)
( segid " " and resid 323 and name HG2%)
2.100 0.500 0.500 peak 1281 spectrum 1 weight 0.10000E+01 volume 0.83796E-02 ppm1 0.908 ppm2 0.411 CV 1
OR { 1281}
( segid " " and resid 364 and name HG2%)
( segid " " and resid 322 and name HG2%)
OR { 1281}
( segid " " and resid 364 and name HG2%)
( segid " " and resid 371 and name HG1%)
ASSI { 302}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 220 and name HA ))
3.300 1.400 1.400 peak 302 spectrum 1 weight 0.10000E+01 volume 0.16015E-02 ppm1 1.913 ppm2 3.294 CV 1
OR { 302}
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(( segid " " and resid 324 and name HB3 ))
OR { 302}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 323 and name HA ))
ASSI { 531}
(( segid " " and resid 340 and name HA ))
( segid " " and resid 358 and name HD% )
4.100 2.100 1.900 peak 531 spectrum 1 weight 0.10000E+01 volume 0.82329E-03 ppm1 4.010 ppm2 7.013 CV 1
OR { 531}
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(( segid " " and resid 433 and name HE21))
OR { 531}
(( segid " " and resid 340 and name HA ))
( segid " " and resid 361 and name HE% )
OR { 531}
(( segid " " and resid 340 and name HA ))
(( segid " " and resid 345 and name H ))
ASSI { 319}
( segid " " and resid 409 and name HD2%)
(( segid " " and resid 433 and name HG3 ))
3.400 1.400 1.400 peak 319 spectrum 1 weight 0.10000E+01 volume 0.38203E-02 ppm1 0.742 ppm2 2.485 CV 1
OR { 319}
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(( segid " " and resid 350 and name HB ))
ASSI { 279}
( segid " " and resid 223 and name HD% )
(( segid " " and resid 222 and name HA ))
3.800 1.800 1.800 peak 279 spectrum 1 weight 0.10000E+01 volume 0.27631E-03 ppm1 6.427 ppm2 3.792 CV 1
OR { 279}
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(( segid " " and resid 260 and name HD3 ))
ASSI { 736}
(( segid " " and resid 417 and name HB2 ))
(( segid " " and resid 417 and name H ))
2.300 0.700 0.700 peak 736 spectrum 1 weight 0.10000E+01 volume 0.65949E-02 ppm1 2.061 ppm2 7.768 CV 1
OR { 736}
(( segid " " and resid 401 and name HB2 ))
(( segid " " and resid 401 and name H ))
OR { 736}
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(( segid " " and resid 428 and name H ))
OR { 736}
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(( segid " " and resid 428 and name H ))
OR { 736}
(( segid " " and resid 401 and name HB3 ))
(( segid " " and resid 401 and name H ))
OR { 736}
(( segid " " and resid 417 and name HB3 ))
(( segid " " and resid 417 and name H ))
ASSI { 1193}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 316 and name HA ))
4.500 2.600 1.500 peak 1193 spectrum 1 weight 0.10000E+01 volume 0.64567E-03 ppm1 -0.902 ppm2 3.559 CV 1
OR { 1193}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 214 and name HA ))
OR { 1193}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 213 and name HA ))
ASSI { 89}
(( segid " " and resid 293 and name HD2 ))
(( segid " " and resid 299 and name HA ))
5.100 3.300 0.900 peak 89 spectrum 1 weight 0.10000E+01 volume 0.60901E-03 ppm1 3.069 ppm2 3.768 CV 1
OR { 89}
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(( segid " " and resid 292 and name HA2 ))
OR { 89}
(( segid " " and resid 293 and name HD2 ))
(( segid " " and resid 296 and name HA ))
ASSI { 1223}
( segid " " and resid 262 and name HG2%)
(( segid " " and resid 236 and name H ))
3.400 1.400 1.400 peak 1223 spectrum 1 weight 0.10000E+01 volume 0.12603E-02 ppm1 1.075 ppm2 7.789 CV 1
OR { 1223}
( segid " " and resid 262 and name HG2%)
(( segid " " and resid 265 and name H ))
ASSI { 1650}
(( segid " " and resid 278 and name HB3 ))
( segid " " and resid 279 and name HD1%)
4.000 2.000 2.000 peak 1650 spectrum 1 weight 0.10000E+01 volume 0.40600E-03 ppm1 1.513 ppm2 0.164 CV 1
OR { 1650}
(( segid " " and resid 278 and name HB3 ))
( segid " " and resid 317 and name HD1%)
ASSI { 1623}
(( segid " " and resid 274 and name HB3 ))
(( segid " " and resid 276 and name H ))
4.100 2.100 1.900 peak 1623 spectrum 1 weight 0.10000E+01 volume 0.38344E-03 ppm1 1.800 ppm2 6.989 CV 1
OR { 1623}
(( segid " " and resid 274 and name HB3 ))
(( segid " " and resid 274 and name H ))
ASSI { 732}
(( segid " " and resid 336 and name HG2 ))
(( segid " " and resid 337 and name HG2 ))
3.900 1.900 1.900 peak 732 spectrum 1 weight 0.10000E+01 volume 0.99809E-03 ppm1 1.162 ppm2 1.811 CV 1
OR { 732}
(( segid " " and resid 336 and name HG2 ))
( segid " " and resid 337 and name HE% )
OR { 732}
(( segid " " and resid 336 and name HG2 ))
(( segid " " and resid 332 and name HB2 ))
ASSI { 291}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 403 and name HA ))
5.000 3.200 1.000 peak 291 spectrum 1 weight 0.10000E+01 volume 0.78098E-03 ppm1 0.700 ppm2 4.058 CV 1
OR { 291}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 438 and name HA ))
OR { 291}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 406 and name HA ))
OR { 291}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 446 and name HA ))
ASSI { 756}
( segid " " and resid 192 and name HD1%)
(( segid " " and resid 192 and name HB ))
2.500 0.800 0.800 peak 756 spectrum 1 weight 0.10000E+01 volume 0.40713E-02 ppm1 0.869 ppm2 2.166 CV 1
OR { 756}
( segid " " and resid 192 and name HD1%)
(( segid " " and resid 189 and name HB ))
ASSI { 910}
( segid " " and resid 359 and name HG1%)
( segid " " and resid 360 and name HD% )
3.600 1.600 1.600 peak 910 spectrum 1 weight 0.10000E+01 volume 0.45480E-02 ppm1 0.892 ppm2 7.041 CV 1
