NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
14640 |
1x32   |
6589 | cing | 1-original | 2 | XPLOR/CNS | distance | NOE | simple |
ASSI { 36}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HA1 ))
2.400 0.700 0.700 peak 36 spectrum 1 weight 0.10000E+01 volume 0.74400E-02 ppm1 7.798 ppm2 3.716 CV 1
ASSI { 84}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HA ))
3.300 1.400 1.400 peak 84 spectrum 1 weight 0.10000E+01 volume 0.32060E-02 ppm1 8.109 ppm2 4.349 CV 1
ASSI { 86}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 18 and name HN ))
3.400 1.500 1.500 peak 86 spectrum 1 weight 0.10000E+01 volume 0.74608E-03 ppm1 8.109 ppm2 7.583 CV 1
ASSI { 89}
(( segid " " and resid 15 and name HN ))
( segid " " and resid 14 and name HB% )
2.300 0.700 0.700 peak 89 spectrum 1 weight 0.10000E+01 volume 0.61404E-02 ppm1 8.109 ppm2 1.021 CV 1
ASSI { 94}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 16 and name HN ))
2.900 1.100 1.100 peak 94 spectrum 1 weight 0.10000E+01 volume 0.16742E-02 ppm1 8.109 ppm2 8.544 CV 1
ASSI { 95}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HN ))
2.200 0.600 0.600 peak 95 spectrum 1 weight 0.10000E+01 volume 0.26331E-02 ppm1 8.109 ppm2 8.403 CV 1
ASSI { 109}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 10 and name HA1 ))
3.100 1.200 1.200 peak 109 spectrum 1 weight 0.10000E+01 volume 0.15033E-02 ppm1 7.305 ppm2 4.091 CV 1
ASSI { 115}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 10 and name HA2 ))
3.600 1.700 1.700 peak 115 spectrum 1 weight 0.10000E+01 volume 0.12530E-02 ppm1 7.305 ppm2 3.763 CV 1
ASSI { 116}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 9 and name HN ))
3.700 1.700 1.700 peak 116 spectrum 1 weight 0.10000E+01 volume 0.21217E-02 ppm1 7.305 ppm2 8.849 CV 1
ASSI { 122}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 18 and name HN ))
2.200 0.600 0.600 peak 122 spectrum 1 weight 0.10000E+01 volume 0.46481E-02 ppm1 8.332 ppm2 7.583 CV 1
ASSI { 124}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 18 and name HB% )
4.700 2.700 1.300 peak 124 spectrum 1 weight 0.10000E+01 volume 0.11005E-02 ppm1 8.332 ppm2 1.232 CV 1
ASSI { 128}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HA1 ))
2.400 0.700 0.700 peak 128 spectrum 1 weight 0.10000E+01 volume 0.73782E-02 ppm1 8.332 ppm2 3.575 CV 1
ASSI { 130}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HA2 ))
2.500 0.800 0.800 peak 130 spectrum 1 weight 0.10000E+01 volume 0.10590E-01 ppm1 8.332 ppm2 3.974 CV 1
ASSI { 132}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HN ))
2.900 1.000 1.000 peak 132 spectrum 1 weight 0.10000E+01 volume 0.17986E-02 ppm1 8.332 ppm2 8.544 CV 1
ASSI { 160}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 3 and name HA2 ))
2.900 1.100 1.100 peak 160 spectrum 1 weight 0.10000E+01 volume 0.33488E-02 ppm1 8.579 ppm2 3.857 CV 1
ASSI { 167}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 4 and name HN ))
4.300 2.300 1.700 peak 167 spectrum 1 weight 0.10000E+01 volume 0.11015E-02 ppm1 8.579 ppm2 8.263 CV 1
ASSI { 230}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HA2 ))
2.600 0.900 0.900 peak 230 spectrum 1 weight 0.10000E+01 volume 0.37833E-02 ppm1 8.573 ppm2 3.763 CV 1
ASSI { 232}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HA1 ))
3.300 1.400 1.400 peak 232 spectrum 1 weight 0.10000E+01 volume 0.39372E-02 ppm1 8.573 ppm2 4.114 CV 1
ASSI { 233}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 21 and name HE% )
4.400 2.400 1.600 peak 233 spectrum 1 weight 0.10000E+01 volume 0.76424E-03 ppm1 8.579 ppm2 6.693 CV 1
ASSI { 258}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HN ))
3.500 1.600 1.600 peak 258 spectrum 1 weight 0.10000E+01 volume 0.92134E-03 ppm1 8.232 ppm2 8.872 CV 1
ASSI { 260}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 34 and name HA ))
4.500 2.500 1.500 peak 260 spectrum 1 weight 0.10000E+01 volume 0.17140E-02 ppm1 8.232 ppm2 4.888 CV 1
ASSI { 265}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HB2 ))
2.600 0.900 0.900 peak 265 spectrum 1 weight 0.10000E+01 volume 0.40779E-02 ppm1 7.986 ppm2 3.833 CV 1
ASSI { 269}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 36 and name HN ))
3.000 1.100 1.100 peak 269 spectrum 1 weight 0.10000E+01 volume 0.19317E-02 ppm1 7.986 ppm2 8.286 CV 1
ASSI { 279}
(( segid " " and resid 6 and name HD22))
(( segid " " and resid 6 and name HB2 ))
4.500 2.500 1.500 peak 279 spectrum 1 weight 0.10000E+01 volume 0.95952E-03 ppm1 7.845 ppm2 2.193 CV 1
ASSI { 283}
(( segid " " and resid 6 and name HD22))
(( segid " " and resid 6 and name HD21))
2.100 0.500 0.500 peak 283 spectrum 1 weight 0.10000E+01 volume 0.44752E-02 ppm1 7.845 ppm2 7.068 CV 1
ASSI { 302}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 21 and name HD% )
3.900 1.900 1.900 peak 302 spectrum 1 weight 0.10000E+01 volume 0.79909E-03 ppm1 7.710 ppm2 6.974 CV 1
ASSI { 305}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 23 and name HN ))
3.700 1.700 1.700 peak 305 spectrum 1 weight 0.10000E+01 volume 0.18769E-02 ppm1 7.710 ppm2 8.122 CV 1
ASSI { 312}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 38 and name HE% )
3.800 1.800 1.800 peak 312 spectrum 1 weight 0.10000E+01 volume 0.15846E-02 ppm1 7.710 ppm2 6.763 CV 1
ASSI { 315}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 23 and name HG2%)
2.700 2.700 3.300 peak 315 spectrum 1 weight 0.10000E+01 volume 0.10336E-02 ppm1 7.710 ppm2 0.880 CV 1
ASSI { 316}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 25 and name HE1 ))
3.500 1.500 1.500 peak 316 spectrum 1 weight 0.10000E+01 volume 0.22292E-02 ppm1 7.710 ppm2 9.646 CV 1
ASSI { 333}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 25 and name HH2 ))
4.600 2.600 1.400 peak 333 spectrum 1 weight 0.10000E+01 volume 0.73613E-03 ppm1 8.309 ppm2 6.880 CV 1
ASSI { 334}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 6 and name HA ))
2.300 2.300 3.700 peak 334 spectrum 1 weight 0.10000E+01 volume 0.32285E-02 ppm1 8.309 ppm2 3.669 CV 1
ASSI { 336}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 8 and name HB ))
5.100 3.200 0.900 peak 336 spectrum 1 weight 0.10000E+01 volume 0.80822E-03 ppm1 7.558 ppm2 1.419 CV 1
ASSI { 384}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 43 and name HN ))
3.300 1.300 1.300 peak 384 spectrum 1 weight 0.10000E+01 volume 0.10893E-02 ppm1 8.168 ppm2 7.677 CV 1
ASSI { 396}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 12 and name HB2 ))
3.400 1.500 1.500 peak 396 spectrum 1 weight 0.10000E+01 volume 0.95705E-03 ppm1 8.890 ppm2 1.794 CV 1
ASSI { 400}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 19 and name HA ))
4.500 2.600 1.500 peak 400 spectrum 1 weight 0.10000E+01 volume 0.82381E-03 ppm1 8.890 ppm2 4.958 CV 1
ASSI { 403}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 21 and name HA ))
4.100 2.100 1.900 peak 403 spectrum 1 weight 0.10000E+01 volume 0.91286E-03 ppm1 8.890 ppm2 5.193 CV 1
ASSI { 413}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HA ))
2.300 0.700 0.700 peak 413 spectrum 1 weight 0.10000E+01 volume 0.64921E-02 ppm1 8.473 ppm2 4.443 CV 1
ASSI { 414}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HB2 ))
4.200 2.200 1.800 peak 414 spectrum 1 weight 0.10000E+01 volume 0.18724E-02 ppm1 8.473 ppm2 2.872 CV 1
ASSI { 416}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HA ))
2.700 0.900 0.900 peak 416 spectrum 1 weight 0.10000E+01 volume 0.19507E-02 ppm1 8.473 ppm2 3.857 CV 1
ASSI { 419}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 38 and name HD% )
4.400 2.500 1.600 peak 419 spectrum 1 weight 0.10000E+01 volume 0.79744E-03 ppm1 8.473 ppm2 6.997 CV 1
ASSI { 429}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HN ))
3.500 1.600 1.600 peak 429 spectrum 1 weight 0.10000E+01 volume 0.27853E-02 ppm1 8.180 ppm2 8.005 CV 1
ASSI { 436}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HB ))
3.400 1.500 1.500 peak 436 spectrum 1 weight 0.10000E+01 volume 0.17845E-02 ppm1 8.186 ppm2 1.911 CV 1
ASSI { 437}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HB2 ))
2.900 1.100 1.100 peak 437 spectrum 1 weight 0.10000E+01 volume 0.32561E-02 ppm1 8.186 ppm2 3.646 CV 1
ASSI { 438}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HA ))
2.300 0.700 0.700 peak 438 spectrum 1 weight 0.10000E+01 volume 0.66409E-02 ppm1 8.186 ppm2 3.927 CV 1
ASSI { 449}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 3 and name HA2 ))
2.900 1.000 1.000 peak 449 spectrum 1 weight 0.10000E+01 volume 0.44521E-02 ppm1 8.285 ppm2 3.857 CV 1
ASSI { 451}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HA1 ))
2.900 1.100 1.100 peak 451 spectrum 1 weight 0.10000E+01 volume 0.19762E-02 ppm1 7.921 ppm2 3.716 CV 1
ASSI { 452}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 47 and name HB2 ))
4.200 2.200 1.800 peak 452 spectrum 1 weight 0.10000E+01 volume 0.18344E-02 ppm1 7.921 ppm2 2.685 CV 1
ASSI { 458}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HA ))
2.900 1.000 1.000 peak 458 spectrum 1 weight 0.10000E+01 volume 0.33298E-02 ppm1 7.921 ppm2 4.443 CV 1
ASSI { 459}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HB2 ))
2.600 0.800 0.800 peak 459 spectrum 1 weight 0.10000E+01 volume 0.45153E-02 ppm1 7.921 ppm2 2.872 CV 1
ASSI { 470}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 25 and name HZ2 ))
4.500 2.500 1.500 peak 470 spectrum 1 weight 0.10000E+01 volume 0.74783E-03 ppm1 8.285 ppm2 7.396 CV 1
ASSI { 486}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HB ))
3.600 1.600 1.600 peak 486 spectrum 1 weight 0.10000E+01 volume 0.13496E-02 ppm1 7.699 ppm2 1.935 CV 1
ASSI { 526}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 19 and name HA ))
2.400 0.700 0.700 peak 526 spectrum 1 weight 0.10000E+01 volume 0.26414E-02 ppm1 8.461 ppm2 4.958 CV 1
ASSI { 529}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HN ))
4.000 2.000 2.000 peak 529 spectrum 1 weight 0.10000E+01 volume 0.83059E-03 ppm1 8.467 ppm2 7.560 CV 1
ASSI { 538}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 19 and name HG2 ))
3.700 1.700 1.700 peak 538 spectrum 1 weight 0.10000E+01 volume 0.14544E-02 ppm1 8.461 ppm2 2.216 CV 1
ASSI { 558}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 8 and name HA ))
2.500 0.800 0.800 peak 558 spectrum 1 weight 0.10000E+01 volume 0.30176E-02 ppm1 8.860 ppm2 4.044 CV 1
ASSI { 607}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 4 and name HA ))
3.100 1.200 1.200 peak 607 spectrum 1 weight 0.10000E+01 volume 0.17914E-02 ppm1 8.221 ppm2 4.372 CV 1
ASSI { 618}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HB2 ))
2.700 0.900 0.900 peak 618 spectrum 1 weight 0.10000E+01 volume 0.46464E-02 ppm1 8.045 ppm2 3.060 CV 1
ASSI { 621}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 39 and name HN ))
3.300 1.300 1.300 peak 621 spectrum 1 weight 0.10000E+01 volume 0.23608E-02 ppm1 8.045 ppm2 7.232 CV 1
ASSI { 626}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 34 and name HB ))
3.300 1.400 1.400 peak 626 spectrum 1 weight 0.10000E+01 volume 0.17882E-02 ppm1 8.051 ppm2 1.958 CV 1
ASSI { 639}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 47 and name HN ))
3.300 1.300 1.300 peak 639 spectrum 1 weight 0.10000E+01 volume 0.31528E-02 ppm1 8.115 ppm2 7.513 CV 1
ASSI { 649}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HB2 ))
3.900 1.900 1.900 peak 649 spectrum 1 weight 0.10000E+01 volume 0.12814E-02 ppm1 8.121 ppm2 3.646 CV 1
ASSI { 676}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HN ))
3.600 1.600 1.600 peak 676 spectrum 1 weight 0.10000E+01 volume 0.10120E-02 ppm1 7.986 ppm2 7.700 CV 1
ASSI { 681}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 18 and name HB% )
2.100 0.600 0.600 peak 681 spectrum 1 weight 0.10000E+01 volume 0.92785E-02 ppm1 7.599 ppm2 1.255 CV 1
ASSI { 682}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 18 and name HA ))
2.500 0.800 0.800 peak 682 spectrum 1 weight 0.10000E+01 volume 0.28368E-02 ppm1 7.593 ppm2 4.443 CV 1
ASSI { 684}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HA1 ))
3.100 1.200 1.200 peak 684 spectrum 1 weight 0.10000E+01 volume 0.17158E-02 ppm1 7.593 ppm2 3.575 CV 1
ASSI { 685}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 13 and name HG1 ))
4.300 2.300 1.700 peak 685 spectrum 1 weight 0.10000E+01 volume 0.12699E-02 ppm1 7.593 ppm2 1.044 CV 1
ASSI { 687}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HB ))
3.100 1.200 1.200 peak 687 spectrum 1 weight 0.10000E+01 volume 0.25540E-02 ppm1 7.992 ppm2 1.911 CV 1