OR { 910}
( segid " " and resid 359 and name HG1%)
( segid " " and resid 358 and name HD% )
OR { 910}
( segid " " and resid 359 and name HG1%)
( segid " " and resid 303 and name HD% )
OR { 910}
( segid " " and resid 359 and name HG1%)
( segid " " and resid 360 and name HE% )
ASSI { 786}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 325 and name H ))
4.400 2.400 1.600 peak 786 spectrum 1 weight 0.10000E+01 volume 0.69077E-03 ppm1 0.392 ppm2 8.503 CV 1
OR { 786}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 324 and name H ))
OR { 786}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 358 and name H ))
ASSI { 1323}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 210 and name HG2 ))
3.800 1.800 1.800 peak 1323 spectrum 1 weight 0.10000E+01 volume 0.22641E-02 ppm1 0.552 ppm2 1.614 CV 1
OR { 1323}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 210 and name HB2 ))
OR { 1323}
( segid " " and resid 194 and name HD2%)
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OR { 1323}
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(( segid " " and resid 193 and name HB3 ))
OR { 1323}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 316 and name HB2 ))
OR { 1323}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 275 and name HG2 ))
OR { 1323}
( segid " " and resid 194 and name HD2%)
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OR { 1323}
( segid " " and resid 194 and name HD2%)
(( segid " " and resid 316 and name HB3 ))
ASSI { 411}
(( segid " " and resid 320 and name HZ3 ))
(( segid " " and resid 217 and name H ))
3.700 3.700 2.300 peak 411 spectrum 1 weight 0.10000E+01 volume 0.34398E-03 ppm1 7.021 ppm2 7.508 CV 1
OR { 411}
(( segid " " and resid 320 and name HZ3 ))
(( segid " " and resid 375 and name HE22))
OR { 411}
(( segid " " and resid 320 and name HZ3 ))
(( segid " " and resid 371 and name H ))
ASSI { 329}
(( segid " " and resid 332 and name HG3 ))
(( segid " " and resid 337 and name HB3 ))
3.700 1.700 1.700 peak 329 spectrum 1 weight 0.10000E+01 volume 0.95582E-03 ppm1 1.976 ppm2 1.554 CV 1
OR { 329}
(( segid " " and resid 332 and name HG3 ))
(( segid " " and resid 339 and name HG13))
OR { 329}
(( segid " " and resid 332 and name HG3 ))
(( segid " " and resid 333 and name HB3 ))
OR { 329}
(( segid " " and resid 332 and name HG3 ))
(( segid " " and resid 331 and name HG2 ))
OR { 329}
(( segid " " and resid 332 and name HG3 ))
(( segid " " and resid 339 and name HB ))
OR { 329}
(( segid " " and resid 332 and name HG3 ))
(( segid " " and resid 333 and name HB2 ))
ASSI { 1313}
(( segid " " and resid 284 and name HG3 ))
( segid " " and resid 356 and name HG1%)
4.600 2.600 1.400 peak 1313 spectrum 1 weight 0.10000E+01 volume 0.18863E-02 ppm1 2.586 ppm2 0.751 CV 1
OR { 1313}
(( segid " " and resid 284 and name HG3 ))
( segid " " and resid 350 and name HG2%)
OR { 1313}
(( segid " " and resid 284 and name HG2 ))
( segid " " and resid 350 and name HG2%)
OR { 1313}
(( segid " " and resid 284 and name HG2 ))
( segid " " and resid 356 and name HG1%)
OR { 1313}
(( segid " " and resid 284 and name HG3 ))
( segid " " and resid 350 and name HG1%)
OR { 1313}
(( segid " " and resid 284 and name HG2 ))
( segid " " and resid 350 and name HG1%)
ASSI { 711}
( segid " " and resid 407 and name HD% )
( segid " " and resid 407 and name HE% )
3.800 1.800 1.800 peak 711 spectrum 1 weight 0.10000E+01 volume 0.37780E-03 ppm1 7.314 ppm2 6.857 CV 1
OR { 711}
( segid " " and resid 407 and name HD% )
(( segid " " and resid 410 and name HD21))
ASSI { 4659}
(( segid " " and resid 249 and name HB2 ))
(( segid " " and resid 249 and name H ))
2.900 1.100 1.100 peak 4659 spectrum 1 weight 0.10000E+01 volume 0.10996E-02 ppm1 1.914 ppm2 7.322 CV 1
OR { 4659}
(( segid " " and resid 298 and name HB2 ))
(( segid " " and resid 298 and name H ))
ASSI { 564}
(( segid " " and resid 225 and name HG2 ))
( segid " " and resid 225 and name HE% )
2.800 1.000 1.000 peak 564 spectrum 1 weight 0.10000E+01 volume 0.19652E-02 ppm1 2.805 ppm2 1.921 CV 1
OR { 564}
(( segid " " and resid 225 and name HG2 ))
(( segid " " and resid 221 and name HB3 ))
ASSI { 989}
(( segid " " and resid 430 and name HD1 ))
(( segid " " and resid 433 and name HG2 ))
5.200 3.400 0.800 peak 989 spectrum 1 weight 0.10000E+01 volume 0.47930E-03 ppm1 7.177 ppm2 2.213 CV 1
OR { 989}
(( segid " " and resid 430 and name HD1 ))
(( segid " " and resid 426 and name HG2 ))
OR { 989}
(( segid " " and resid 430 and name HD1 ))
(( segid " " and resid 433 and name HB3 ))
OR { 989}
(( segid " " and resid 430 and name HD1 ))
(( segid " " and resid 427 and name HG2 ))
ASSI { 1464}
( segid " " and resid 271 and name HD2%)
(( segid " " and resid 271 and name HB2 ))
3.100 1.200 1.200 peak 1464 spectrum 1 weight 0.10000E+01 volume 0.48297E-02 ppm1 0.734 ppm2 1.263 CV 1
OR { 1464}
( segid " " and resid 271 and name HD2%)
( segid " " and resid 349 and name HG2%)
ASSI { 770}
(( segid " " and resid 413 and name HE1 ))
( segid " " and resid 429 and name HD2%)
4.100 2.100 1.900 peak 770 spectrum 1 weight 0.10000E+01 volume 0.96146E-03 ppm1 7.625 ppm2 0.662 CV 1
OR { 770}
(( segid " " and resid 413 and name HE1 ))
( segid " " and resid 416 and name HD2%)
ASSI { 313}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 350 and name HB ))
3.100 1.200 1.200 peak 313 spectrum 1 weight 0.10000E+01 volume 0.10686E-02 ppm1 0.603 ppm2 2.493 CV 1
OR { 313}
( segid " " and resid 352 and name HD1%)