ASSI { 711}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 7 and name HN ))
3.700 1.700 1.700 peak 711 spectrum 1 weight 0.10000E+01 volume 0.85176E-03 ppm1 8.860 ppm2 7.536 CV 1
ASSI { 717}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HB2 ))
3.700 1.700 1.700 peak 717 spectrum 1 weight 0.10000E+01 volume 0.93118E-03 ppm1 8.860 ppm2 2.193 CV 1
ASSI { 726}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 26 and name HB2 ))
3.700 1.700 1.700 peak 726 spectrum 1 weight 0.10000E+01 volume 0.99321E-03 ppm1 9.036 ppm2 1.677 CV 1
ASSI { 751}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HA ))
3.200 1.200 1.200 peak 751 spectrum 1 weight 0.10000E+01 volume 0.13442E-02 ppm1 7.517 ppm2 4.232 CV 1
ASSI { 756}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HB2 ))
2.700 0.900 0.900 peak 756 spectrum 1 weight 0.10000E+01 volume 0.32000E-02 ppm1 7.517 ppm2 2.685 CV 1
ASSI { 791}
(( segid " " and resid 40 and name HN ))
( segid " " and resid 41 and name HB% )
4.100 2.100 1.900 peak 791 spectrum 1 weight 0.10000E+01 volume 0.98905E-03 ppm1 7.916 ppm2 1.279 CV 1
ASSI { 803}
(( segid " " and resid 23 and name HN ))
( segid " " and resid 23 and name HG2%)
3.200 1.300 1.300 peak 803 spectrum 1 weight 0.10000E+01 volume 0.23770E-02 ppm1 8.133 ppm2 0.880 CV 1
ASSI { 811}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 7 and name HG2 ))
3.600 3.600 2.400 peak 811 spectrum 1 weight 0.10000E+01 volume 0.20270E-02 ppm1 8.133 ppm2 1.091 CV 1
ASSI { 818}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 10 and name HN ))
3.400 1.400 1.400 peak 818 spectrum 1 weight 0.10000E+01 volume 0.11914E-02 ppm1 7.699 ppm2 7.278 CV 1
ASSI { 825}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HB2 ))
3.500 1.500 1.500 peak 825 spectrum 1 weight 0.10000E+01 volume 0.93928E-03 ppm1 7.699 ppm2 2.286 CV 1
ASSI { 838}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 12 and name HN ))
4.700 2.700 1.300 peak 838 spectrum 1 weight 0.10000E+01 volume 0.87435E-03 ppm1 7.699 ppm2 8.872 CV 1
ASSI { 839}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HA ))
2.600 0.800 0.800 peak 839 spectrum 1 weight 0.10000E+01 volume 0.36513E-02 ppm1 7.699 ppm2 5.193 CV 1
ASSI { 840}
(( segid " " and resid 22 and name HN ))
( segid " " and resid 22 and name HD2%)
3.400 1.400 1.400 peak 840 spectrum 1 weight 0.10000E+01 volume 0.24368E-02 ppm1 7.699 ppm2 0.435 CV 1
OR { 840}
(( segid " " and resid 22 and name HN ))
( segid " " and resid 22 and name HD1%)
ASSI { 870}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 19 and name HA ))
1.800 0.400 0.400 peak 870 spectrum 1 weight 0.10000E+01 volume 0.37748E-02 ppm1 8.420 ppm2 4.958 CV 1
ASSI { 871}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 18 and name HB% )
4.000 2.000 2.000 peak 871 spectrum 1 weight 0.10000E+01 volume 0.15388E-02 ppm1 8.420 ppm2 1.232 CV 1
ASSI { 879}
(( segid " " and resid 25 and name HE1 ))
( segid " " and resid 21 and name HD% )
3.600 3.600 2.400 peak 879 spectrum 1 weight 0.10000E+01 volume 0.22474E-02 ppm1 9.658 ppm2 6.974 CV 1
ASSI { 881}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HA ))
2.700 0.900 0.900 peak 881 spectrum 1 weight 0.10000E+01 volume 0.25293E-02 ppm1 8.420 ppm2 4.349 CV 1
ASSI { 887}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 14 and name HB% )
2.300 0.700 0.700 peak 887 spectrum 1 weight 0.10000E+01 volume 0.76845E-02 ppm1 8.420 ppm2 1.021 CV 1
ASSI { 888}
(( segid " " and resid 25 and name HE1 ))
( segid " " and resid 38 and name HE% )
3.100 3.100 2.900 peak 888 spectrum 1 weight 0.10000E+01 volume 0.38230E-02 ppm1 9.658 ppm2 6.763 CV 1
ASSI { 909}
(( segid " " and resid 33 and name HE1 ))
(( segid " " and resid 11 and name HA ))
4.000 2.000 2.000 peak 909 spectrum 1 weight 0.10000E+01 volume 0.15713E-02 ppm1 9.928 ppm2 5.661 CV 1
ASSI { 912}
(( segid " " and resid 33 and name HE1 ))
(( segid " " and resid 33 and name HZ2 ))
2.500 0.800 0.800 peak 912 spectrum 1 weight 0.10000E+01 volume 0.61869E-02 ppm1 9.928 ppm2 7.232 CV 1
ASSI { 6}
( segid " " and resid 38 and name HD% )
( segid " " and resid 38 and name HE% )
1.900 0.500 0.500 peak 6 spectrum 1 weight 0.10000E+01 volume 0.21160E-01 ppm1 6.971 ppm2 6.782 CV 1
ASSI { 9}
( segid " " and resid 21 and name HD% )
( segid " " and resid 21 and name HE% )
2.400 0.700 0.700 peak 9 spectrum 1 weight 0.10000E+01 volume 0.63866E-02 ppm1 6.951 ppm2 6.700 CV 1
ASSI { 14}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 47 and name HB2 ))
2.500 0.800 0.800 peak 14 spectrum 1 weight 0.10000E+01 volume 0.13121E-01 ppm1 2.883 ppm2 2.693 CV 1
ASSI { 23}
(( segid " " and resid 15 and name HA2 ))
(( segid " " and resid 15 and name HA1 ))
1.700 0.300 0.500 peak 23 spectrum 1 weight 0.10000E+01 volume 0.12400E-01 ppm1 3.860 ppm2 3.691 CV 1
ASSI { 31}
(( segid " " and resid 33 and name HE1 ))
(( segid " " and resid 33 and name HD1 ))
2.400 0.700 0.700 peak 31 spectrum 1 weight 0.10000E+01 volume 0.48653E-02 ppm1 9.925 ppm2 7.124 CV 1
ASSI { 45}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HB2 ))
3.400 1.400 1.400 peak 45 spectrum 1 weight 0.10000E+01 volume 0.10659E-02 ppm1 3.860 ppm2 3.760 CV 1
ASSI { 47}
( segid " " and resid 40 and name HB% )
( segid " " and resid 18 and name HB% )
2.600 2.600 3.400 peak 47 spectrum 1 weight 0.10000E+01 volume 0.11830E-02 ppm1 1.331 ppm2 1.230 CV 1
ASSI { 63}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 23 and name HA ))
2.200 0.600 0.600 peak 63 spectrum 1 weight 0.10000E+01 volume 0.74958E-02 ppm1 8.086 ppm2 3.979 CV 1
ASSI { 68}
(( segid " " and resid 33 and name HZ2 ))
(( segid " " and resid 33 and name HH2 ))
2.700 0.900 0.900 peak 68 spectrum 1 weight 0.10000E+01 volume 0.43104E-02 ppm1 7.231 ppm2 6.713 CV 1
ASSI { 69}
( segid " " and resid 40 and name HB% )
( segid " " and resid 39 and name HG2%)
3.500 1.500 1.500 peak 69 spectrum 1 weight 0.10000E+01 volume 0.55628E-02 ppm1 1.290 ppm2 0.697 CV 1
ASSI { 75}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HA ))
2.000 0.500 0.500 peak 75 spectrum 1 weight 0.10000E+01 volume 0.69417E-02 ppm1 8.448 ppm2 4.471 CV 1
ASSI { 78}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HA ))
2.900 1.000 1.000 peak 78 spectrum 1 weight 0.10000E+01 volume 0.47473E-02 ppm1 8.086 ppm2 4.170 CV 1
ASSI { 80}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 45 and name HB2 ))
3.300 1.400 1.400 peak 80 spectrum 1 weight 0.10000E+01 volume 0.45600E-02 ppm1 3.936 ppm2 3.623 CV 1
ASSI { 84}
(( segid " " and resid 15 and name HN ))
( segid " " and resid 18 and name HB% )
3.100 1.200 1.200 peak 84 spectrum 1 weight 0.10000E+01 volume 0.47406E-02 ppm1 8.086 ppm2 1.257 CV 1
ASSI { 85}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HA ))
2.500 0.800 0.800 peak 85 spectrum 1 weight 0.10000E+01 volume 0.42221E-02 ppm1 7.915 ppm2 4.061 CV 1
ASSI { 91}
( segid " " and resid 38 and name HD% )
( segid " " and resid 39 and name HG2%)
3.100 1.200 1.200 peak 91 spectrum 1 weight 0.10000E+01 volume 0.44949E-02 ppm1 6.978 ppm2 0.724 CV 1
ASSI { 120}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HA ))
2.500 0.800 0.800 peak 120 spectrum 1 weight 0.10000E+01 volume 0.58522E-02 ppm1 7.792 ppm2 4.430 CV 1
ASSI { 121}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 31 and name HD2 ))
2.000 0.500 0.500 peak 121 spectrum 1 weight 0.10000E+01 volume 0.53052E-02 ppm1 3.894 ppm2 3.527 CV 1
ASSI { 138}
(( segid " " and resid 39 and name HA ))
( segid " " and resid 18 and name HB% )
2.900 2.900 3.100 peak 138 spectrum 1 weight 0.10000E+01 volume 0.45274E-02 ppm1 4.059 ppm2 1.257 CV 1
ASSI { 139}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HA ))
2.500 0.800 0.800 peak 139 spectrum 1 weight 0.10000E+01 volume 0.48832E-02 ppm1 8.079 ppm2 4.320 CV 1
ASSI { 143}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 35 and name HG2 ))
2.200 2.200 3.800 peak 143 spectrum 1 weight 0.10000E+01 volume 0.31271E-02 ppm1 1.734 ppm2 1.449 CV 1
ASSI { 154}
(( segid " " and resid 40 and name HN ))
( segid " " and resid 40 and name HB% )
2.900 1.100 1.100 peak 154 spectrum 1 weight 0.10000E+01 volume 0.21907E-02 ppm1 7.915 ppm2 1.312 CV 1
ASSI { 162}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 4 and name HA ))
2.500 0.800 0.800 peak 162 spectrum 1 weight 0.10000E+01 volume 0.32818E-02 ppm1 8.250 ppm2 4.389 CV 1
ASSI { 177}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HB ))
1.800 0.400 0.400 peak 177 spectrum 1 weight 0.10000E+01 volume 0.29128E-02 ppm1 8.400 ppm2 4.006 CV 1
ASSI { 178}
(( segid " " and resid 25 and name HE1 ))
(( segid " " and resid 25 and name HD1 ))
2.600 0.900 0.900 peak 178 spectrum 1 weight 0.10000E+01 volume 0.24889E-02 ppm1 9.672 ppm2 6.809 CV 1
ASSI { 188}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 46 and name HA ))
2.400 0.700 0.700 peak 188 spectrum 1 weight 0.10000E+01 volume 0.21849E-02 ppm1 7.504 ppm2 4.129 CV 1
ASSI { 190}
(( segid " " and resid 25 and name HZ3 ))
( segid " " and resid 39 and name HG2%)
3.700 1.700 1.700 peak 190 spectrum 1 weight 0.10000E+01 volume 0.15333E-02 ppm1 6.773 ppm2 0.724 CV 1
ASSI { 212}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 13 and name HA ))
4.600 2.600 1.400 peak 212 spectrum 1 weight 0.10000E+01 volume 0.59019E-03 ppm1 4.811 ppm2 4.621 CV 1
ASSI { 213}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HA ))
2.200 0.600 0.600 peak 213 spectrum 1 weight 0.10000E+01 volume 0.34849E-02 ppm1 7.709 ppm2 4.895 CV 1
ASSI { 215}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 7 and name HG2 ))
3.600 3.600 2.400 peak 215 spectrum 1 weight 0.10000E+01 volume 0.15299E-02 ppm1 8.215 ppm2 1.080 CV 1
ASSI { 220}
(( segid " " and resid 25 and name HH2 ))
(( segid " " and resid 21 and name HB2 ))
3.200 1.300 1.300 peak 220 spectrum 1 weight 0.10000E+01 volume 0.38516E-02 ppm1 6.869 ppm2 2.297 CV 1
ASSI { 221}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 40 and name HB% )
4.100 2.100 1.900 peak 221 spectrum 1 weight 0.10000E+01 volume 0.21787E-02 ppm1 8.092 ppm2 1.312 CV 1
ASSI { 236}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HA ))
2.300 0.700 0.700 peak 236 spectrum 1 weight 0.10000E+01 volume 0.37973E-02 ppm1 8.113 ppm2 3.432 CV 1
ASSI { 245}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HA ))
3.000 1.100 1.100 peak 245 spectrum 1 weight 0.10000E+01 volume 0.22069E-02 ppm1 7.956 ppm2 4.184 CV 1
ASSI { 247}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HB ))
2.800 1.000 1.000 peak 247 spectrum 1 weight 0.10000E+01 volume 0.29779E-02 ppm1 3.901 ppm2 1.900 CV 1
ASSI { 248}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HA ))
2.900 1.100 1.100 peak 248 spectrum 1 weight 0.10000E+01 volume 0.21280E-02 ppm1 8.154 ppm2 4.416 CV 1
ASSI { 251}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 26 and name HB2 ))
2.500 0.800 0.800 peak 251 spectrum 1 weight 0.10000E+01 volume 0.54579E-02 ppm1 3.997 ppm2 1.695 CV 1
ASSI { 262}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HA1 ))
2.900 1.100 1.100 peak 262 spectrum 1 weight 0.10000E+01 volume 0.28316E-02 ppm1 8.086 ppm2 3.678 CV 1
ASSI { 266}
(( segid " " and resid 7 and name HG2 ))
( segid " " and resid 23 and name HG2%)
3.900 1.900 1.900 peak 266 spectrum 1 weight 0.10000E+01 volume 0.36646E-03 ppm1 1.078 ppm2 0.902 CV 1
ASSI { 280}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HA2 ))
2.900 1.000 1.000 peak 280 spectrum 1 weight 0.10000E+01 volume 0.13101E-02 ppm1 8.092 ppm2 3.869 CV 1
ASSI { 303}
(( segid " " and resid 25 and name HD1 ))
(( segid " " and resid 31 and name HA ))
3.600 1.700 1.700 peak 303 spectrum 1 weight 0.10000E+01 volume 0.23113E-02 ppm1 6.800 ppm2 4.881 CV 1
OR { 303}
(( segid " " and resid 25 and name HZ3 ))
(( segid " " and resid 31 and name HA ))
ASSI { 305}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HB2 ))
3.900 1.900 1.900 peak 305 spectrum 1 weight 0.10000E+01 volume 0.76430E-03 ppm1 8.154 ppm2 2.502 CV 1
ASSI { 309}
(( segid " " and resid 44 and name HA ))
( segid " " and resid 39 and name HG2%)
3.400 1.400 1.400 peak 309 spectrum 1 weight 0.10000E+01 volume 0.16617E-02 ppm1 3.942 ppm2 0.724 CV 1
ASSI { 324}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 34 and name HB ))
3.600 1.600 1.600 peak 324 spectrum 1 weight 0.10000E+01 volume 0.23954E-02 ppm1 6.978 ppm2 1.968 CV 1
ASSI { 330}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 6 and name HA ))
4.300 2.300 1.700 peak 330 spectrum 1 weight 0.10000E+01 volume 0.13004E-02 ppm1 8.154 ppm2 3.664 CV 1
ASSI { 331}
(( segid " " and resid 41 and name HA ))
( segid " " and resid 41 and name HB% )