(( segid " " and resid 287 and name HB3 ))
ASSI { 461}
( segid " " and resid 258 and name HD% )
( segid " " and resid 263 and name HG2%)
4.400 2.400 1.600 peak 461 spectrum 1 weight 0.10000E+01 volume 0.47366E-03 ppm1 7.095 ppm2 0.807 CV 1
OR { 461}
( segid " " and resid 258 and name HD% )
( segid " " and resid 240 and name HG2%)
OR { 461}
( segid " " and resid 258 and name HD% )
( segid " " and resid 266 and name HD2%)
ASSI { 926}
(( segid " " and resid 217 and name HG12))
(( segid " " and resid 321 and name HA ))
5.000 3.100 1.000 peak 926 spectrum 1 weight 0.10000E+01 volume 0.35244E-03 ppm1 0.522 ppm2 3.925 CV 1
OR { 926}
(( segid " " and resid 217 and name HG12))
(( segid " " and resid 324 and name HA ))
OR { 926}
(( segid " " and resid 217 and name HG12))
(( segid " " and resid 216 and name HA ))
OR { 926}
(( segid " " and resid 217 and name HG12))
(( segid " " and resid 215 and name HA ))
OR { 926}
(( segid " " and resid 217 and name HG12))
(( segid " " and resid 221 and name HA ))
ASSI { 1152}
( segid " " and resid 284 and name HE% )
( segid " " and resid 352 and name HD1%)
2.100 0.500 0.500 peak 1152 spectrum 1 weight 0.10000E+01 volume 0.76071E-02 ppm1 2.151 ppm2 0.619 CV 1
OR { 1152}
( segid " " and resid 284 and name HE% )
( segid " " and resid 278 and name HD1%)
ASSI { 1408}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 286 and name HG3 ))
2.900 1.100 1.100 peak 1408 spectrum 1 weight 0.10000E+01 volume 0.40939E-02 ppm1 0.379 ppm2 1.682 CV 1
OR { 1408}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 286 and name HG2 ))
OR { 1408}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 305 and name HG2 ))
OR { 1408}
( segid " " and resid 306 and name HD1%)
(( segid " " and resid 305 and name HG3 ))
ASSI { 2883}
(( segid " " and resid 324 and name HB3 ))
(( segid " " and resid 325 and name H ))
3.100 1.200 1.200 peak 2883 spectrum 1 weight 0.10000E+01 volume 0.47366E-03 ppm1 3.273 ppm2 8.501 CV 1
OR { 2883}
(( segid " " and resid 324 and name HB3 ))
(( segid " " and resid 324 and name H ))
ASSI { 1119}
( segid " " and resid 278 and name HD1%)
(( segid " " and resid 351 and name HE22))
3.800 1.800 1.800 peak 1119 spectrum 1 weight 0.10000E+01 volume 0.10630E-02 ppm1 0.649 ppm2 7.518 CV 1
OR { 1119}
( segid " " and resid 278 and name HD1%)
(( segid " " and resid 317 and name H ))
OR { 1119}
( segid " " and resid 429 and name HD2%)
(( segid " " and resid 430 and name HE3 ))
ASSI { 415}
( segid " " and resid 322 and name HD1%)
( segid " " and resid 322 and name HG2%)
2.000 0.500 0.500 peak 415 spectrum 1 weight 0.10000E+01 volume 0.14698E-01 ppm1 -0.166 ppm2 0.386 CV 1
OR { 415}
( segid " " and resid 322 and name HD1%)
( segid " " and resid 318 and name HD1%)
OR { 415}
( segid " " and resid 322 and name HD1%)
( segid " " and resid 323 and name HG2%)
ASSI { 674}
(( segid " " and resid 320 and name HD1 ))
( segid " " and resid 316 and name HD1%)
4.400 2.400 1.600 peak 674 spectrum 1 weight 0.10000E+01 volume 0.57516E-03 ppm1 7.247 ppm2 0.796 CV 1
OR { 674}
(( segid " " and resid 320 and name HD1 ))
( segid " " and resid 316 and name HD2%)
OR { 674}
(( segid " " and resid 320 and name HD1 ))
( segid " " and resid 323 and name HG1%)
OR { 674}
(( segid " " and resid 320 and name HD1 ))
( segid " " and resid 372 and name HG2%)
ASSI { 1577}
(( segid " " and resid 393 and name HG2 ))
( segid " " and resid 394 and name HG2%)
4.500 2.600 1.500 peak 1577 spectrum 1 weight 0.10000E+01 volume 0.17763E-02 ppm1 2.167 ppm2 1.236 CV 1
OR { 1577}
(( segid " " and resid 393 and name HG2 ))
( segid " " and resid 446 and name HB% )
ASSI { 1583}
( segid " " and resid 439 and name HD2%)
(( segid " " and resid 391 and name HA ))
2.300 2.300 3.700 peak 1583 spectrum 1 weight 0.10000E+01 volume 0.21428E-02 ppm1 0.880 ppm2 4.407 CV 1
OR { 1583}
( segid " " and resid 333 and name HD1%)
(( segid " " and resid 334 and name HA ))
OR { 1583}
( segid " " and resid 333 and name HD1%)
(( segid " " and resid 327 and name HA ))
ASSI { 153}
(( segid " " and resid 311 and name HD2 ))
(( segid " " and resid 310 and name HB3 ))
3.500 1.600 1.600 peak 153 spectrum 1 weight 0.10000E+01 volume 0.51315E-03 ppm1 4.042 ppm2 2.079 CV 1
OR { 153}
(( segid " " and resid 311 and name HD2 ))
(( segid " " and resid 311 and name HB2 ))
ASSI { 272}
( segid " " and resid 373 and name HD1%)
( segid " " and resid 323 and name HG1%)
3.300 1.400 1.400 peak 272 spectrum 1 weight 0.10000E+01 volume 0.32170E-02 ppm1 -0.195 ppm2 0.765 CV 1
OR { 272}
( segid " " and resid 373 and name HD1%)
( segid " " and resid 372 and name HG2%)
ASSI { 3081}
( segid " " and resid 267 and name HD2%)
( segid " " and resid 212 and name HG1%)
5.000 3.100 1.000 peak 3081 spectrum 1 weight 0.10000E+01 volume 0.13985E-02 ppm1 0.901 ppm2 -0.352 CV 1
OR { 3081}
( segid " " and resid 283 and name HD2%)
( segid " " and resid 306 and name HD2%)
ASSI { 663}
( segid " " and resid 201 and name HG2%)
(( segid " " and resid 189 and name HB ))
4.600 2.700 1.400 peak 663 spectrum 1 weight 0.10000E+01 volume 0.14971E-02 ppm1 1.293 ppm2 2.206 CV 1
OR { 663}
( segid " " and resid 201 and name HG2%)
( segid " " and resid 203 and name HE% )
ASSI { 1298}
( segid " " and resid 357 and name HD1%)
(( segid " " and resid 347 and name H ))
4.200 2.200 1.800 peak 1298 spectrum 1 weight 0.10000E+01 volume 0.53007E-03 ppm1 0.680 ppm2 8.969 CV 1
OR { 1298}
( segid " " and resid 357 and name HD1%)
(( segid " " and resid 354 and name H ))
ASSI { 979}
(( segid " " and resid 293 and name HD3 ))
(( segid " " and resid 295 and name H ))
6.000 4.900 0.000 peak 979 spectrum 1 weight 0.10000E+01 volume 0.26503E-03 ppm1 3.154 ppm2 7.358 CV 1
OR { 979}
(( segid " " and resid 293 and name HD3 ))
(( segid " " and resid 291 and name H ))
OR { 979}
(( segid " " and resid 293 and name HD3 ))
(( segid " " and resid 298 and name H ))
ASSI { 1400}
(( segid " " and resid 406 and name HG3 ))
( segid " " and resid 402 and name HG2%)
2.700 0.900 0.900 peak 1400 spectrum 1 weight 0.10000E+01 volume 0.26419E-02 ppm1 2.093 ppm2 0.794 CV 1
OR { 1400}
(( segid " " and resid 406 and name HG3 ))
( segid " " and resid 409 and name HD2%)
OR { 1400}
(( segid " " and resid 406 and name HG3 ))
( segid " " and resid 409 and name HD1%)
ASSI { 474}
(( segid " " and resid 352 and name HA ))
( segid " " and resid 356 and name HG2%)
5.600 4.000 0.400 peak 474 spectrum 1 weight 0.10000E+01 volume 0.54981E-03 ppm1 4.163 ppm2 0.356 CV 1
OR { 474}
(( segid " " and resid 352 and name HA ))
( segid " " and resid 279 and name HD2%)
ASSI { 1199}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 305 and name HB2 ))
3.500 1.500 1.500 peak 1199 spectrum 1 weight 0.10000E+01 volume 0.18806E-02 ppm1 -0.357 ppm2 1.889 CV 1
OR { 1199}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 283 and name HB3 ))
OR { 1199}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 305 and name HB3 ))
OR { 1199}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 309 and name HB2 ))
OR { 1199}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 309 and name HB3 ))
ASSI { 2274}
(( segid " " and resid 406 and name HG2 ))
(( segid " " and resid 406 and name HA ))
3.300 1.400 1.400 peak 2274 spectrum 1 weight 0.10000E+01 volume 0.60337E-03 ppm1 2.585 ppm2 4.093 CV 1
OR { 2274}
(( segid " " and resid 406 and name HG2 ))
(( segid " " and resid 403 and name HA ))
ASSI { 561}
(( segid " " and resid 239 and name HD2 ))
( segid " " and resid 258 and name HD% )
3.400 1.500 1.500 peak 561 spectrum 1 weight 0.10000E+01 volume 0.14492E-02 ppm1 1.752 ppm2 7.085 CV 1
OR { 561}
(( segid " " and resid 239 and name HD2 ))
(( segid " " and resid 239 and name H ))
ASSI { 2290}
(( segid " " and resid 281 and name HB3 ))
(( segid " " and resid 281 and name HG3 ))
2.000 0.500 0.500 peak 2290 spectrum 1 weight 0.10000E+01 volume 0.13590E-01 ppm1 1.905 ppm2 1.398 CV 1
OR { 2290}
(( segid " " and resid 239 and name HB2 ))
(( segid " " and resid 239 and name HG2 ))
OR { 2290}
(( segid " " and resid 281 and name HB3 ))
(( segid " " and resid 281 and name HG2 ))
ASSI { 1850}
( segid " " and resid 385 and name HE% )
(( segid " " and resid 386 and name H ))
4.100 2.100 1.900 peak 1850 spectrum 1 weight 0.10000E+01 volume 0.78663E-03 ppm1 1.915 ppm2 7.966 CV 1
OR { 1850}
( segid " " and resid 385 and name HE% )
(( segid " " and resid 387 and name H ))
ASSI { 1606}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 302 and name HA ))
4.500 2.500 1.500 peak 1606 spectrum 1 weight 0.10000E+01 volume 0.42293E-03 ppm1 -0.362 ppm2 4.300 CV 1
OR { 1606}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 279 and name HA ))
ASSI { 818}
( segid " " and resid 219 and name HE% )
( segid " " and resid 230 and name HD1%)
5.300 3.400 0.700 peak 818 spectrum 1 weight 0.10000E+01 volume 0.34116E-03 ppm1 6.407 ppm2 0.616 CV 1
OR { 818}
( segid " " and resid 219 and name HE% )
( segid " " and resid 255 and name HD1%)
ASSI { 803}
(( segid " " and resid 317 and name HA ))
(( segid " " and resid 209 and name HG ))
4.600 2.700 1.400 peak 803 spectrum 1 weight 0.10000E+01 volume 0.66538E-03 ppm1 3.125 ppm2 0.718 CV 1
OR { 803}
(( segid " " and resid 317 and name HA ))
( segid " " and resid 316 and name HD2%)
OR { 803}
(( segid " " and resid 317 and name HA ))
( segid " " and resid 278 and name HD2%)
OR { 803}
(( segid " " and resid 317 and name HA ))
( segid " " and resid 194 and name HD1%)
OR { 803}
(( segid " " and resid 317 and name HA ))
( segid " " and resid 321 and name HD2%)
ASSI { 57}
( segid " " and resid 359 and name HG2%)
(( segid " " and resid 366 and name HB2 ))
4.800 2.800 1.200 peak 57 spectrum 1 weight 0.10000E+01 volume 0.54417E-03 ppm1 -0.458 ppm2 1.842 CV 1
OR { 57}
( segid " " and resid 359 and name HG2%)
(( segid " " and resid 366 and name HB3 ))
OR { 57}
( segid " " and resid 359 and name HG2%)
(( segid " " and resid 357 and name HB3 ))
ASSI { 2069}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 210 and name HD2 ))
4.300 2.300 1.700 peak 2069 spectrum 1 weight 0.10000E+01 volume 0.57234E-03 ppm1 -0.911 ppm2 3.312 CV 1
OR { 2069}
( segid " " and resid 209 and name HD2%)
(( segid " " and resid 320 and name HB3 ))
ASSI { 4519}
( segid " " and resid 194 and name HD2%)
( segid " " and resid 317 and name HD1%)
2.900 1.100 1.100 peak 4519 spectrum 1 weight 0.10000E+01 volume 0.40290E-02 ppm1 0.551 ppm2 0.169 CV 1
OR { 4519}
( segid " " and resid 194 and name HD2%)
( segid " " and resid 209 and name HD1%)
ASSI { 244}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 320 and name HB2 ))
4.700 2.800 1.300 peak 244 spectrum 1 weight 0.10000E+01 volume 0.52161E-03 ppm1 0.369 ppm2 2.915 CV 1
OR { 244}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 324 and name HB2 ))
OR { 244}
( segid " " and resid 371 and name HG1%)
(( segid " " and resid 374 and name HE2 ))
ASSI { 1299}
(( segid " " and resid 413 and name HA ))
(( segid " " and resid 413 and name HD2 ))