3.500 1.500 1.500 peak 331 spectrum 1 weight 0.10000E+01 volume 0.11199E-02 ppm1 4.147 ppm2 1.271 CV 1
ASSI { 348}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 42 and name HA ))
3.400 1.400 1.400 peak 348 spectrum 1 weight 0.10000E+01 volume 0.12494E-02 ppm1 7.655 ppm2 4.416 CV 1
ASSI { 370}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HN ))
4.900 2.900 1.100 peak 370 spectrum 1 weight 0.10000E+01 volume 0.20352E-03 ppm1 7.901 ppm2 7.807 CV 1
ASSI { 389}
(( segid " " and resid 6 and name HA ))
( segid " " and resid 9 and name HG2%)
3.500 1.500 1.500 peak 389 spectrum 1 weight 0.10000E+01 volume 0.13818E-02 ppm1 3.642 ppm2 0.560 CV 1
ASSI { 411}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 11 and name HA ))
2.400 0.700 0.700 peak 411 spectrum 1 weight 0.10000E+01 volume 0.18914E-02 ppm1 8.879 ppm2 5.647 CV 1
ASSI { 415}
(( segid " " and resid 19 and name HB2 ))
( segid " " and resid 14 and name HB% )
2.500 2.500 3.500 peak 415 spectrum 1 weight 0.10000E+01 volume 0.15598E-02 ppm1 1.631 ppm2 1.025 CV 1
ASSI { 423}
(( segid " " and resid 39 and name HB ))
( segid " " and resid 18 and name HB% )
4.500 2.500 1.500 peak 423 spectrum 1 weight 0.10000E+01 volume 0.77146E-03 ppm1 1.857 ppm2 1.230 CV 1
ASSI { 426}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 20 and name HA ))
3.400 1.400 1.400 peak 426 spectrum 1 weight 0.10000E+01 volume 0.54011E-03 ppm1 4.995 ppm2 4.799 CV 1
ASSI { 436}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HA ))
2.900 1.100 1.100 peak 436 spectrum 1 weight 0.10000E+01 volume 0.21669E-02 ppm1 9.029 ppm2 4.826 CV 1
ASSI { 439}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 30 and name HB2 ))
4.500 2.500 1.500 peak 439 spectrum 1 weight 0.10000E+01 volume 0.42178E-03 ppm1 4.667 ppm2 3.760 CV 1
ASSI { 441}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HA ))
2.700 0.900 0.900 peak 441 spectrum 1 weight 0.10000E+01 volume 0.20334E-02 ppm1 8.851 ppm2 3.664 CV 1
ASSI { 450}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 46 and name HB2 ))
4.000 2.000 2.000 peak 450 spectrum 1 weight 0.10000E+01 volume 0.11942E-02 ppm1 8.195 ppm2 1.736 CV 1
ASSI { 466}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 38 and name HB2 ))
5.900 4.400 0.100 peak 466 spectrum 1 weight 0.10000E+01 volume 0.21327E-03 ppm1 4.653 ppm2 3.062 CV 1
ASSI { 470}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 34 and name HB ))
5.000 3.200 1.000 peak 470 spectrum 1 weight 0.10000E+01 volume 0.46856E-03 ppm1 4.653 ppm2 1.968 CV 1
ASSI { 471}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HA ))
3.100 1.200 1.200 peak 471 spectrum 1 weight 0.10000E+01 volume 0.93310E-03 ppm1 8.209 ppm2 4.621 CV 1
ASSI { 478}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 19 and name HG2 ))
5.200 3.300 0.800 peak 478 spectrum 1 weight 0.10000E+01 volume 0.36633E-03 ppm1 4.653 ppm2 2.228 CV 1
ASSI { 487}
(( segid " " and resid 32 and name HA ))
( segid " " and resid 40 and name HB% )
5.200 3.400 0.800 peak 487 spectrum 1 weight 0.10000E+01 volume 0.33501E-03 ppm1 4.667 ppm2 1.298 CV 1
ASSI { 488}
(( segid " " and resid 25 and name HE1 ))
( segid " " and resid 38 and name HD% )
3.600 1.600 1.600 peak 488 spectrum 1 weight 0.10000E+01 volume 0.98249E-03 ppm1 9.672 ppm2 6.987 CV 1
ASSI { 495}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HB2 ))
3.700 1.700 1.700 peak 495 spectrum 1 weight 0.10000E+01 volume 0.19877E-02 ppm1 8.195 ppm2 1.804 CV 1
ASSI { 505}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HA2 ))
3.800 1.800 1.800 peak 505 spectrum 1 weight 0.10000E+01 volume 0.10113E-02 ppm1 8.544 ppm2 3.883 CV 1
ASSI { 507}
(( segid " " and resid 40 and name HN ))
( segid " " and resid 39 and name HG2%)
4.900 3.000 1.100 peak 507 spectrum 1 weight 0.10000E+01 volume 0.47227E-03 ppm1 7.928 ppm2 0.724 CV 1
ASSI { 518}
(( segid " " and resid 33 and name HD1 ))
(( segid " " and resid 33 and name HB2 ))
3.900 1.900 1.900 peak 518 spectrum 1 weight 0.10000E+01 volume 0.10513E-02 ppm1 7.108 ppm2 2.707 CV 1
ASSI { 554}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HB2 ))
3.000 1.100 1.100 peak 554 spectrum 1 weight 0.10000E+01 volume 0.13458E-02 ppm1 8.393 ppm2 2.721 CV 1
ASSI { 562}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 20 and name HA ))
4.500 2.600 1.500 peak 562 spectrum 1 weight 0.10000E+01 volume 0.62143E-03 ppm1 5.146 ppm2 4.799 CV 1
ASSI { 564}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 5 and name HB ))
4.000 2.000 2.000 peak 564 spectrum 1 weight 0.10000E+01 volume 0.11205E-02 ppm1 3.648 ppm2 1.996 CV 1
ASSI { 565}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HN ))
4.800 2.800 1.200 peak 565 spectrum 1 weight 0.10000E+01 volume 0.11505E-03 ppm1 8.065 ppm2 7.971 CV 1
ASSI { 594}
(( segid " " and resid 25 and name HE1 ))
(( segid " " and resid 31 and name HA ))
2.700 0.900 0.900 peak 594 spectrum 1 weight 0.10000E+01 volume 0.11121E-02 ppm1 9.679 ppm2 4.881 CV 1
ASSI { 615}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HA ))
3.100 1.200 1.200 peak 615 spectrum 1 weight 0.10000E+01 volume 0.10849E-02 ppm1 7.265 ppm2 4.061 CV 1
ASSI { 622}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 33 and name HB2 ))
5.600 3.900 0.400 peak 622 spectrum 1 weight 0.10000E+01 volume 0.29466E-03 ppm1 4.647 ppm2 2.707 CV 1
ASSI { 625}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HB ))
3.800 1.800 1.800 peak 625 spectrum 1 weight 0.10000E+01 volume 0.84126E-03 ppm1 7.238 ppm2 1.873 CV 1
ASSI { 640}
(( segid " " and resid 25 and name HZ2 ))
(( segid " " and resid 33 and name HB2 ))
5.200 3.300 0.800 peak 640 spectrum 1 weight 0.10000E+01 volume 0.47973E-03 ppm1 7.395 ppm2 2.721 CV 1
ASSI { 671}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HA ))
3.400 1.500 1.500 peak 671 spectrum 1 weight 0.10000E+01 volume 0.98725E-03 ppm1 7.675 ppm2 3.965 CV 1
ASSI { 689}
( segid " " and resid 18 and name HB% )
( segid " " and resid 39 and name HG2%)
5.100 3.300 0.900 peak 689 spectrum 1 weight 0.10000E+01 volume 0.10731E-03 ppm1 1.201 ppm2 0.724 CV 1
ASSI { 690}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HA1 ))
3.700 1.700 1.700 peak 690 spectrum 1 weight 0.10000E+01 volume 0.44267E-03 ppm1 8.544 ppm2 3.691 CV 1
ASSI { 715}
(( segid " " and resid 25 and name HH2 ))
( segid " " and resid 18 and name HB% )
5.500 3.700 0.500 peak 715 spectrum 1 weight 0.10000E+01 volume 0.53313E-03 ppm1 6.882 ppm2 1.230 CV 1
ASSI { 733}
(( segid " " and resid 46 and name HB2 ))
( segid " " and resid 39 and name HG2%)
5.300 3.500 0.700 peak 733 spectrum 1 weight 0.10000E+01 volume 0.22878E-03 ppm1 1.720 ppm2 0.724 CV 1
ASSI { 740}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 27 and name HA ))
4.200 2.200 1.800 peak 740 spectrum 1 weight 0.10000E+01 volume 0.77480E-03 ppm1 7.928 ppm2 4.416 CV 1
ASSI { 782}
(( segid " " and resid 17 and name HA1 ))
(( segid " " and resid 17 and name HA2 ))
1.900 0.500 0.500 peak 782 spectrum 1 weight 0.10000E+01 volume 0.71917E-02 ppm1 3.601 ppm2 3.951 CV 1
ASSI { 783}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 25 and name HZ2 ))
2.400 2.400 3.600 peak 783 spectrum 1 weight 0.10000E+01 volume 0.65676E-02 ppm1 6.957 ppm2 7.411 CV 1
ASSI { 805}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 38 and name HB2 ))
3.300 1.400 1.400 peak 805 spectrum 1 weight 0.10000E+01 volume 0.10970E-02 ppm1 2.917 ppm2 3.049 CV 1
ASSI { 811}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 37 and name HA ))
2.500 0.800 0.800 peak 811 spectrum 1 weight 0.10000E+01 volume 0.72070E-02 ppm1 3.812 ppm2 4.170 CV 1
ASSI { 815}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 45 and name HA ))
2.200 0.600 0.600 peak 815 spectrum 1 weight 0.10000E+01 volume 0.69445E-02 ppm1 3.655 ppm2 4.320 CV 1
ASSI { 818}
(( segid " " and resid 13 and name HG1 ))
(( segid " " and resid 13 and name HB ))
1.900 0.400 0.400 peak 818 spectrum 1 weight 0.10000E+01 volume 0.50768E-02 ppm1 1.064 ppm2 4.006 CV 1
ASSI { 823}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 18 and name HA ))
2.000 0.500 0.500 peak 823 spectrum 1 weight 0.10000E+01 volume 0.71966E-02 ppm1 1.249 ppm2 4.457 CV 1
ASSI { 828}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 8 and name HA ))
2.800 1.000 1.000 peak 828 spectrum 1 weight 0.10000E+01 volume 0.90389E-02 ppm1 0.674 ppm2 4.061 CV 1
ASSI { 829}
( segid " " and resid 14 and name HB% )
(( segid " " and resid 14 and name HA ))
2.600 0.800 0.800 peak 829 spectrum 1 weight 0.10000E+01 volume 0.52476E-02 ppm1 1.009 ppm2 4.361 CV 1
ASSI { 844}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HA ))
2.500 0.800 0.800 peak 844 spectrum 1 weight 0.10000E+01 volume 0.61907E-02 ppm1 2.883 ppm2 4.457 CV 1
ASSI { 853}
( segid " " and resid 39 and name HG2%)
(( segid " " and resid 34 and name HB ))
2.500 0.800 0.800 peak 853 spectrum 1 weight 0.10000E+01 volume 0.45159E-02 ppm1 0.715 ppm2 1.968 CV 1
ASSI { 863}
(( segid " " and resid 4 and name HB2 ))
(( segid " " and resid 31 and name HD2 ))
2.500 0.800 0.800 peak 863 spectrum 1 weight 0.10000E+01 volume 0.54994E-02 ppm1 1.871 ppm2 3.527 CV 1
ASSI { 877}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 11 and name HB2 ))
2.500 2.500 3.500 peak 877 spectrum 1 weight 0.10000E+01 volume 0.16808E-02 ppm1 3.436 ppm2 3.787 CV 1
ASSI { 883}
(( segid " " and resid 7 and name HG2 ))
(( segid " " and resid 8 and name HB ))
4.400 2.400 1.600 peak 883 spectrum 1 weight 0.10000E+01 volume 0.20687E-02 ppm1 1.085 ppm2 1.422 CV 1
ASSI { 884}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 5 and name HB ))
3.000 3.000 3.000 peak 884 spectrum 1 weight 0.10000E+01 volume 0.47731E-02 ppm1 0.551 ppm2 1.996 CV 1
ASSI { 885}
(( segid " " and resid 13 and name HG1 ))
( segid " " and resid 18 and name HB% )
3.200 1.300 1.300 peak 885 spectrum 1 weight 0.10000E+01 volume 0.59911E-03 ppm1 1.030 ppm2 1.230 CV 1
ASSI { 890}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 47 and name HA ))
2.900 1.100 1.100 peak 890 spectrum 1 weight 0.10000E+01 volume 0.16745E-02 ppm1 2.684 ppm2 4.238 CV 1
ASSI { 902}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 11 and name HB2 ))
2.900 1.000 1.000 peak 902 spectrum 1 weight 0.10000E+01 volume 0.49343E-02 ppm1 1.966 ppm2 3.773 CV 1
ASSI { 908}
(( segid " " and resid 9 and name HB ))
(( segid " " and resid 9 and name HA ))
2.400 0.700 0.700 peak 908 spectrum 1 weight 0.10000E+01 volume 0.43782E-02 ppm1 1.850 ppm2 4.402 CV 1
ASSI { 927}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 37 and name HB2 ))
4.700 2.700 1.300 peak 927 spectrum 1 weight 0.10000E+01 volume 0.46668E-03 ppm1 2.903 ppm2 3.828 CV 1
ASSI { 963}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 31 and name HA ))
3.300 3.300 2.700 peak 963 spectrum 1 weight 0.10000E+01 volume 0.34027E-02 ppm1 3.450 ppm2 4.908 CV 1
ASSI { 965}
( segid " " and resid 9 and name HG2%)
( segid " " and resid 23 and name HG2%)
3.500 1.500 1.500 peak 965 spectrum 1 weight 0.10000E+01 volume 0.27303E-02 ppm1 0.551 ppm2 0.902 CV 1
ASSI { 972}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 7 and name HA ))
3.700 1.700 1.700 peak 972 spectrum 1 weight 0.10000E+01 volume 0.16685E-02 ppm1 3.628 ppm2 4.279 CV 1
ASSI { 982}
(( segid " " and resid 34 and name HB ))
(( segid " " and resid 34 and name HA ))
2.400 0.700 0.700 peak 982 spectrum 1 weight 0.10000E+01 volume 0.36588E-02 ppm1 1.960 ppm2 4.908 CV 1
ASSI { 994}
(( segid " " and resid 33 and name HD1 ))
(( segid " " and resid 33 and name HN ))
3.600 1.600 1.600 peak 994 spectrum 1 weight 0.10000E+01 volume 0.22069E-02 ppm1 7.108 ppm2 8.409 CV 1
ASSI { 999}
(( segid " " and resid 34 and name HB ))
(( segid " " and resid 38 and name HA ))
2.400 0.700 0.700 peak 999 spectrum 1 weight 0.10000E+01 volume 0.19471E-02 ppm1 1.994 ppm2 4.238 CV 1
ASSI { 1004}
(( segid " " and resid 4 and name HG2 ))
(( segid " " and resid 26 and name HA ))
3.700 3.700 2.300 peak 1004 spectrum 1 weight 0.10000E+01 volume 0.13427E-02 ppm1 2.083 ppm2 4.020 CV 1
ASSI { 1019}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 46 and name HA ))
2.700 0.900 0.900 peak 1019 spectrum 1 weight 0.10000E+01 volume 0.19376E-02 ppm1 1.727 ppm2 4.129 CV 1
ASSI { 1030}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 38 and name HA ))
2.600 0.800 0.800 peak 1030 spectrum 1 weight 0.10000E+01 volume 0.24438E-02 ppm1 3.033 ppm2 4.238 CV 1
ASSI { 1037}
( segid " " and resid 8 and name HG2%)
( segid " " and resid 23 and name HG2%)
5.800 4.200 0.200 peak 1037 spectrum 1 weight 0.10000E+01 volume 0.16630E-03 ppm1 0.709 ppm2 0.902 CV 1