4.100 2.100 1.900 peak 1299 spectrum 1 weight 0.10000E+01 volume 0.62875E-03 ppm1 4.199 ppm2 6.796 CV 1
OR { 1299}
(( segid " " and resid 413 and name HA ))
(( segid " " and resid 417 and name HE22))
ASSI { 2962}
(( segid " " and resid 343 and name HA ))
(( segid " " and resid 346 and name H ))
3.300 1.300 1.300 peak 2962 spectrum 1 weight 0.10000E+01 volume 0.10770E-02 ppm1 4.016 ppm2 8.998 CV 1
OR { 2962}
(( segid " " and resid 345 and name HA ))
(( segid " " and resid 346 and name H ))
ASSI { 477}
( segid " " and resid 247 and name HD% )
( segid " " and resid 266 and name HD2%)
4.300 2.300 1.700 peak 477 spectrum 1 weight 0.10000E+01 volume 0.55263E-03 ppm1 7.311 ppm2 0.793 CV 1
OR { 477}
( segid " " and resid 247 and name HD% )
( segid " " and resid 255 and name HD2%)
ASSI { 621}
( segid " " and resid 267 and name HD1%)
( segid " " and resid 317 and name HD1%)
2.400 2.400 3.600 peak 621 spectrum 1 weight 0.10000E+01 volume 0.20272E-02 ppm1 0.916 ppm2 0.174 CV 1
OR { 621}
( segid " " and resid 267 and name HD1%)
( segid " " and resid 209 and name HD1%)
ASSI { 453}
(( segid " " and resid 305 and name HD3 ))
(( segid " " and resid 309 and name HG2 ))
3.000 1.100 1.100 peak 453 spectrum 1 weight 0.10000E+01 volume 0.12970E-02 ppm1 3.038 ppm2 2.316 CV 1
OR { 453}
(( segid " " and resid 305 and name HD3 ))
(( segid " " and resid 283 and name HB2 ))
ASSI { 304}
( segid " " and resid 407 and name HD% )
(( segid " " and resid 403 and name HG3 ))
4.500 2.500 1.500 peak 304 spectrum 1 weight 0.10000E+01 volume 0.47648E-03 ppm1 7.322 ppm2 1.869 CV 1
OR { 304}
( segid " " and resid 407 and name HD% )
(( segid " " and resid 406 and name HB2 ))
OR { 304}
( segid " " and resid 407 and name HD% )
(( segid " " and resid 404 and name HG2 ))
OR { 304}
( segid " " and resid 407 and name HD% )
(( segid " " and resid 406 and name HB3 ))
OR { 304}
( segid " " and resid 407 and name HD% )
(( segid " " and resid 408 and name HB2 ))
OR { 304}
( segid " " and resid 407 and name HD% )
(( segid " " and resid 409 and name HB3 ))
ASSI { 4030}
( segid " " and resid 364 and name HG2%)
(( segid " " and resid 364 and name HB ))
1.700 0.400 0.500 peak 4030 spectrum 1 weight 0.10000E+01 volume 0.21011E-01 ppm1 0.914 ppm2 2.128 CV 1
OR { 4030}
( segid " " and resid 345 and name HG2%)
(( segid " " and resid 345 and name HB ))
ASSI { 413}
( segid " " and resid 263 and name HG1%)
(( segid " " and resid 263 and name H ))
2.600 0.800 0.800 peak 413 spectrum 1 weight 0.10000E+01 volume 0.35696E-02 ppm1 0.071 ppm2 7.086 CV 1
OR { 413}
( segid " " and resid 300 and name HG1%)
(( segid " " and resid 363 and name HD2 ))
OR { 413}
( segid " " and resid 300 and name HG1%)
( segid " " and resid 303 and name HD% )
ASSI { 303}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 326 and name HB2 ))
4.600 2.600 1.400 peak 303 spectrum 1 weight 0.10000E+01 volume 0.86842E-03 ppm1 0.438 ppm2 2.882 CV 1
OR { 303}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 324 and name HB2 ))
OR { 303}
( segid " " and resid 323 and name HG2%)
(( segid " " and resid 320 and name HB2 ))
ASSI { 629}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 325 and name HB3 ))
4.500 2.600 1.500 peak 629 spectrum 1 weight 0.10000E+01 volume 0.12321E-02 ppm1 -0.047 ppm2 1.374 CV 1
OR { 629}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 373 and name HB3 ))
OR { 629}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 322 and name HG12))
OR { 629}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 210 and name HB3 ))
OR { 629}
( segid " " and resid 217 and name HD1%)
(( segid " " and resid 322 and name HB ))
ASSI { 586}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 405 and name HA ))
2.700 2.700 3.300 peak 586 spectrum 1 weight 0.10000E+01 volume 0.54248E-02 ppm1 0.779 ppm2 3.838 CV 1
OR { 586}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 437 and name HA ))
OR { 586}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 435 and name HA ))
OR { 586}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 411 and name HA ))
OR { 586}
( segid " " and resid 380 and name HD1%)
(( segid " " and resid 383 and name HB2 ))
OR { 586}
( segid " " and resid 380 and name HD1%)
(( segid " " and resid 383 and name HB3 ))
ASSI { 228}
( segid " " and resid 306 and name HD2%)
(( segid " " and resid 306 and name HB2 ))
2.500 0.800 0.800 peak 228 spectrum 1 weight 0.10000E+01 volume 0.23684E-02 ppm1 -0.358 ppm2 0.909 CV 1
OR { 228}
( segid " " and resid 306 and name HD2%)
( segid " " and resid 283 and name HD2%)
ASSI { 1563}
(( segid " " and resid 415 and name HB2 ))
(( segid " " and resid 412 and name HA ))
4.100 2.100 1.900 peak 1563 spectrum 1 weight 0.10000E+01 volume 0.30732E-03 ppm1 2.766 ppm2 3.960 CV 1
OR { 1563}
(( segid " " and resid 415 and name HB2 ))
(( segid " " and resid 414 and name HA ))
OR { 1563}
(( segid " " and resid 415 and name HB2 ))
(( segid " " and resid 418 and name HA3 ))
ASSI { 1103}
(( segid " " and resid 304 and name HB3 ))
(( segid " " and resid 308 and name HE2 ))
4.700 2.800 1.300 peak 1103 spectrum 1 weight 0.10000E+01 volume 0.55827E-03 ppm1 1.871 ppm2 2.861 CV 1
OR { 1103}
(( segid " " and resid 304 and name HB3 ))
(( segid " " and resid 308 and name HE3 ))
OR { 1103}
(( segid " " and resid 304 and name HB3 ))
(( segid " " and resid 300 and name HA ))
ASSI { 1550}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 221 and name H ))