ASSI { 1052}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 30 and name HB2 ))
3.300 1.400 1.400 peak 1052 spectrum 1 weight 0.10000E+01 volume 0.26723E-03 ppm1 3.047 ppm2 3.773 CV 1
ASSI { 1058}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 14 and name HA ))
4.100 2.100 1.900 peak 1058 spectrum 1 weight 0.10000E+01 volume 0.20870E-02 ppm1 1.966 ppm2 4.375 CV 1
ASSI { 1062}
(( segid " " and resid 46 and name HG2 ))
(( segid " " and resid 37 and name HA ))
2.600 2.600 3.400 peak 1062 spectrum 1 weight 0.10000E+01 volume 0.14199E-02 ppm1 2.021 ppm2 4.184 CV 1
ASSI { 1152}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 19 and name HG2 ))
3.000 1.100 1.100 peak 1152 spectrum 1 weight 0.10000E+01 volume 0.21423E-02 ppm1 1.611 ppm2 2.228 CV 1
ASSI { 1160}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 7 and name HG2 ))
5.800 4.200 0.200 peak 1160 spectrum 1 weight 0.10000E+01 volume 0.21227E-03 ppm1 0.729 ppm2 1.080 CV 1
ASSI { 1167}
(( segid " " and resid 25 and name HZ3 ))
(( segid " " and resid 25 and name HZ2 ))
4.200 2.200 1.800 peak 1167 spectrum 1 weight 0.10000E+01 volume 0.76966E-03 ppm1 6.773 ppm2 7.411 CV 1
ASSI { 1202}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 12 and name HA ))
4.400 2.500 1.600 peak 1202 spectrum 1 weight 0.10000E+01 volume 0.17263E-02 ppm1 1.611 ppm2 4.977 CV 1
ASSI { 1212}
(( segid " " and resid 25 and name HD1 ))
(( segid " " and resid 6 and name HD21))
4.700 2.800 1.300 peak 1212 spectrum 1 weight 0.10000E+01 volume 0.32717E-03 ppm1 6.821 ppm2 7.096 CV 1
ASSI { 1220}
(( segid " " and resid 25 and name HH2 ))
(( segid " " and resid 32 and name HN ))
3.700 1.700 1.700 peak 1220 spectrum 1 weight 0.10000E+01 volume 0.10330E-02 ppm1 6.862 ppm2 7.698 CV 1
ASSI { 1225}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 7 and name HA ))
2.600 2.600 3.400 peak 1225 spectrum 1 weight 0.10000E+01 volume 0.12912E-02 ppm1 0.709 ppm2 4.252 CV 1
ASSI { 1235}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 7 and name HG2 ))
3.700 1.700 1.700 peak 1235 spectrum 1 weight 0.10000E+01 volume 0.58483E-03 ppm1 0.579 ppm2 1.093 CV 1
ASSI { 1249}
( segid " " and resid 47 and name HE% )
( segid " " and resid 47 and name HD% )
4.700 2.800 1.300 peak 1249 spectrum 1 weight 0.10000E+01 volume 0.11077E-03 ppm1 6.650 ppm2 7.014 CV 1
ASSI { 1260}
(( segid " " and resid 25 and name HH2 ))
(( segid " " and resid 21 and name HN ))
3.100 1.200 1.200 peak 1260 spectrum 1 weight 0.10000E+01 volume 0.15107E-02 ppm1 6.869 ppm2 9.038 CV 1
ASSI { 1289}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 14 and name HA ))
4.700 2.700 1.300 peak 1289 spectrum 1 weight 0.10000E+01 volume 0.10185E-02 ppm1 1.235 ppm2 4.361 CV 1
ASSI { 1297}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 32 and name HA ))
4.200 2.200 1.800 peak 1297 spectrum 1 weight 0.10000E+01 volume 0.65632E-04 ppm1 4.230 ppm2 4.649 CV 1
ASSI { 1301}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 4 and name HA ))
4.600 2.600 1.400 peak 1301 spectrum 1 weight 0.10000E+01 volume 0.33758E-03 ppm1 2.630 ppm2 4.361 CV 1
ASSI { 1305}
(( segid " " and resid 7 and name HG2 ))
(( segid " " and resid 7 and name HA ))
3.900 1.900 1.900 peak 1305 spectrum 1 weight 0.10000E+01 volume 0.13143E-02 ppm1 1.057 ppm2 4.266 CV 1
ASSI { 36}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HA1 ))
2.300 0.700 0.700 peak 36 spectrum 1 weight 0.10000E+01 volume 0.73793E-02 ppm1 7.798 ppm2 3.716 CV 1
ASSI { 84}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HA ))
3.400 1.400 1.400 peak 84 spectrum 1 weight 0.10000E+01 volume 0.31799E-02 ppm1 8.109 ppm2 4.349 CV 1
ASSI { 86}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 18 and name HN ))
3.300 1.300 1.300 peak 86 spectrum 1 weight 0.10000E+01 volume 0.74002E-03 ppm1 8.109 ppm2 7.583 CV 1
ASSI { 89}
(( segid " " and resid 15 and name HN ))
( segid " " and resid 14 and name HB% )
2.300 0.700 0.700 peak 89 spectrum 1 weight 0.10000E+01 volume 0.60904E-02 ppm1 8.109 ppm2 1.021 CV 1
ASSI { 94}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 16 and name HN ))
3.000 1.100 1.100 peak 94 spectrum 1 weight 0.10000E+01 volume 0.16605E-02 ppm1 8.109 ppm2 8.544 CV 1
ASSI { 95}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HN ))
2.400 0.700 0.700 peak 95 spectrum 1 weight 0.10000E+01 volume 0.26116E-02 ppm1 8.109 ppm2 8.403 CV 1
ASSI { 109}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 10 and name HA1 ))
3.000 1.200 1.200 peak 109 spectrum 1 weight 0.10000E+01 volume 0.14911E-02 ppm1 7.305 ppm2 4.091 CV 1
ASSI { 115}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 10 and name HA2 ))
3.600 1.600 1.600 peak 115 spectrum 1 weight 0.10000E+01 volume 0.12428E-02 ppm1 7.305 ppm2 3.763 CV 1
ASSI { 116}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 9 and name HN ))
3.600 1.600 1.600 peak 116 spectrum 1 weight 0.10000E+01 volume 0.21044E-02 ppm1 7.305 ppm2 8.849 CV 1
ASSI { 121}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 22 and name HN ))
3.600 1.600 1.600 peak 121 spectrum 1 weight 0.10000E+01 volume 0.86558E-03 ppm1 7.305 ppm2 7.677 CV 1
ASSI { 122}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 18 and name HN ))
2.300 0.700 0.700 peak 122 spectrum 1 weight 0.10000E+01 volume 0.46103E-02 ppm1 8.332 ppm2 7.583 CV 1
ASSI { 124}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 18 and name HB% )
4.600 2.600 1.400 peak 124 spectrum 1 weight 0.10000E+01 volume 0.10916E-02 ppm1 8.332 ppm2 1.232 CV 1
ASSI { 128}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HA1 ))
2.300 0.700 0.700 peak 128 spectrum 1 weight 0.10000E+01 volume 0.73180E-02 ppm1 8.332 ppm2 3.575 CV 1
ASSI { 130}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HA2 ))
2.500 0.800 0.800 peak 130 spectrum 1 weight 0.10000E+01 volume 0.10504E-01 ppm1 8.332 ppm2 3.974 CV 1
ASSI { 132}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HN ))
3.000 1.100 1.100 peak 132 spectrum 1 weight 0.10000E+01 volume 0.17839E-02 ppm1 8.332 ppm2 8.544 CV 1
ASSI { 160}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 3 and name HA2 ))
2.800 1.000 1.000 peak 160 spectrum 1 weight 0.10000E+01 volume 0.33216E-02 ppm1 8.579 ppm2 3.857 CV 1
ASSI { 167}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 4 and name HN ))
4.600 2.700 1.400 peak 167 spectrum 1 weight 0.10000E+01 volume 0.10926E-02 ppm1 8.579 ppm2 8.263 CV 1
ASSI { 230}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HA2 ))
2.600 0.900 0.900 peak 230 spectrum 1 weight 0.10000E+01 volume 0.37525E-02 ppm1 8.573 ppm2 3.763 CV 1
ASSI { 232}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HA1 ))
3.200 1.300 1.300 peak 232 spectrum 1 weight 0.10000E+01 volume 0.39052E-02 ppm1 8.573 ppm2 4.114 CV 1
ASSI { 258}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HN ))
3.700 1.700 1.700 peak 258 spectrum 1 weight 0.10000E+01 volume 0.91380E-03 ppm1 8.232 ppm2 8.872 CV 1
ASSI { 265}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HB2 ))
2.600 0.800 0.800 peak 265 spectrum 1 weight 0.10000E+01 volume 0.40447E-02 ppm1 7.986 ppm2 3.833 CV 1
ASSI { 269}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 36 and name HN ))
3.000 1.100 1.100 peak 269 spectrum 1 weight 0.10000E+01 volume 0.19160E-02 ppm1 7.986 ppm2 8.286 CV 1
ASSI { 279}
(( segid " " and resid 6 and name HD22))
(( segid " " and resid 6 and name HB2 ))
4.400 2.500 1.600 peak 279 spectrum 1 weight 0.10000E+01 volume 0.95166E-03 ppm1 7.845 ppm2 2.193 CV 1
ASSI { 283}
(( segid " " and resid 6 and name HD22))
(( segid " " and resid 6 and name HD21))
2.100 0.500 0.500 peak 283 spectrum 1 weight 0.10000E+01 volume 0.44387E-02 ppm1 7.845 ppm2 7.068 CV 1
ASSI { 302}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 21 and name HD% )
3.500 1.500 1.500 peak 302 spectrum 1 weight 0.10000E+01 volume 0.79259E-03 ppm1 7.710 ppm2 6.974 CV 1
ASSI { 305}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 23 and name HN ))
3.100 3.100 2.900 peak 305 spectrum 1 weight 0.10000E+01 volume 0.18617E-02 ppm1 7.710 ppm2 8.122 CV 1
ASSI { 312}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 38 and name HE% )
3.500 3.500 2.500 peak 312 spectrum 1 weight 0.10000E+01 volume 0.15717E-02 ppm1 7.710 ppm2 6.763 CV 1
ASSI { 315}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 23 and name HG2%)
2.700 2.700 3.300 peak 315 spectrum 1 weight 0.10000E+01 volume 0.10251E-02 ppm1 7.710 ppm2 0.880 CV 1
ASSI { 316}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 25 and name HE1 ))
3.500 1.600 1.600 peak 316 spectrum 1 weight 0.10000E+01 volume 0.22110E-02 ppm1 7.710 ppm2 9.646 CV 1
ASSI { 333}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 25 and name HH2 ))
4.300 2.300 1.700 peak 333 spectrum 1 weight 0.10000E+01 volume 0.73009E-03 ppm1 8.309 ppm2 6.880 CV 1
ASSI { 334}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 6 and name HA ))
2.200 2.200 3.800 peak 334 spectrum 1 weight 0.10000E+01 volume 0.32022E-02 ppm1 8.309 ppm2 3.669 CV 1
ASSI { 384}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 43 and name HN ))
3.300 1.400 1.400 peak 384 spectrum 1 weight 0.10000E+01 volume 0.10804E-02 ppm1 8.168 ppm2 7.677 CV 1
ASSI { 396}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 12 and name HB2 ))
3.500 1.500 1.500 peak 396 spectrum 1 weight 0.10000E+01 volume 0.94925E-03 ppm1 8.890 ppm2 1.794 CV 1
ASSI { 400}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 19 and name HA ))
4.400 2.400 1.600 peak 400 spectrum 1 weight 0.10000E+01 volume 0.81714E-03 ppm1 8.890 ppm2 4.958 CV 1
ASSI { 403}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 21 and name HA ))
4.000 2.000 2.000 peak 403 spectrum 1 weight 0.10000E+01 volume 0.90542E-03 ppm1 8.890 ppm2 5.193 CV 1
ASSI { 413}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HA ))
2.300 0.600 0.600 peak 413 spectrum 1 weight 0.10000E+01 volume 0.64389E-02 ppm1 8.473 ppm2 4.443 CV 1
ASSI { 414}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HB2 ))
4.200 2.200 1.800 peak 414 spectrum 1 weight 0.10000E+01 volume 0.18571E-02 ppm1 8.473 ppm2 2.872 CV 1
ASSI { 416}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HA ))
2.700 0.900 0.900 peak 416 spectrum 1 weight 0.10000E+01 volume 0.19348E-02 ppm1 8.473 ppm2 3.857 CV 1
ASSI { 419}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 38 and name HD% )
3.900 1.900 1.900 peak 419 spectrum 1 weight 0.10000E+01 volume 0.79093E-03 ppm1 8.473 ppm2 6.997 CV 1
ASSI { 429}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HN ))
3.400 1.400 1.400 peak 429 spectrum 1 weight 0.10000E+01 volume 0.27626E-02 ppm1 8.180 ppm2 8.005 CV 1
ASSI { 436}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HB ))
3.200 1.300 1.300 peak 436 spectrum 1 weight 0.10000E+01 volume 0.17699E-02 ppm1 8.186 ppm2 1.911 CV 1
ASSI { 437}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HB2 ))
3.000 1.200 1.200 peak 437 spectrum 1 weight 0.10000E+01 volume 0.32296E-02 ppm1 8.186 ppm2 3.646 CV 1
ASSI { 438}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HA ))
2.200 0.600 0.600 peak 438 spectrum 1 weight 0.10000E+01 volume 0.65866E-02 ppm1 8.186 ppm2 3.927 CV 1
ASSI { 449}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 3 and name HA2 ))
2.700 0.900 0.900 peak 449 spectrum 1 weight 0.10000E+01 volume 0.44158E-02 ppm1 8.285 ppm2 3.857 CV 1
ASSI { 451}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HA1 ))
2.800 1.000 1.000 peak 451 spectrum 1 weight 0.10000E+01 volume 0.19601E-02 ppm1 7.921 ppm2 3.716 CV 1
ASSI { 458}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HA ))
2.800 1.000 1.000 peak 458 spectrum 1 weight 0.10000E+01 volume 0.33026E-02 ppm1 7.921 ppm2 4.443 CV 1
ASSI { 459}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HB2 ))
2.500 0.800 0.800 peak 459 spectrum 1 weight 0.10000E+01 volume 0.44785E-02 ppm1 7.921 ppm2 2.872 CV 1
ASSI { 470}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 25 and name HZ2 ))
3.800 3.800 2.200 peak 470 spectrum 1 weight 0.10000E+01 volume 0.74174E-03 ppm1 8.285 ppm2 7.396 CV 1
ASSI { 486}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HB ))
3.600 1.600 1.600 peak 486 spectrum 1 weight 0.10000E+01 volume 0.13385E-02 ppm1 7.699 ppm2 1.935 CV 1
ASSI { 494}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 44 and name HN ))
4.100 2.100 1.900 peak 494 spectrum 1 weight 0.10000E+01 volume 0.84125E-03 ppm1 7.699 ppm2 7.982 CV 1
ASSI { 526}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 19 and name HA ))
2.500 0.800 0.800 peak 526 spectrum 1 weight 0.10000E+01 volume 0.26199E-02 ppm1 8.461 ppm2 4.958 CV 1
ASSI { 529}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HN ))
4.000 2.000 2.000 peak 529 spectrum 1 weight 0.10000E+01 volume 0.82380E-03 ppm1 8.467 ppm2 7.560 CV 1
ASSI { 536}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HA ))
2.000 0.500 0.500 peak 536 spectrum 1 weight 0.10000E+01 volume 0.99999E-02 ppm1 8.461 ppm2 4.443 CV 1
ASSI { 538}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 19 and name HG2 ))
3.900 1.900 1.900 peak 538 spectrum 1 weight 0.10000E+01 volume 0.14426E-02 ppm1 8.461 ppm2 2.216 CV 1
ASSI { 558}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 8 and name HA ))
2.500 0.800 0.800 peak 558 spectrum 1 weight 0.10000E+01 volume 0.29931E-02 ppm1 8.860 ppm2 4.044 CV 1
ASSI { 607}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 4 and name HA ))
3.200 1.300 1.300 peak 607 spectrum 1 weight 0.10000E+01 volume 0.17769E-02 ppm1 8.221 ppm2 4.372 CV 1
ASSI { 618}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HB2 ))
2.500 2.500 3.500 peak 618 spectrum 1 weight 0.10000E+01 volume 0.46086E-02 ppm1 8.045 ppm2 3.060 CV 1
ASSI { 621}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 39 and name HN ))
3.200 1.300 1.300 peak 621 spectrum 1 weight 0.10000E+01 volume 0.23415E-02 ppm1 8.045 ppm2 7.232 CV 1
ASSI { 626}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 34 and name HB ))
3.200 1.300 1.300 peak 626 spectrum 1 weight 0.10000E+01 volume 0.17737E-02 ppm1 8.051 ppm2 1.958 CV 1
ASSI { 639}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 47 and name HN ))
3.200 1.300 1.300 peak 639 spectrum 1 weight 0.10000E+01 volume 0.31271E-02 ppm1 8.115 ppm2 7.513 CV 1
ASSI { 649}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HB2 ))
3.600 1.600 1.600 peak 649 spectrum 1 weight 0.10000E+01 volume 0.12709E-02 ppm1 8.121 ppm2 3.646 CV 1
ASSI { 681}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 18 and name HB% )
2.300 0.700 0.700 peak 681 spectrum 1 weight 0.10000E+01 volume 0.92025E-02 ppm1 7.599 ppm2 1.255 CV 1
ASSI { 682}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 18 and name HA ))
2.600 0.900 0.900 peak 682 spectrum 1 weight 0.10000E+01 volume 0.28136E-02 ppm1 7.593 ppm2 4.443 CV 1
ASSI { 684}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HA1 ))
3.200 1.300 1.300 peak 684 spectrum 1 weight 0.10000E+01 volume 0.17018E-02 ppm1 7.593 ppm2 3.575 CV 1
ASSI { 685}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 13 and name HG1 ))
4.000 2.000 2.000 peak 685 spectrum 1 weight 0.10000E+01 volume 0.12595E-02 ppm1 7.593 ppm2 1.044 CV 1
ASSI { 687}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HB ))
3.200 1.300 1.300 peak 687 spectrum 1 weight 0.10000E+01 volume 0.25332E-02 ppm1 7.992 ppm2 1.911 CV 1
ASSI { 711}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 7 and name HN ))
3.700 1.700 1.700 peak 711 spectrum 1 weight 0.10000E+01 volume 0.84485E-03 ppm1 8.860 ppm2 7.536 CV 1
ASSI { 717}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HB2 ))
3.600 1.700 1.700 peak 717 spectrum 1 weight 0.10000E+01 volume 0.92358E-03 ppm1 8.860 ppm2 2.193 CV 1
ASSI { 726}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 26 and name HB2 ))
3.500 1.600 1.600 peak 726 spectrum 1 weight 0.10000E+01 volume 0.98512E-03 ppm1 9.036 ppm2 1.677 CV 1
ASSI { 756}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HB2 ))
2.800 1.000 1.000 peak 756 spectrum 1 weight 0.10000E+01 volume 0.31739E-02 ppm1 7.517 ppm2 2.685 CV 1
ASSI { 791}
(( segid " " and resid 40 and name HN ))
( segid " " and resid 41 and name HB% )
3.900 1.900 1.900 peak 791 spectrum 1 weight 0.10000E+01 volume 0.98098E-03 ppm1 7.916 ppm2 1.279 CV 1
ASSI { 792}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HA ))
3.300 1.400 1.400 peak 792 spectrum 1 weight 0.10000E+01 volume 0.79823E-03 ppm1 7.921 ppm2 4.068 CV 1
ASSI { 803}
(( segid " " and resid 23 and name HN ))
( segid " " and resid 23 and name HG2%)
3.100 1.200 1.200 peak 803 spectrum 1 weight 0.10000E+01 volume 0.23576E-02 ppm1 8.133 ppm2 0.880 CV 1
ASSI { 825}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HB2 ))
3.800 1.800 1.800 peak 825 spectrum 1 weight 0.10000E+01 volume 0.93163E-03 ppm1 7.699 ppm2 2.286 CV 1
ASSI { 838}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 12 and name HN ))
4.400 2.500 1.600 peak 838 spectrum 1 weight 0.10000E+01 volume 0.86724E-03 ppm1 7.699 ppm2 8.872 CV 1
ASSI { 839}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HA ))
2.600 0.800 0.800 peak 839 spectrum 1 weight 0.10000E+01 volume 0.36215E-02 ppm1 7.699 ppm2 5.193 CV 1
ASSI { 840}
(( segid " " and resid 22 and name HN ))
( segid " " and resid 22 and name HD2%)
3.500 1.600 1.600 peak 840 spectrum 1 weight 0.10000E+01 volume 0.24170E-02 ppm1 7.699 ppm2 0.435 CV 1
OR { 840}
(( segid " " and resid 22 and name HN ))
( segid " " and resid 22 and name HD1%)
ASSI { 870}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 19 and name HA ))
2.100 0.500 0.500 peak 870 spectrum 1 weight 0.10000E+01 volume 0.37441E-02 ppm1 8.420 ppm2 4.958 CV 1
ASSI { 871}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 18 and name HB% )
3.700 1.800 1.800 peak 871 spectrum 1 weight 0.10000E+01 volume 0.15262E-02 ppm1 8.420 ppm2 1.232 CV 1
ASSI { 881}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HA ))
2.700 0.900 0.900 peak 881 spectrum 1 weight 0.10000E+01 volume 0.25087E-02 ppm1 8.420 ppm2 4.349 CV 1
ASSI { 887}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 14 and name HB% )
2.400 0.700 0.700 peak 887 spectrum 1 weight 0.10000E+01 volume 0.76220E-02 ppm1 8.420 ppm2 1.021 CV 1
ASSI { 888}
(( segid " " and resid 25 and name HE1 ))
( segid " " and resid 38 and name HE% )
2.900 2.900 3.100 peak 888 spectrum 1 weight 0.10000E+01 volume 0.37919E-02 ppm1 9.658 ppm2 6.763 CV 1
ASSI { 909}
(( segid " " and resid 33 and name HE1 ))
(( segid " " and resid 11 and name HA ))
2.500 2.500 3.500 peak 909 spectrum 1 weight 0.10000E+01 volume 0.15584E-02 ppm1 9.928 ppm2 5.661 CV 1
ASSI { 912}
(( segid " " and resid 33 and name HE1 ))
(( segid " " and resid 33 and name HZ2 ))
2.700 0.900 0.900 peak 912 spectrum 1 weight 0.10000E+01 volume 0.61366E-02 ppm1 9.928 ppm2 7.232 CV 1
ASSI { 6}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 25 and name HZ3 ))
2.300 2.300 3.700 peak 6 spectrum 1 weight 0.10000E+01 volume 0.15351E-01 ppm1 6.971 ppm2 6.782 CV 1
ASSI { 14}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 47 and name HB2 ))
2.400 2.400 3.600 peak 14 spectrum 1 weight 0.10000E+01 volume 0.95193E-02 ppm1 2.883 ppm2 2.693 CV 1
ASSI { 23}
(( segid " " and resid 3 and name HA2 ))
(( segid " " and resid 5 and name HA ))
2.800 2.800 3.200 peak 23 spectrum 1 weight 0.10000E+01 volume 0.89962E-02 ppm1 3.860 ppm2 3.691 CV 1
ASSI { 31}
(( segid " " and resid 33 and name HE1 ))
(( segid " " and resid 33 and name HD1 ))
2.700 0.900 0.900 peak 31 spectrum 1 weight 0.10000E+01 volume 0.35298E-02 ppm1 9.925 ppm2 7.124 CV 1
ASSI { 45}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HB2 ))
3.200 1.300 1.300 peak 45 spectrum 1 weight 0.10000E+01 volume 0.77332E-03 ppm1 3.860 ppm2 3.760 CV 1
ASSI { 63}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 23 and name HA ))
2.200 0.600 0.600 peak 63 spectrum 1 weight 0.10000E+01 volume 0.54379E-02 ppm1 8.086 ppm2 3.979 CV 1
ASSI { 68}
(( segid " " and resid 33 and name HZ2 ))
(( segid " " and resid 33 and name HH2 ))
2.700 0.900 0.900 peak 68 spectrum 1 weight 0.10000E+01 volume 0.31272E-02 ppm1 7.231 ppm2 6.713 CV 1
ASSI { 69}
( segid " " and resid 40 and name HB% )
( segid " " and resid 39 and name HG2%)
3.300 3.300 2.700 peak 69 spectrum 1 weight 0.10000E+01 volume 0.40358E-02 ppm1 1.290 ppm2 0.697 CV 1
ASSI { 80}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 45 and name HB2 ))
3.300 3.300 2.700 peak 80 spectrum 1 weight 0.10000E+01 volume 0.33083E-02 ppm1 3.936 ppm2 3.623 CV 1
ASSI { 83}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 46 and name HA ))
2.200 0.600 0.600 peak 83 spectrum 1 weight 0.10000E+01 volume 0.33060E-02 ppm1 8.072 ppm2 4.115 CV 1
ASSI { 84}
(( segid " " and resid 15 and name HN ))
( segid " " and resid 18 and name HB% )
3.000 1.100 1.100 peak 84 spectrum 1 weight 0.10000E+01 volume 0.34393E-02 ppm1 8.086 ppm2 1.257 CV 1
ASSI { 91}
( segid " " and resid 38 and name HD% )
( segid " " and resid 39 and name HG2%)
3.300 3.300 2.700 peak 91 spectrum 1 weight 0.10000E+01 volume 0.32610E-02 ppm1 6.978 ppm2 0.724 CV 1
ASSI { 120}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HA ))
2.500 0.800 0.800 peak 120 spectrum 1 weight 0.10000E+01 volume 0.42457E-02 ppm1 7.792 ppm2 4.430 CV 1
ASSI { 131}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 36 and name HA ))
2.400 0.700 0.700 peak 131 spectrum 1 weight 0.10000E+01 volume 0.59008E-02 ppm1 8.284 ppm2 4.006 CV 1
ASSI { 143}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 35 and name HG2 ))
2.200 2.200 3.800 peak 143 spectrum 1 weight 0.10000E+01 volume 0.22687E-02 ppm1 1.734 ppm2 1.449 CV 1
ASSI { 176}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 45 and name HB2 ))
5.200 3.400 0.800 peak 176 spectrum 1 weight 0.10000E+01 volume 0.11830E-03 ppm1 3.751 ppm2 3.650 CV 1
ASSI { 177}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HB ))
2.000 0.500 0.500 peak 177 spectrum 1 weight 0.10000E+01 volume 0.21132E-02 ppm1 8.400 ppm2 4.006 CV 1
ASSI { 188}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 46 and name HA ))
2.300 0.700 0.700 peak 188 spectrum 1 weight 0.10000E+01 volume 0.15851E-02 ppm1 7.504 ppm2 4.129 CV 1
ASSI { 190}
(( segid " " and resid 25 and name HZ3 ))
( segid " " and resid 39 and name HG2%)
3.800 3.800 2.200 peak 190 spectrum 1 weight 0.10000E+01 volume 0.11124E-02 ppm1 6.773 ppm2 0.724 CV 1
ASSI { 213}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HA ))
2.300 0.700 0.700 peak 213 spectrum 1 weight 0.10000E+01 volume 0.25283E-02 ppm1 7.709 ppm2 4.895 CV 1
ASSI { 221}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 40 and name HB% )
4.100 2.100 1.900 peak 221 spectrum 1 weight 0.10000E+01 volume 0.15806E-02 ppm1 8.092 ppm2 1.312 CV 1
ASSI { 236}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HA ))
2.300 0.700 0.700 peak 236 spectrum 1 weight 0.10000E+01 volume 0.27549E-02 ppm1 8.113 ppm2 3.432 CV 1
ASSI { 248}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HA ))
3.000 1.100 1.100 peak 248 spectrum 1 weight 0.10000E+01 volume 0.15438E-02 ppm1 8.154 ppm2 4.416 CV 1
ASSI { 262}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HA1 ))
2.800 1.000 1.000 peak 262 spectrum 1 weight 0.10000E+01 volume 0.20543E-02 ppm1 8.086 ppm2 3.678 CV 1
ASSI { 266}
(( segid " " and resid 7 and name HG2 ))
( segid " " and resid 23 and name HG2%)
3.800 1.800 1.800 peak 266 spectrum 1 weight 0.10000E+01 volume 0.26586E-03 ppm1 1.078 ppm2 0.902 CV 1
ASSI { 280}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HA2 ))
2.900 1.100 1.100 peak 280 spectrum 1 weight 0.10000E+01 volume 0.95048E-03 ppm1 8.092 ppm2 3.869 CV 1
ASSI { 309}
(( segid " " and resid 44 and name HA ))
( segid " " and resid 39 and name HG2%)
3.300 1.300 1.300 peak 309 spectrum 1 weight 0.10000E+01 volume 0.12056E-02 ppm1 3.942 ppm2 0.724 CV 1
ASSI { 311}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HB2 ))
3.400 1.400 1.400 peak 311 spectrum 1 weight 0.10000E+01 volume 0.14637E-02 ppm1 8.147 ppm2 2.529 CV 1
ASSI { 319}
( segid " " and resid 23 and name HG2%)
( segid " " and resid 8 and name HG2%)
3.900 1.900 1.900 peak 319 spectrum 1 weight 0.10000E+01 volume 0.71349E-04 ppm1 0.873 ppm2 0.697 CV 1
ASSI { 324}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 34 and name HB ))
3.500 1.500 1.500 peak 324 spectrum 1 weight 0.10000E+01 volume 0.17379E-02 ppm1 6.978 ppm2 1.968 CV 1
ASSI { 342}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 39 and name HB ))
3.400 3.400 2.600 peak 342 spectrum 1 weight 0.10000E+01 volume 0.26543E-02 ppm1 4.018 ppm2 1.873 CV 1
ASSI { 370}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HN ))
4.800 2.900 1.200 peak 370 spectrum 1 weight 0.10000E+01 volume 0.14765E-03 ppm1 7.901 ppm2 7.807 CV 1
ASSI { 371}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HD1 ))
4.600 2.700 1.400 peak 371 spectrum 1 weight 0.10000E+01 volume 0.59529E-03 ppm1 8.393 ppm2 7.124 CV 1
ASSI { 407}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HA ))
3.000 1.100 1.100 peak 407 spectrum 1 weight 0.10000E+01 volume 0.10881E-02 ppm1 7.511 ppm2 4.238 CV 1