3.400 1.400 1.400 peak 1550 spectrum 1 weight 0.10000E+01 volume 0.27490E-02 ppm1 1.913 ppm2 8.723 CV 1
OR { 1550}
( segid " " and resid 225 and name HE% )
(( segid " " and resid 220 and name H ))
ASSI { 2324}
(( segid " " and resid 396 and name HA ))
( segid " " and resid 396 and name HB% )
2.300 0.700 0.700 peak 2324 spectrum 1 weight 0.10000E+01 volume 0.10249E-01 ppm1 3.993 ppm2 1.342 CV 1
OR { 2324}
(( segid " " and resid 245 and name HA ))
( segid " " and resid 245 and name HB% )
ASSI { 1870}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 341 and name HD22))
4.800 2.900 1.200 peak 1870 spectrum 1 weight 0.10000E+01 volume 0.12575E-02 ppm1 1.804 ppm2 7.317 CV 1
OR { 1870}
( segid " " and resid 337 and name HE% )
(( segid " " and resid 337 and name H ))
ASSI { 1067}
( segid " " and resid 189 and name HD1%)
(( segid " " and resid 200 and name H ))
4.600 2.600 1.400 peak 1067 spectrum 1 weight 0.10000E+01 volume 0.60055E-03 ppm1 0.740 ppm2 7.582 CV 1
OR { 1067}
( segid " " and resid 189 and name HD1%)
(( segid " " and resid 185 and name HD22))
ASSI { 566}
(( segid " " and resid 317 and name HG ))
( segid " " and resid 278 and name HD2%)
3.700 1.700 1.700 peak 566 spectrum 1 weight 0.10000E+01 volume 0.15535E-02 ppm1 0.419 ppm2 0.736 CV 1
OR { 566}
(( segid " " and resid 317 and name HG ))
( segid " " and resid 194 and name HD1%)
OR { 566}
(( segid " " and resid 317 and name HG ))
( segid " " and resid 271 and name HD2%)
OR { 566}
(( segid " " and resid 317 and name HG ))
(( segid " " and resid 209 and name HG ))
ASSI { 885}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 408 and name H ))
5.100 3.300 0.900 peak 885 spectrum 1 weight 0.10000E+01 volume 0.11306E-02 ppm1 0.782 ppm2 7.498 CV 1
OR { 885}
( segid " " and resid 409 and name HD1%)
(( segid " " and resid 410 and name HD22))
ASSI { 345}
(( segid " " and resid 212 and name HA ))
( segid " " and resid 255 and name HD2%)
4.800 2.900 1.200 peak 345 spectrum 1 weight 0.10000E+01 volume 0.60901E-03 ppm1 3.230 ppm2 0.795 CV 1
OR { 345}
(( segid " " and resid 212 and name HA ))
( segid " " and resid 266 and name HD2%)
OR { 345}
(( segid " " and resid 212 and name HA ))
( segid " " and resid 263 and name HG2%)
OR { 345}
(( segid " " and resid 212 and name HA ))
(( segid " " and resid 209 and name HG ))
OR { 345}
(( segid " " and resid 212 and name HA ))
( segid " " and resid 274 and name HD2%)
ASSI { 722}
( segid " " and resid 357 and name HD2%)
(( segid " " and resid 343 and name HA ))
3.100 1.200 1.200 peak 722 spectrum 1 weight 0.10000E+01 volume 0.48184E-02 ppm1 0.870 ppm2 4.041 CV 1
OR { 722}
( segid " " and resid 357 and name HD2%)
(( segid " " and resid 355 and name HA ))
OR { 722}
( segid " " and resid 357 and name HD2%)
(( segid " " and resid 358 and name HA ))
ASSI { 814}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 440 and name HD3 ))
3.300 1.400 1.400 peak 814 spectrum 1 weight 0.10000E+01 volume 0.41052E-02 ppm1 0.766 ppm2 1.607 CV 1
OR { 814}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 436 and name HG ))
OR { 814}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 440 and name HD2 ))
OR { 814}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 399 and name HD3 ))
OR { 814}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 399 and name HD2 ))
OR { 814}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 443 and name HG ))
OR { 814}
( segid " " and resid 402 and name HG2%)
(( segid " " and resid 443 and name HB3 ))
ASSI { 1105}
( segid " " and resid 310 and name HD2%)
(( segid " " and resid 309 and name H ))
3.600 1.600 1.600 peak 1105 spectrum 1 weight 0.10000E+01 volume 0.13505E-02 ppm1 1.087 ppm2 7.546 CV 1
OR { 1105}
( segid " " and resid 310 and name HD2%)
(( segid " " and resid 280 and name HG1 ))
ASSI { 402}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 309 and name HG3 ))
2.800 1.000 1.000 peak 402 spectrum 1 weight 0.10000E+01 volume 0.11157E-01 ppm1 0.903 ppm2 2.165 CV 1
OR { 402}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 282 and name HG3 ))
OR { 402}
( segid " " and resid 283 and name HD2%)
(( segid " " and resid 310 and name HG ))
ASSI { 52}
(( segid " " and resid 304 and name HG3 ))
(( segid " " and resid 300 and name HA ))
4.000 2.000 2.000 peak 52 spectrum 1 weight 0.10000E+01 volume 0.81483E-03 ppm1 2.299 ppm2 2.864 CV 1
OR { 52}
(( segid " " and resid 304 and name HG3 ))
(( segid " " and resid 308 and name HE2 ))
OR { 52}
(( segid " " and resid 304 and name HG3 ))
(( segid " " and resid 308 and name HE3 ))
ASSI { 65}
(( segid " " and resid 324 and name HD2 ))
( segid " " and resid 325 and name HE% )
5.200 3.300 0.800 peak 65 spectrum 1 weight 0.10000E+01 volume 0.40036E-03 ppm1 7.142 ppm2 0.901 CV 1
OR { 65}
(( segid " " and resid 324 and name HD2 ))
( segid " " and resid 321 and name HD1%)
OR { 65}
(( segid " " and resid 324 and name HD2 ))
( segid " " and resid 267 and name HD2%)
OR { 65}
(( segid " " and resid 324 and name HD2 ))
( segid " " and resid 364 and name HG2%)
ASSI { 3666}
( segid " " and resid 230 and name HG2%)
(( segid " " and resid 231 and name HB3 ))
3.300 1.400 1.400 peak 3666 spectrum 1 weight 0.10000E+01 volume 0.22923E-02 ppm1 0.950 ppm2 2.817 CV 1
OR { 3666}
( segid " " and resid 230 and name HG2%)
(( segid " " and resid 227 and name HB3 ))
OR { 3666}
( segid " " and resid 230 and name HG2%)
(( segid " " and resid 231 and name HB2 ))
ASSI { 968}
( segid " " and resid 323 and name HG1%)