ASSI { 411}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 11 and name HA ))
2.600 0.800 0.800 peak 411 spectrum 1 weight 0.10000E+01 volume 0.13722E-02 ppm1 8.879 ppm2 5.647 CV 1
ASSI { 415}
(( segid " " and resid 19 and name HB2 ))
( segid " " and resid 14 and name HB% )
2.500 2.500 3.500 peak 415 spectrum 1 weight 0.10000E+01 volume 0.11316E-02 ppm1 1.631 ppm2 1.025 CV 1
ASSI { 426}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 20 and name HA ))
3.700 1.700 1.700 peak 426 spectrum 1 weight 0.10000E+01 volume 0.39185E-03 ppm1 4.995 ppm2 4.799 CV 1
ASSI { 436}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HA ))
2.800 1.000 1.000 peak 436 spectrum 1 weight 0.10000E+01 volume 0.15720E-02 ppm1 9.029 ppm2 4.826 CV 1
ASSI { 439}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 30 and name HB2 ))
4.400 2.500 1.600 peak 439 spectrum 1 weight 0.10000E+01 volume 0.30600E-03 ppm1 4.667 ppm2 3.760 CV 1
ASSI { 441}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HA ))
3.000 1.100 1.100 peak 441 spectrum 1 weight 0.10000E+01 volume 0.14752E-02 ppm1 8.851 ppm2 3.664 CV 1
ASSI { 445}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 29 and name HB2 ))
3.400 1.500 1.500 peak 445 spectrum 1 weight 0.10000E+01 volume 0.13758E-02 ppm1 7.880 ppm2 2.898 CV 1
ASSI { 447}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 20 and name HA ))
2.900 2.900 3.100 peak 447 spectrum 1 weight 0.10000E+01 volume 0.44139E-03 ppm1 8.284 ppm2 4.826 CV 1
ASSI { 470}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 34 and name HB ))
4.400 2.400 1.600 peak 470 spectrum 1 weight 0.10000E+01 volume 0.33994E-03 ppm1 4.653 ppm2 1.968 CV 1
ASSI { 471}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HA ))
3.200 1.300 1.300 peak 471 spectrum 1 weight 0.10000E+01 volume 0.67697E-03 ppm1 8.209 ppm2 4.621 CV 1
ASSI { 478}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 19 and name HG2 ))
5.000 3.100 1.000 peak 478 spectrum 1 weight 0.10000E+01 volume 0.26577E-03 ppm1 4.653 ppm2 2.228 CV 1
ASSI { 486}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 19 and name HB2 ))
3.300 1.400 1.400 peak 486 spectrum 1 weight 0.10000E+01 volume 0.65871E-03 ppm1 2.219 ppm2 1.627 CV 1
ASSI { 487}
(( segid " " and resid 32 and name HA ))
( segid " " and resid 40 and name HB% )
4.600 2.600 1.400 peak 487 spectrum 1 weight 0.10000E+01 volume 0.24305E-03 ppm1 4.667 ppm2 1.298 CV 1
ASSI { 494}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 25 and name HH2 ))
3.800 1.800 1.800 peak 494 spectrum 1 weight 0.10000E+01 volume 0.55985E-03 ppm1 7.682 ppm2 6.891 CV 1
ASSI { 505}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HA2 ))
3.900 1.900 1.900 peak 505 spectrum 1 weight 0.10000E+01 volume 0.73363E-03 ppm1 8.544 ppm2 3.883 CV 1
ASSI { 554}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HB2 ))
3.000 1.100 1.100 peak 554 spectrum 1 weight 0.10000E+01 volume 0.97642E-03 ppm1 8.393 ppm2 2.721 CV 1
ASSI { 564}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 5 and name HB ))
3.600 1.600 1.600 peak 564 spectrum 1 weight 0.10000E+01 volume 0.81295E-03 ppm1 3.648 ppm2 1.996 CV 1
ASSI { 565}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HN ))
4.500 2.500 1.500 peak 565 spectrum 1 weight 0.10000E+01 volume 0.83464E-04 ppm1 8.065 ppm2 7.971 CV 1
ASSI { 573}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 13 and name HA ))
5.100 3.200 0.900 peak 573 spectrum 1 weight 0.10000E+01 volume 0.18749E-03 ppm1 4.968 ppm2 4.621 CV 1
ASSI { 610}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 46 and name HG2 ))
4.400 2.400 1.600 peak 610 spectrum 1 weight 0.10000E+01 volume 0.72600E-03 ppm1 8.065 ppm2 2.037 CV 1
ASSI { 622}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 33 and name HB2 ))
5.500 3.800 0.500 peak 622 spectrum 1 weight 0.10000E+01 volume 0.21377E-03 ppm1 4.647 ppm2 2.707 CV 1
ASSI { 625}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HB ))
3.700 1.700 1.700 peak 625 spectrum 1 weight 0.10000E+01 volume 0.61033E-03 ppm1 7.238 ppm2 1.873 CV 1
ASSI { 628}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 19 and name HB2 ))
3.400 1.500 1.500 peak 628 spectrum 1 weight 0.10000E+01 volume 0.79501E-03 ppm1 8.434 ppm2 1.640 CV 1
ASSI { 662}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 6 and name HB2 ))
3.800 1.800 1.800 peak 662 spectrum 1 weight 0.10000E+01 volume 0.80634E-03 ppm1 4.004 ppm2 2.201 CV 1
ASSI { 690}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HA1 ))
3.600 1.600 1.600 peak 690 spectrum 1 weight 0.10000E+01 volume 0.32116E-03 ppm1 8.544 ppm2 3.691 CV 1
ASSI { 750}
( segid " " and resid 38 and name HE% )
( segid " " and resid 38 and name HD% )
1.900 0.400 0.400 peak 750 spectrum 1 weight 0.10000E+01 volume 0.15074E-01 ppm1 6.780 ppm2 7.000 CV 1
ASSI { 753}
( segid " " and resid 21 and name HE% )
( segid " " and resid 21 and name HD% )
2.300 0.600 0.600 peak 753 spectrum 1 weight 0.10000E+01 volume 0.56511E-02 ppm1 6.691 ppm2 6.973 CV 1
ASSI { 760}
(( segid " " and resid 15 and name HA1 ))
(( segid " " and resid 15 and name HA2 ))
1.500 0.300 0.700 peak 760 spectrum 1 weight 0.10000E+01 volume 0.14356E-01 ppm1 3.676 ppm2 3.869 CV 1
ASSI { 783}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 25 and name HZ2 ))
2.600 2.600 3.400 peak 783 spectrum 1 weight 0.10000E+01 volume 0.47647E-02 ppm1 6.957 ppm2 7.411 CV 1
ASSI { 818}
(( segid " " and resid 13 and name HG1 ))
(( segid " " and resid 13 and name HB ))
2.000 0.500 0.500 peak 818 spectrum 1 weight 0.10000E+01 volume 0.36832E-02 ppm1 1.064 ppm2 4.006 CV 1
ASSI { 823}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 18 and name HA ))
2.200 0.600 0.600 peak 823 spectrum 1 weight 0.10000E+01 volume 0.52212E-02 ppm1 1.249 ppm2 4.457 CV 1
ASSI { 828}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 8 and name HA ))
2.600 0.900 0.900 peak 828 spectrum 1 weight 0.10000E+01 volume 0.65576E-02 ppm1 0.674 ppm2 4.061 CV 1
ASSI { 829}
( segid " " and resid 14 and name HB% )
(( segid " " and resid 14 and name HA ))
2.500 0.800 0.800 peak 829 spectrum 1 weight 0.10000E+01 volume 0.38071E-02 ppm1 1.009 ppm2 4.361 CV 1
ASSI { 844}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HA ))
2.600 0.800 0.800 peak 844 spectrum 1 weight 0.10000E+01 volume 0.44912E-02 ppm1 2.883 ppm2 4.457 CV 1
ASSI { 853}
( segid " " and resid 39 and name HG2%)
(( segid " " and resid 34 and name HB ))
2.300 0.600 0.600 peak 853 spectrum 1 weight 0.10000E+01 volume 0.32762E-02 ppm1 0.715 ppm2 1.968 CV 1
ASSI { 876}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 26 and name HA ))
2.600 0.800 0.800 peak 876 spectrum 1 weight 0.10000E+01 volume 0.29643E-02 ppm1 1.679 ppm2 4.006 CV 1
ASSI { 877}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 11 and name HB2 ))
2.400 2.400 3.600 peak 877 spectrum 1 weight 0.10000E+01 volume 0.12194E-02 ppm1 3.436 ppm2 3.787 CV 1
ASSI { 883}
(( segid " " and resid 7 and name HG2 ))
(( segid " " and resid 8 and name HB ))
4.000 2.000 2.000 peak 883 spectrum 1 weight 0.10000E+01 volume 0.15008E-02 ppm1 1.085 ppm2 1.422 CV 1
ASSI { 884}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 5 and name HB ))
2.000 2.000 4.000 peak 884 spectrum 1 weight 0.10000E+01 volume 0.34628E-02 ppm1 0.551 ppm2 1.996 CV 1
ASSI { 890}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 47 and name HA ))
2.900 1.000 1.000 peak 890 spectrum 1 weight 0.10000E+01 volume 0.12148E-02 ppm1 2.684 ppm2 4.238 CV 1
ASSI { 953}
(( segid " " and resid 9 and name HB ))
(( segid " " and resid 23 and name HA ))
3.300 3.300 2.700 peak 953 spectrum 1 weight 0.10000E+01 volume 0.14134E-02 ppm1 1.864 ppm2 4.006 CV 1
ASSI { 965}
( segid " " and resid 9 and name HG2%)
( segid " " and resid 23 and name HG2%)
3.000 1.100 1.100 peak 965 spectrum 1 weight 0.10000E+01 volume 0.19808E-02 ppm1 0.551 ppm2 0.902 CV 1
ASSI { 982}
(( segid " " and resid 34 and name HB ))
(( segid " " and resid 34 and name HA ))
2.400 0.700 0.700 peak 982 spectrum 1 weight 0.10000E+01 volume 0.26544E-02 ppm1 1.960 ppm2 4.908 CV 1
ASSI { 1016}
(( segid " " and resid 13 and name HG1 ))
(( segid " " and resid 19 and name HB2 ))
3.600 1.600 1.600 peak 1016 spectrum 1 weight 0.10000E+01 volume 0.18064E-02 ppm1 1.044 ppm2 1.627 CV 1
ASSI { 1019}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 46 and name HA ))
2.600 0.900 0.900 peak 1019 spectrum 1 weight 0.10000E+01 volume 0.14057E-02 ppm1 1.727 ppm2 4.129 CV 1
ASSI { 1027}
(( segid " " and resid 8 and name HB ))
(( segid " " and resid 7 and name HA ))
2.200 2.200 3.800 peak 1027 spectrum 1 weight 0.10000E+01 volume 0.19575E-02 ppm1 1.420 ppm2 4.252 CV 1
ASSI { 1052}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 30 and name HB2 ))
4.500 2.600 1.500 peak 1052 spectrum 1 weight 0.10000E+01 volume 0.19388E-03 ppm1 3.047 ppm2 3.773 CV 1
ASSI { 1062}
(( segid " " and resid 46 and name HG2 ))
(( segid " " and resid 37 and name HA ))
2.500 2.500 3.500 peak 1062 spectrum 1 weight 0.10000E+01 volume 0.10301E-02 ppm1 2.021 ppm2 4.184 CV 1
ASSI { 1127}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 39 and name HB ))
4.300 2.300 1.700 peak 1127 spectrum 1 weight 0.10000E+01 volume 0.47670E-03 ppm1 1.235 ppm2 1.886 CV 1
ASSI { 1167}
(( segid " " and resid 25 and name HZ3 ))
(( segid " " and resid 25 and name HZ2 ))
4.400 2.400 1.600 peak 1167 spectrum 1 weight 0.10000E+01 volume 0.55840E-03 ppm1 6.773 ppm2 7.411 CV 1
ASSI { 1173}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 6 and name HA ))
3.500 1.600 1.600 peak 1173 spectrum 1 weight 0.10000E+01 volume 0.92755E-03 ppm1 0.551 ppm2 3.664 CV 1
ASSI { 1212}
(( segid " " and resid 25 and name HD1 ))
(( segid " " and resid 6 and name HD21))
4.300 2.400 1.700 peak 1212 spectrum 1 weight 0.10000E+01 volume 0.23736E-03 ppm1 6.821 ppm2 7.096 CV 1
ASSI { 1243}
(( segid " " and resid 13 and name HB ))
(( segid " " and resid 18 and name HA ))
4.000 2.000 2.000 peak 1243 spectrum 1 weight 0.10000E+01 volume 0.68122E-03 ppm1 3.997 ppm2 4.471 CV 1
ASSI { 1249}
( segid " " and resid 47 and name HE% )
( segid " " and resid 47 and name HD% )
4.600 2.700 1.400 peak 1249 spectrum 1 weight 0.10000E+01 volume 0.80366E-04 ppm1 6.650 ppm2 7.014 CV 1
ASSI { 1289}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 14 and name HA ))
4.700 2.800 1.300 peak 1289 spectrum 1 weight 0.10000E+01 volume 0.73889E-03 ppm1 1.235 ppm2 4.361 CV 1
ASSI { 1297}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 32 and name HA ))
4.200 2.200 1.800 peak 1297 spectrum 1 weight 0.10000E+01 volume 0.47615E-04 ppm1 4.230 ppm2 4.649 CV 1
ASSI { 1314}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 44 and name HB ))
4.200 2.200 1.800 peak 1314 spectrum 1 weight 0.10000E+01 volume 0.29746E-03 ppm1 1.242 ppm2 1.914 CV 1
ASSI { 36}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HA1 ))
2.200 0.600 0.600 peak 36 spectrum 1 weight 0.10000E+01 volume 0.71163E-02 ppm1 7.798 ppm2 3.716 CV 1
ASSI { 84}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HA ))
3.400 1.400 1.400 peak 84 spectrum 1 weight 0.10000E+01 volume 0.30666E-02 ppm1 8.109 ppm2 4.349 CV 1
ASSI { 86}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 18 and name HN ))
3.400 1.500 1.500 peak 86 spectrum 1 weight 0.10000E+01 volume 0.71363E-03 ppm1 8.109 ppm2 7.583 CV 1
ASSI { 89}
(( segid " " and resid 15 and name HN ))
( segid " " and resid 14 and name HB% )
2.400 0.700 0.700 peak 89 spectrum 1 weight 0.10000E+01 volume 0.58732E-02 ppm1 8.109 ppm2 1.021 CV 1
ASSI { 94}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 16 and name HN ))
3.300 1.400 1.400 peak 94 spectrum 1 weight 0.10000E+01 volume 0.16013E-02 ppm1 8.109 ppm2 8.544 CV 1
ASSI { 95}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HN ))
2.500 0.800 0.800 peak 95 spectrum 1 weight 0.10000E+01 volume 0.25186E-02 ppm1 8.109 ppm2 8.403 CV 1
ASSI { 109}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 10 and name HA1 ))
3.000 1.100 1.100 peak 109 spectrum 1 weight 0.10000E+01 volume 0.14379E-02 ppm1 7.305 ppm2 4.091 CV 1
ASSI { 115}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 10 and name HA2 ))
3.600 1.600 1.600 peak 115 spectrum 1 weight 0.10000E+01 volume 0.11986E-02 ppm1 7.305 ppm2 3.763 CV 1
ASSI { 116}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 9 and name HN ))
3.600 1.600 1.600 peak 116 spectrum 1 weight 0.10000E+01 volume 0.20294E-02 ppm1 7.305 ppm2 8.849 CV 1
ASSI { 121}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 22 and name HN ))
3.600 1.600 1.600 peak 121 spectrum 1 weight 0.10000E+01 volume 0.83474E-03 ppm1 7.305 ppm2 7.677 CV 1