( segid " " and resid 368 and name HD% )
3.900 1.900 1.900 peak 968 spectrum 1 weight 0.10000E+01 volume 0.29041E-02 ppm1 0.781 ppm2 7.147 CV 1
OR { 968}
( segid " " and resid 380 and name HD2%)
(( segid " " and resid 382 and name HE3 ))
OR { 968}
( segid " " and resid 323 and name HG1%)
(( segid " " and resid 324 and name HD2 ))
OR { 968}
( segid " " and resid 323 and name HG1%)
( segid " " and resid 361 and name HD% )
OR { 968}
( segid " " and resid 323 and name HG1%)
( segid " " and resid 213 and name HE% )
ASSI { 557}
( segid " " and resid 371 and name HG1%)
( segid " " and resid 323 and name HG1%)
2.200 0.600 0.600 peak 557 spectrum 1 weight 0.10000E+01 volume 0.97020E-02 ppm1 0.366 ppm2 0.769 CV 1
OR { 557}
( segid " " and resid 371 and name HG1%)
( segid " " and resid 372 and name HG2%)
ASSI { 1390}
( segid " " and resid 367 and name HD2%)
(( segid " " and resid 304 and name HG3 ))
3.200 1.200 1.200 peak 1390 spectrum 1 weight 0.10000E+01 volume 0.18721E-02 ppm1 0.781 ppm2 2.269 CV 1
OR { 1390}
( segid " " and resid 367 and name HD2%)
(( segid " " and resid 307 and name HG ))
ASSI { 1059}
(( segid " " and resid 239 and name HD3 ))
( segid " " and resid 262 and name HG2%)
3.400 1.400 1.400 peak 1059 spectrum 1 weight 0.10000E+01 volume 0.19595E-02 ppm1 1.677 ppm2 1.068 CV 1
OR { 1059}
(( segid " " and resid 239 and name HD3 ))
( segid " " and resid 240 and name HG1%)
ASSI { 2670}
(( segid " " and resid 199 and name HB3 ))
(( segid " " and resid 199 and name HA ))
2.400 0.700 0.700 peak 2670 spectrum 1 weight 0.10000E+01 volume 0.56194E-02 ppm1 2.090 ppm2 3.800 CV 1
OR { 2670}
(( segid " " and resid 302 and name HB3 ))
(( segid " " and resid 299 and name HA ))
ASSI { 4622}
(( segid " " and resid 325 and name HA ))
(( segid " " and resid 328 and name HB ))
3.200 1.300 1.300 peak 4622 spectrum 1 weight 0.10000E+01 volume 0.10911E-02 ppm1 3.857 ppm2 2.397 CV 1
OR { 4622}
(( segid " " and resid 325 and name HA ))
(( segid " " and resid 325 and name HG2 ))
ASSI { 419}
(( segid " " and resid 327 and name HA ))
(( segid " " and resid 327 and name HD2 ))
3.900 1.900 1.900 peak 419 spectrum 1 weight 0.10000E+01 volume 0.55263E-03 ppm1 4.423 ppm2 7.170 CV 1
OR { 419}
(( segid " " and resid 327 and name HA ))
(( segid " " and resid 328 and name H ))
ASSI { 917}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 440 and name HA ))
2.500 0.800 0.800 peak 917 spectrum 1 weight 0.10000E+01 volume 0.39980E-02 ppm1 0.702 ppm2 3.777 CV 1
OR { 917}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 399 and name HA ))
OR { 917}
( segid " " and resid 402 and name HD1%)
(( segid " " and resid 439 and name HA ))
ASSI { 189}
( segid " " and resid 339 and name HG2%)
(( segid " " and resid 344 and name H ))
4.900 3.000 1.100 peak 189 spectrum 1 weight 0.10000E+01 volume 0.52161E-03 ppm1 0.711 ppm2 7.699 CV 1
OR { 189}
( segid " " and resid 339 and name HG2%)
(( segid " " and resid 338 and name H ))
ASSI { 92}
( segid " " and resid 409 and name HD2%)
(( segid " " and resid 433 and name H ))
3.800 1.800 1.800 peak 92 spectrum 1 weight 0.10000E+01 volume 0.30930E-02 ppm1 0.743 ppm2 8.319 CV 1
OR { 92}
( segid " " and resid 278 and name HD2%)
(( segid " " and resid 314 and name HD22))
ASSI { 46}
(( segid " " and resid 293 and name HD3 ))
(( segid " " and resid 299 and name HA ))
5.100 3.300 0.900 peak 46 spectrum 1 weight 0.10000E+01 volume 0.52161E-03 ppm1 3.156 ppm2 3.769 CV 1
OR { 46}
(( segid " " and resid 293 and name HD3 ))
(( segid " " and resid 292 and name HA2 ))
OR { 46}
(( segid " " and resid 293 and name HD3 ))
(( segid " " and resid 296 and name HA ))
ASSI { 1287}
( segid " " and resid 263 and name HG2%)
(( segid " " and resid 219 and name HB2 ))
3.100 1.200 1.200 peak 1287 spectrum 1 weight 0.10000E+01 volume 0.30281E-02 ppm1 0.809 ppm2 3.162 CV 1
OR { 1287}
( segid " " and resid 263 and name HG2%)
(( segid " " and resid 263 and name HA ))
OR { 1287}
( segid " " and resid 263 and name HG2%)
(( segid " " and resid 219 and name HB3 ))
ASSI { 1604}
(( segid " " and resid 426 and name HG3 ))
(( segid " " and resid 425 and name HB2 ))
3.300 1.400 1.400 peak 1604 spectrum 1 weight 0.10000E+01 volume 0.15902E-02 ppm1 1.983 ppm2 1.619 CV 1
OR { 1604}
(( segid " " and resid 426 and name HG3 ))
(( segid " " and resid 416 and name HG ))
OR { 1604}
(( segid " " and resid 426 and name HG3 ))
(( segid " " and resid 423 and name HB3 ))
OR { 1604}
(( segid " " and resid 426 and name HG3 ))
(( segid " " and resid 423 and name HG ))
OR { 1604}
(( segid " " and resid 426 and name HG3 ))
(( segid " " and resid 425 and name HD2 ))
ASSI { 1454}
(( segid " " and resid 364 and name HB ))
( segid " " and resid 361 and name HD% )
4.800 2.900 1.200 peak 1454 spectrum 1 weight 0.10000E+01 volume 0.69077E-03 ppm1 2.123 ppm2 7.143 CV 1
OR { 1454}
(( segid " " and resid 364 and name HB ))
( segid " " and resid 368 and name HD% )
ASSI { 943}
( segid " " and resid 420 and name HG2%)
(( segid " " and resid 416 and name H ))
3.600 1.600 1.600 peak 943 spectrum 1 weight 0.10000E+01 volume 0.10545E-02 ppm1 0.804 ppm2 7.958 CV 1
OR { 943}
( segid " " and resid 420 and name HG2%)
(( segid " " and resid 426 and name H ))
ASSI { 828}
(( segid " " and resid 217 and name HA ))
(( segid " " and resid 216 and name HB3 ))
4.800 2.900 1.200 peak 828 spectrum 1 weight 0.10000E+01 volume 0.34962E-03 ppm1 2.987 ppm2 2.710 CV 1
OR { 828}
(( segid " " and resid 217 and name HA ))