ASSI { 122}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 18 and name HN ))
2.400 0.700 0.700 peak 122 spectrum 1 weight 0.10000E+01 volume 0.44460E-02 ppm1 8.332 ppm2 7.583 CV 1
ASSI { 124}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 18 and name HB% )
4.500 2.500 1.500 peak 124 spectrum 1 weight 0.10000E+01 volume 0.10526E-02 ppm1 8.332 ppm2 1.232 CV 1
ASSI { 128}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HA1 ))
2.300 0.700 0.700 peak 128 spectrum 1 weight 0.10000E+01 volume 0.70573E-02 ppm1 8.332 ppm2 3.575 CV 1
ASSI { 130}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HA2 ))
2.500 0.800 0.800 peak 130 spectrum 1 weight 0.10000E+01 volume 0.10130E-01 ppm1 8.332 ppm2 3.974 CV 1
ASSI { 132}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HN ))
2.900 1.100 1.100 peak 132 spectrum 1 weight 0.10000E+01 volume 0.17204E-02 ppm1 8.332 ppm2 8.544 CV 1
ASSI { 160}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 3 and name HA2 ))
2.700 0.900 0.900 peak 160 spectrum 1 weight 0.10000E+01 volume 0.32032E-02 ppm1 8.579 ppm2 3.857 CV 1
ASSI { 167}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 4 and name HN ))
4.700 2.800 1.300 peak 167 spectrum 1 weight 0.10000E+01 volume 0.10536E-02 ppm1 8.579 ppm2 8.263 CV 1
ASSI { 230}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HA2 ))
2.500 0.800 0.800 peak 230 spectrum 1 weight 0.10000E+01 volume 0.36188E-02 ppm1 8.573 ppm2 3.763 CV 1
ASSI { 232}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HA1 ))
3.400 1.500 1.500 peak 232 spectrum 1 weight 0.10000E+01 volume 0.37660E-02 ppm1 8.573 ppm2 4.114 CV 1
ASSI { 233}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 21 and name HE% )
4.200 2.200 1.800 peak 233 spectrum 1 weight 0.10000E+01 volume 0.73097E-03 ppm1 8.579 ppm2 6.693 CV 1
ASSI { 258}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HN ))
3.900 1.900 1.900 peak 258 spectrum 1 weight 0.10000E+01 volume 0.88127E-03 ppm1 8.232 ppm2 8.872 CV 1
ASSI { 265}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HB2 ))
2.700 0.900 0.900 peak 265 spectrum 1 weight 0.10000E+01 volume 0.39005E-02 ppm1 7.986 ppm2 3.833 CV 1
ASSI { 269}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 36 and name HN ))
3.000 1.100 1.100 peak 269 spectrum 1 weight 0.10000E+01 volume 0.18477E-02 ppm1 7.986 ppm2 8.286 CV 1
ASSI { 279}
(( segid " " and resid 6 and name HD22))
(( segid " " and resid 6 and name HB2 ))
4.400 2.400 1.600 peak 279 spectrum 1 weight 0.10000E+01 volume 0.91776E-03 ppm1 7.845 ppm2 2.193 CV 1
ASSI { 283}
(( segid " " and resid 6 and name HD22))
(( segid " " and resid 6 and name HD21))
2.100 0.500 0.500 peak 283 spectrum 1 weight 0.10000E+01 volume 0.42806E-02 ppm1 7.845 ppm2 7.068 CV 1
ASSI { 302}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 21 and name HD% )
3.900 1.900 1.900 peak 302 spectrum 1 weight 0.10000E+01 volume 0.76436E-03 ppm1 7.710 ppm2 6.974 CV 1
ASSI { 312}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 38 and name HE% )
3.700 3.700 2.300 peak 312 spectrum 1 weight 0.10000E+01 volume 0.15156E-02 ppm1 7.710 ppm2 6.763 CV 1
ASSI { 315}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 23 and name HG2%)
2.700 2.700 3.300 peak 315 spectrum 1 weight 0.10000E+01 volume 0.98859E-03 ppm1 7.710 ppm2 0.880 CV 1
ASSI { 316}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 25 and name HE1 ))
3.700 1.700 1.700 peak 316 spectrum 1 weight 0.10000E+01 volume 0.21322E-02 ppm1 7.710 ppm2 9.646 CV 1
ASSI { 333}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 25 and name HH2 ))
4.200 2.200 1.800 peak 333 spectrum 1 weight 0.10000E+01 volume 0.70408E-03 ppm1 8.309 ppm2 6.880 CV 1
ASSI { 334}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 6 and name HA ))
2.200 2.200 3.800 peak 334 spectrum 1 weight 0.10000E+01 volume 0.30880E-02 ppm1 8.309 ppm2 3.669 CV 1
ASSI { 336}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 8 and name HB ))
4.800 2.900 1.200 peak 336 spectrum 1 weight 0.10000E+01 volume 0.77306E-03 ppm1 7.558 ppm2 1.419 CV 1
ASSI { 384}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 43 and name HN ))
3.300 1.300 1.300 peak 384 spectrum 1 weight 0.10000E+01 volume 0.10419E-02 ppm1 8.168 ppm2 7.677 CV 1
ASSI { 396}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 12 and name HB2 ))
3.400 1.500 1.500 peak 396 spectrum 1 weight 0.10000E+01 volume 0.91546E-03 ppm1 8.890 ppm2 1.794 CV 1
ASSI { 400}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 19 and name HA ))
4.000 2.000 2.000 peak 400 spectrum 1 weight 0.10000E+01 volume 0.78800E-03 ppm1 8.890 ppm2 4.958 CV 1
ASSI { 403}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 21 and name HA ))
3.900 1.900 1.900 peak 403 spectrum 1 weight 0.10000E+01 volume 0.87318E-03 ppm1 8.890 ppm2 5.193 CV 1
ASSI { 413}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HA ))
2.200 0.600 0.600 peak 413 spectrum 1 weight 0.10000E+01 volume 0.62096E-02 ppm1 8.473 ppm2 4.443 CV 1
ASSI { 414}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HB2 ))
4.200 2.200 1.800 peak 414 spectrum 1 weight 0.10000E+01 volume 0.17910E-02 ppm1 8.473 ppm2 2.872 CV 1
ASSI { 416}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HA ))
2.600 0.900 0.900 peak 416 spectrum 1 weight 0.10000E+01 volume 0.18659E-02 ppm1 8.473 ppm2 3.857 CV 1
ASSI { 429}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HN ))
3.200 1.300 1.300 peak 429 spectrum 1 weight 0.10000E+01 volume 0.26642E-02 ppm1 8.180 ppm2 8.005 CV 1
ASSI { 436}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HB ))
3.100 1.200 1.200 peak 436 spectrum 1 weight 0.10000E+01 volume 0.17069E-02 ppm1 8.186 ppm2 1.911 CV 1
ASSI { 437}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HB2 ))
2.900 1.100 1.100 peak 437 spectrum 1 weight 0.10000E+01 volume 0.31144E-02 ppm1 8.186 ppm2 3.646 CV 1
ASSI { 438}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HA ))
2.300 0.600 0.600 peak 438 spectrum 1 weight 0.10000E+01 volume 0.63520E-02 ppm1 8.186 ppm2 3.927 CV 1
ASSI { 449}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 3 and name HA2 ))
2.700 0.900 0.900 peak 449 spectrum 1 weight 0.10000E+01 volume 0.42584E-02 ppm1 8.285 ppm2 3.857 CV 1
ASSI { 451}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HA1 ))
2.700 0.900 0.900 peak 451 spectrum 1 weight 0.10000E+01 volume 0.18903E-02 ppm1 7.921 ppm2 3.716 CV 1
ASSI { 452}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 47 and name HB2 ))
4.100 2.100 1.900 peak 452 spectrum 1 weight 0.10000E+01 volume 0.17546E-02 ppm1 7.921 ppm2 2.685 CV 1
ASSI { 458}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HA ))
2.800 1.000 1.000 peak 458 spectrum 1 weight 0.10000E+01 volume 0.31850E-02 ppm1 7.921 ppm2 4.443 CV 1
ASSI { 459}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HB2 ))
2.500 0.800 0.800 peak 459 spectrum 1 weight 0.10000E+01 volume 0.43189E-02 ppm1 7.921 ppm2 2.872 CV 1
ASSI { 470}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 25 and name HZ2 ))
3.700 3.700 2.300 peak 470 spectrum 1 weight 0.10000E+01 volume 0.71533E-03 ppm1 8.285 ppm2 7.396 CV 1
ASSI { 486}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HB ))
3.400 1.400 1.400 peak 486 spectrum 1 weight 0.10000E+01 volume 0.12908E-02 ppm1 7.699 ppm2 1.935 CV 1
ASSI { 494}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 44 and name HN ))
4.100 2.100 1.900 peak 494 spectrum 1 weight 0.10000E+01 volume 0.81125E-03 ppm1 7.699 ppm2 7.982 CV 1
ASSI { 526}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 19 and name HA ))
2.400 0.700 0.700 peak 526 spectrum 1 weight 0.10000E+01 volume 0.25266E-02 ppm1 8.461 ppm2 4.958 CV 1
ASSI { 529}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HN ))
3.900 1.900 1.900 peak 529 spectrum 1 weight 0.10000E+01 volume 0.79445E-03 ppm1 8.467 ppm2 7.560 CV 1
ASSI { 536}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HA ))
1.900 0.500 0.500 peak 536 spectrum 1 weight 0.10000E+01 volume 0.96440E-02 ppm1 8.461 ppm2 4.443 CV 1
ASSI { 538}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 19 and name HG2 ))
3.700 1.700 1.700 peak 538 spectrum 1 weight 0.10000E+01 volume 0.13912E-02 ppm1 8.461 ppm2 2.216 CV 1
ASSI { 558}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 8 and name HA ))
2.500 0.800 0.800 peak 558 spectrum 1 weight 0.10000E+01 volume 0.28864E-02 ppm1 8.860 ppm2 4.044 CV 1
ASSI { 607}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 4 and name HA ))
3.300 1.400 1.400 peak 607 spectrum 1 weight 0.10000E+01 volume 0.17135E-02 ppm1 8.221 ppm2 4.372 CV 1
ASSI { 618}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HB2 ))
2.600 2.600 3.400 peak 618 spectrum 1 weight 0.10000E+01 volume 0.44444E-02 ppm1 8.045 ppm2 3.060 CV 1
ASSI { 621}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 39 and name HN ))
3.200 1.300 1.300 peak 621 spectrum 1 weight 0.10000E+01 volume 0.22581E-02 ppm1 8.045 ppm2 7.232 CV 1
ASSI { 626}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 34 and name HB ))
3.300 1.300 1.300 peak 626 spectrum 1 weight 0.10000E+01 volume 0.17105E-02 ppm1 8.051 ppm2 1.958 CV 1
ASSI { 639}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 47 and name HN ))
3.100 1.200 1.200 peak 639 spectrum 1 weight 0.10000E+01 volume 0.30157E-02 ppm1 8.115 ppm2 7.513 CV 1
ASSI { 649}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HB2 ))
3.900 1.900 1.900 peak 649 spectrum 1 weight 0.10000E+01 volume 0.12257E-02 ppm1 8.121 ppm2 3.646 CV 1
ASSI { 681}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 18 and name HB% )
2.400 0.700 0.700 peak 681 spectrum 1 weight 0.10000E+01 volume 0.88747E-02 ppm1 7.599 ppm2 1.255 CV 1
ASSI { 682}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 18 and name HA ))
2.700 0.900 0.900 peak 682 spectrum 1 weight 0.10000E+01 volume 0.27133E-02 ppm1 7.593 ppm2 4.443 CV 1
ASSI { 684}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HA1 ))
3.400 1.400 1.400 peak 684 spectrum 1 weight 0.10000E+01 volume 0.16412E-02 ppm1 7.593 ppm2 3.575 CV 1
ASSI { 685}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 13 and name HG1 ))
3.600 1.600 1.600 peak 685 spectrum 1 weight 0.10000E+01 volume 0.12146E-02 ppm1 7.593 ppm2 1.044 CV 1
ASSI { 687}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HB ))
3.300 1.400 1.400 peak 687 spectrum 1 weight 0.10000E+01 volume 0.24429E-02 ppm1 7.992 ppm2 1.911 CV 1
ASSI { 711}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 7 and name HN ))
3.600 1.600 1.600 peak 711 spectrum 1 weight 0.10000E+01 volume 0.81469E-03 ppm1 8.860 ppm2 7.536 CV 1
ASSI { 717}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HB2 ))
3.600 1.600 1.600 peak 717 spectrum 1 weight 0.10000E+01 volume 0.89067E-03 ppm1 8.860 ppm2 2.193 CV 1
ASSI { 726}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 26 and name HB2 ))
3.600 1.600 1.600 peak 726 spectrum 1 weight 0.10000E+01 volume 0.95000E-03 ppm1 9.036 ppm2 1.677 CV 1
ASSI { 756}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HB2 ))
2.800 1.000 1.000 peak 756 spectrum 1 weight 0.10000E+01 volume 0.30608E-02 ppm1 7.517 ppm2 2.685 CV 1
ASSI { 791}
(( segid " " and resid 40 and name HN ))
( segid " " and resid 41 and name HB% )
3.900 1.900 1.900 peak 791 spectrum 1 weight 0.10000E+01 volume 0.94605E-03 ppm1 7.916 ppm2 1.279 CV 1
ASSI { 792}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HA ))
3.400 1.400 1.400 peak 792 spectrum 1 weight 0.10000E+01 volume 0.76981E-03 ppm1 7.921 ppm2 4.068 CV 1
ASSI { 803}
(( segid " " and resid 23 and name HN ))
( segid " " and resid 23 and name HG2%)
3.100 1.200 1.200 peak 803 spectrum 1 weight 0.10000E+01 volume 0.22736E-02 ppm1 8.133 ppm2 0.880 CV 1
ASSI { 811}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 7 and name HG2 ))
3.500 3.500 2.500 peak 811 spectrum 1 weight 0.10000E+01 volume 0.19388E-02 ppm1 8.133 ppm2 1.091 CV 1
ASSI { 825}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HB2 ))
3.400 1.500 1.500 peak 825 spectrum 1 weight 0.10000E+01 volume 0.89847E-03 ppm1 7.699 ppm2 2.286 CV 1
ASSI { 838}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 12 and name HN ))
4.500 2.500 1.500 peak 838 spectrum 1 weight 0.10000E+01 volume 0.83634E-03 ppm1 7.699 ppm2 8.872 CV 1
ASSI { 839}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HA ))
2.600 0.800 0.800 peak 839 spectrum 1 weight 0.10000E+01 volume 0.34925E-02 ppm1 7.699 ppm2 5.193 CV 1
ASSI { 840}
(( segid " " and resid 22 and name HN ))
( segid " " and resid 22 and name HD1%)