(( segid " " and resid 216 and name HG ))
OR { 828}
(( segid " " and resid 217 and name HA ))
(( segid " " and resid 218 and name HB2 ))
OR { 828}
(( segid " " and resid 217 and name HA ))
(( segid " " and resid 213 and name HB3 ))
ASSI { 1215}
(( segid " " and resid 217 and name HG12))
(( segid " " and resid 213 and name HB3 ))
5.600 3.900 0.400 peak 1215 spectrum 1 weight 0.10000E+01 volume 0.31296E-03 ppm1 0.524 ppm2 2.754 CV 1
OR { 1215}
(( segid " " and resid 217 and name HG12))
(( segid " " and resid 216 and name HB3 ))
OR { 1215}
(( segid " " and resid 217 and name HG12))
(( segid " " and resid 218 and name HB2 ))
OR { 1215}
(( segid " " and resid 217 and name HG12))
(( segid " " and resid 216 and name HG ))
ASSI { 671}
(( segid " " and resid 312 and name HG3 ))
(( segid " " and resid 208 and name HG3 ))
3.300 1.400 1.400 peak 671 spectrum 1 weight 0.10000E+01 volume 0.25883E-02 ppm1 2.074 ppm2 0.757 CV 1
OR { 671}
(( segid " " and resid 312 and name HG3 ))
(( segid " " and resid 208 and name HG2 ))
OR { 671}
(( segid " " and resid 312 and name HG3 ))
( segid " " and resid 316 and name HD2%)
OR { 671}
(( segid " " and resid 221 and name HG2 ))
(( segid " " and resid 222 and name HB3 ))
OR { 671}
(( segid " " and resid 221 and name HG2 ))
( segid " " and resid 328 and name HG2%)
ASSI { 41}
(( segid " " and resid 426 and name HG3 ))
( segid " " and resid 416 and name HD2%)
3.400 1.400 1.400 peak 41 spectrum 1 weight 0.10000E+01 volume 0.23063E-02 ppm1 1.992 ppm2 0.685 CV 1
OR { 41}
(( segid " " and resid 426 and name HG3 ))
( segid " " and resid 429 and name HD2%)
ASSI { 362}
( segid " " and resid 246 and name HB% )
(( segid " " and resid 247 and name HA ))
3.900 1.900 1.900 peak 362 spectrum 1 weight 0.10000E+01 volume 0.14126E-02 ppm1 1.177 ppm2 4.141 CV 1
OR { 362}
( segid " " and resid 246 and name HB% )
(( segid " " and resid 253 and name HA ))
ASSI { 438}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 360 and name HB2 ))
4.100 2.100 1.900 peak 438 spectrum 1 weight 0.10000E+01 volume 0.13928E-02 ppm1 0.394 ppm2 2.725 CV 1
OR { 438}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 326 and name HB3 ))
OR { 438}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 325 and name HG3 ))
OR { 438}
( segid " " and resid 322 and name HG2%)
(( segid " " and resid 368 and name HB3 ))
ASSI { 103}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 209 and name HA ))
3.100 1.200 1.200 peak 103 spectrum 1 weight 0.10000E+01 volume 0.21428E-02 ppm1 0.624 ppm2 4.382 CV 1
OR { 103}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 313 and name HA ))
OR { 103}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 201 and name HB ))
OR { 103}
( segid " " and resid 198 and name HG2%)
(( segid " " and resid 196 and name HA ))
ASSI { 985}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 214 and name HA ))
4.500 2.500 1.500 peak 985 spectrum 1 weight 0.10000E+01 volume 0.14323E-02 ppm1 2.221 ppm2 3.558 CV 1
OR { 985}
( segid " " and resid 203 and name HE% )
(( segid " " and resid 213 and name HA ))
ASSI { 1469}
( segid " " and resid 243 and name HD2%)
(( segid " " and resid 263 and name HA ))
4.400 2.400 1.600 peak 1469 spectrum 1 weight 0.10000E+01 volume 0.10094E-02 ppm1 0.168 ppm2 3.228 CV 1
OR { 1469}
( segid " " and resid 243 and name HD2%)
(( segid " " and resid 240 and name HA ))
OR { 1469}
( segid " " and resid 243 and name HD2%)
(( segid " " and resid 244 and name HA ))
ASSI { 1912}
(( segid " " and resid 304 and name HB3 ))
(( segid " " and resid 304 and name HE21))
5.300 3.500 0.700 peak 1912 spectrum 1 weight 0.10000E+01 volume 0.42575E-03 ppm1 1.878 ppm2 6.677 CV 1
OR { 1912}
(( segid " " and resid 301 and name HB3 ))
(( segid " " and resid 301 and name HE21))
OR { 1912}
(( segid " " and resid 301 and name HB3 ))
(( segid " " and resid 304 and name HE21))
ASSI { 157}
( segid " " and resid 423 and name HD2%)
(( segid " " and resid 430 and name HH2 ))
2.900 1.000 1.000 peak 157 spectrum 1 weight 0.10000E+01 volume 0.60449E-02 ppm1 0.826 ppm2 7.046 CV 1
OR { 157}
( segid " " and resid 316 and name HD1%)
( segid " " and resid 315 and name HD% )
ASSI { 1111}
( segid " " and resid 211 and name HB% )
( segid " " and resid 376 and name HG1%)
4.500 2.500 1.500 peak 1111 spectrum 1 weight 0.10000E+01 volume 0.12772E-02 ppm1 1.690 ppm2 0.917 CV 1
OR { 1111}
( segid " " and resid 211 and name HB% )
( segid " " and resid 376 and name HG2%)
OR { 1111}
( segid " " and resid 211 and name HB% )
( segid " " and resid 189 and name HG2%)
OR { 1111}
( segid " " and resid 211 and name HB% )
( segid " " and resid 207 and name HD1%)
OR { 1111}
( segid " " and resid 211 and name HB% )
( segid " " and resid 267 and name HD1%)
ASSI { 208}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 270 and name H ))
5.400 3.600 0.600 peak 208 spectrum 1 weight 0.10000E+01 volume 0.32988E-03 ppm1 -0.165 ppm2 8.506 CV 1
OR { 208}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 244 and name H ))
OR { 208}
( segid " " and resid 212 and name HG2%)
(( segid " " and resid 272 and name H ))
ASSI { 408}
( segid " " and resid 307 and name HD1%)
(( segid " " and resid 360 and name HZ ))
3.600 1.700 1.700 peak 408 spectrum 1 weight 0.10000E+01 volume 0.17171E-02 ppm1 1.210 ppm2 6.626 CV 1
OR { 408}
( segid " " and resid 307 and name HD1%)
(( segid " " and resid 304 and name HE21))
Contact the webmaster for help, if required. Sunday, April 28, 2024 11:03:07 PM GMT (wattos1)