3.600 1.600 1.600 peak 840 spectrum 1 weight 0.10000E+01 volume 0.23309E-02 ppm1 7.699 ppm2 0.435 CV 1
OR { 840}
(( segid " " and resid 22 and name HN ))
( segid " " and resid 22 and name HD2%)
ASSI { 870}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 19 and name HA ))
2.200 0.600 0.600 peak 870 spectrum 1 weight 0.10000E+01 volume 0.36107E-02 ppm1 8.420 ppm2 4.958 CV 1
ASSI { 871}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 18 and name HB% )
3.400 1.500 1.500 peak 871 spectrum 1 weight 0.10000E+01 volume 0.14718E-02 ppm1 8.420 ppm2 1.232 CV 1
ASSI { 879}
(( segid " " and resid 25 and name HE1 ))
( segid " " and resid 21 and name HD% )
3.400 3.400 2.600 peak 879 spectrum 1 weight 0.10000E+01 volume 0.21497E-02 ppm1 9.658 ppm2 6.974 CV 1
ASSI { 881}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HA ))
2.800 1.000 1.000 peak 881 spectrum 1 weight 0.10000E+01 volume 0.24193E-02 ppm1 8.420 ppm2 4.349 CV 1
ASSI { 887}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 14 and name HB% )
2.400 0.700 0.700 peak 887 spectrum 1 weight 0.10000E+01 volume 0.73507E-02 ppm1 8.420 ppm2 1.021 CV 1
ASSI { 888}
(( segid " " and resid 25 and name HE1 ))
( segid " " and resid 38 and name HE% )
2.900 2.900 3.100 peak 888 spectrum 1 weight 0.10000E+01 volume 0.36568E-02 ppm1 9.658 ppm2 6.763 CV 1
ASSI { 909}
(( segid " " and resid 33 and name HE1 ))
(( segid " " and resid 11 and name HA ))
3.800 1.800 1.800 peak 909 spectrum 1 weight 0.10000E+01 volume 0.15029E-02 ppm1 9.928 ppm2 5.661 CV 1
ASSI { 912}
(( segid " " and resid 33 and name HE1 ))
(( segid " " and resid 33 and name HZ2 ))
2.600 0.900 0.900 peak 912 spectrum 1 weight 0.10000E+01 volume 0.59181E-02 ppm1 9.928 ppm2 7.232 CV 1
ASSI { 6}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 25 and name HZ3 ))
2.100 2.100 3.900 peak 6 spectrum 1 weight 0.10000E+01 volume 0.14949E-01 ppm1 6.971 ppm2 6.782 CV 1
ASSI { 14}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 47 and name HB2 ))
2.500 0.800 0.800 peak 14 spectrum 1 weight 0.10000E+01 volume 0.92696E-02 ppm1 2.883 ppm2 2.693 CV 1
ASSI { 23}
(( segid " " and resid 3 and name HA2 ))
(( segid " " and resid 5 and name HA ))
2.800 2.800 3.200 peak 23 spectrum 1 weight 0.10000E+01 volume 0.87603E-02 ppm1 3.860 ppm2 3.691 CV 1
ASSI { 31}
(( segid " " and resid 33 and name HE1 ))
(( segid " " and resid 33 and name HD1 ))
2.700 0.900 0.900 peak 31 spectrum 1 weight 0.10000E+01 volume 0.34373E-02 ppm1 9.925 ppm2 7.124 CV 1
ASSI { 45}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HB2 ))
3.200 1.300 1.300 peak 45 spectrum 1 weight 0.10000E+01 volume 0.75306E-03 ppm1 3.860 ppm2 3.760 CV 1
ASSI { 63}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 23 and name HA ))
2.200 0.600 0.600 peak 63 spectrum 1 weight 0.10000E+01 volume 0.52958E-02 ppm1 8.086 ppm2 3.979 CV 1
ASSI { 68}
(( segid " " and resid 33 and name HZ2 ))
(( segid " " and resid 33 and name HH2 ))
2.700 0.900 0.900 peak 68 spectrum 1 weight 0.10000E+01 volume 0.30453E-02 ppm1 7.231 ppm2 6.713 CV 1
ASSI { 69}
( segid " " and resid 40 and name HB% )
( segid " " and resid 39 and name HG2%)
3.400 1.500 1.500 peak 69 spectrum 1 weight 0.10000E+01 volume 0.39301E-02 ppm1 1.290 ppm2 0.697 CV 1
ASSI { 80}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 45 and name HB2 ))
3.300 3.300 2.700 peak 80 spectrum 1 weight 0.10000E+01 volume 0.32216E-02 ppm1 3.936 ppm2 3.623 CV 1
ASSI { 83}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 46 and name HA ))
2.300 0.700 0.700 peak 83 spectrum 1 weight 0.10000E+01 volume 0.32193E-02 ppm1 8.072 ppm2 4.115 CV 1
ASSI { 84}
(( segid " " and resid 15 and name HN ))
( segid " " and resid 18 and name HB% )
2.900 1.000 1.000 peak 84 spectrum 1 weight 0.10000E+01 volume 0.33492E-02 ppm1 8.086 ppm2 1.257 CV 1
ASSI { 91}
( segid " " and resid 38 and name HD% )
( segid " " and resid 39 and name HG2%)
3.300 3.300 2.700 peak 91 spectrum 1 weight 0.10000E+01 volume 0.31756E-02 ppm1 6.978 ppm2 0.724 CV 1
ASSI { 120}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HA ))
2.500 0.800 0.800 peak 120 spectrum 1 weight 0.10000E+01 volume 0.41345E-02 ppm1 7.792 ppm2 4.430 CV 1
ASSI { 131}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 36 and name HA ))
2.300 0.700 0.700 peak 131 spectrum 1 weight 0.10000E+01 volume 0.57467E-02 ppm1 8.284 ppm2 4.006 CV 1
ASSI { 143}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 35 and name HG2 ))
2.200 2.200 3.800 peak 143 spectrum 1 weight 0.10000E+01 volume 0.22093E-02 ppm1 1.734 ppm2 1.449 CV 1
ASSI { 176}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 45 and name HB2 ))
5.100 3.300 0.900 peak 176 spectrum 1 weight 0.10000E+01 volume 0.11520E-03 ppm1 3.751 ppm2 3.650 CV 1
ASSI { 177}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HB ))
2.300 0.700 0.700 peak 177 spectrum 1 weight 0.10000E+01 volume 0.20579E-02 ppm1 8.400 ppm2 4.006 CV 1
ASSI { 188}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 46 and name HA ))
2.400 0.700 0.700 peak 188 spectrum 1 weight 0.10000E+01 volume 0.15436E-02 ppm1 7.504 ppm2 4.129 CV 1
ASSI { 190}
(( segid " " and resid 25 and name HZ3 ))
( segid " " and resid 39 and name HG2%)
3.700 3.700 2.300 peak 190 spectrum 1 weight 0.10000E+01 volume 0.10833E-02 ppm1 6.773 ppm2 0.724 CV 1
ASSI { 212}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 13 and name HA ))
4.000 2.000 2.000 peak 212 spectrum 1 weight 0.10000E+01 volume 0.41697E-03 ppm1 4.811 ppm2 4.621 CV 1
ASSI { 213}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HA ))
2.200 0.600 0.600 peak 213 spectrum 1 weight 0.10000E+01 volume 0.24621E-02 ppm1 7.709 ppm2 4.895 CV 1
ASSI { 221}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 40 and name HB% )
3.900 1.900 1.900 peak 221 spectrum 1 weight 0.10000E+01 volume 0.15392E-02 ppm1 8.092 ppm2 1.312 CV 1
ASSI { 236}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HA ))
2.300 0.700 0.700 peak 236 spectrum 1 weight 0.10000E+01 volume 0.26828E-02 ppm1 8.113 ppm2 3.432 CV 1
ASSI { 248}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HA ))
2.800 1.000 1.000 peak 248 spectrum 1 weight 0.10000E+01 volume 0.15034E-02 ppm1 8.154 ppm2 4.416 CV 1
ASSI { 262}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HA1 ))
2.800 1.000 1.000 peak 262 spectrum 1 weight 0.10000E+01 volume 0.20005E-02 ppm1 8.086 ppm2 3.678 CV 1
ASSI { 266}
(( segid " " and resid 7 and name HG2 ))
( segid " " and resid 23 and name HG2%)
3.900 1.900 1.900 peak 266 spectrum 1 weight 0.10000E+01 volume 0.25890E-03 ppm1 1.078 ppm2 0.902 CV 1
ASSI { 280}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HA2 ))
3.100 1.200 1.200 peak 280 spectrum 1 weight 0.10000E+01 volume 0.92561E-03 ppm1 8.092 ppm2 3.869 CV 1
ASSI { 309}
(( segid " " and resid 44 and name HA ))
( segid " " and resid 39 and name HG2%)
3.300 1.400 1.400 peak 309 spectrum 1 weight 0.10000E+01 volume 0.11740E-02 ppm1 3.942 ppm2 0.724 CV 1
ASSI { 311}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HB2 ))
3.300 1.300 1.300 peak 311 spectrum 1 weight 0.10000E+01 volume 0.14253E-02 ppm1 8.147 ppm2 2.529 CV 1
ASSI { 324}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 34 and name HB ))
3.400 1.500 1.500 peak 324 spectrum 1 weight 0.10000E+01 volume 0.16924E-02 ppm1 6.978 ppm2 1.968 CV 1
ASSI { 342}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 39 and name HB ))
3.200 3.200 2.800 peak 342 spectrum 1 weight 0.10000E+01 volume 0.25848E-02 ppm1 4.018 ppm2 1.873 CV 1
ASSI { 370}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HN ))
5.100 3.200 0.900 peak 370 spectrum 1 weight 0.10000E+01 volume 0.14378E-03 ppm1 7.901 ppm2 7.807 CV 1
ASSI { 371}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HD1 ))
4.900 3.000 1.100 peak 371 spectrum 1 weight 0.10000E+01 volume 0.57972E-03 ppm1 8.393 ppm2 7.124 CV 1
ASSI { 389}
(( segid " " and resid 6 and name HA ))
( segid " " and resid 9 and name HG2%)
3.600 1.600 1.600 peak 389 spectrum 1 weight 0.10000E+01 volume 0.97624E-03 ppm1 3.642 ppm2 0.560 CV 1
ASSI { 407}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HA ))
2.900 1.100 1.100 peak 407 spectrum 1 weight 0.10000E+01 volume 0.10596E-02 ppm1 7.511 ppm2 4.238 CV 1
ASSI { 411}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 11 and name HA ))
2.600 0.900 0.900 peak 411 spectrum 1 weight 0.10000E+01 volume 0.13363E-02 ppm1 8.879 ppm2 5.647 CV 1
ASSI { 415}
(( segid " " and resid 19 and name HB2 ))
( segid " " and resid 14 and name HB% )
2.400 2.400 3.600 peak 415 spectrum 1 weight 0.10000E+01 volume 0.11020E-02 ppm1 1.631 ppm2 1.025 CV 1
ASSI { 426}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 20 and name HA ))
3.800 1.800 1.800 peak 426 spectrum 1 weight 0.10000E+01 volume 0.38159E-03 ppm1 4.995 ppm2 4.799 CV 1
ASSI { 436}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HA ))
2.800 1.000 1.000 peak 436 spectrum 1 weight 0.10000E+01 volume 0.15309E-02 ppm1 9.029 ppm2 4.826 CV 1
ASSI { 439}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 30 and name HB2 ))
3.000 3.000 3.000 peak 439 spectrum 1 weight 0.10000E+01 volume 0.29798E-03 ppm1 4.667 ppm2 3.760 CV 1
ASSI { 441}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HA ))
2.900 1.000 1.000 peak 441 spectrum 1 weight 0.10000E+01 volume 0.14365E-02 ppm1 8.851 ppm2 3.664 CV 1
ASSI { 445}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 29 and name HB2 ))
3.700 3.700 2.300 peak 445 spectrum 1 weight 0.10000E+01 volume 0.13397E-02 ppm1 7.880 ppm2 2.898 CV 1
ASSI { 447}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 20 and name HA ))
2.900 2.900 3.100 peak 447 spectrum 1 weight 0.10000E+01 volume 0.42983E-03 ppm1 8.284 ppm2 4.826 CV 1
ASSI { 466}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 38 and name HB2 ))
6.000 4.700 0.000 peak 466 spectrum 1 weight 0.10000E+01 volume 0.15067E-03 ppm1 4.653 ppm2 3.062 CV 1
ASSI { 470}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 34 and name HB ))
4.800 2.900 1.200 peak 470 spectrum 1 weight 0.10000E+01 volume 0.33103E-03 ppm1 4.653 ppm2 1.968 CV 1
ASSI { 471}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HA ))
3.300 1.300 1.300 peak 471 spectrum 1 weight 0.10000E+01 volume 0.65924E-03 ppm1 8.209 ppm2 4.621 CV 1
ASSI { 478}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 19 and name HG2 ))
4.900 3.000 1.100 peak 478 spectrum 1 weight 0.10000E+01 volume 0.25881E-03 ppm1 4.653 ppm2 2.228 CV 1
ASSI { 486}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 19 and name HB2 ))
3.700 1.700 1.700 peak 486 spectrum 1 weight 0.10000E+01 volume 0.64150E-03 ppm1 2.219 ppm2 1.627 CV 1
ASSI { 487}
(( segid " " and resid 32 and name HA ))
( segid " " and resid 40 and name HB% )
5.000 3.200 1.000 peak 487 spectrum 1 weight 0.10000E+01 volume 0.23669E-03 ppm1 4.667 ppm2 1.298 CV 1
ASSI { 494}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 25 and name HH2 ))
3.500 1.600 1.600 peak 494 spectrum 1 weight 0.10000E+01 volume 0.54518E-03 ppm1 7.682 ppm2 6.891 CV 1
ASSI { 505}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HA2 ))
3.900 1.900 1.900 peak 505 spectrum 1 weight 0.10000E+01 volume 0.71443E-03 ppm1 8.544 ppm2 3.883 CV 1
ASSI { 554}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HB2 ))
2.900 1.000 1.000 peak 554 spectrum 1 weight 0.10000E+01 volume 0.95080E-03 ppm1 8.393 ppm2 2.721 CV 1
ASSI { 564}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 5 and name HB ))
3.700 1.700 1.700 peak 564 spectrum 1 weight 0.10000E+01 volume 0.79165E-03 ppm1 3.648 ppm2 1.996 CV 1
ASSI { 565}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HN ))
4.500 2.600 1.500 peak 565 spectrum 1 weight 0.10000E+01 volume 0.81280E-04 ppm1 8.065 ppm2 7.971 CV 1
ASSI { 573}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 13 and name HA ))
5.200 3.400 0.800 peak 573 spectrum 1 weight 0.10000E+01 volume 0.18257E-03 ppm1 4.968 ppm2 4.621 CV 1
ASSI { 610}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 46 and name HG2 ))
4.500 2.500 1.500 peak 610 spectrum 1 weight 0.10000E+01 volume 0.70703E-03 ppm1 8.065 ppm2 2.037 CV 1
ASSI { 622}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 33 and name HB2 ))
5.300 3.500 0.700 peak 622 spectrum 1 weight 0.10000E+01 volume 0.20817E-03 ppm1 4.647 ppm2 2.707 CV 1
ASSI { 625}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HB ))
3.800 1.800 1.800 peak 625 spectrum 1 weight 0.10000E+01 volume 0.59436E-03 ppm1 7.238 ppm2 1.873 CV 1
ASSI { 628}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 19 and name HB2 ))
3.500 1.500 1.500 peak 628 spectrum 1 weight 0.10000E+01 volume 0.77416E-03 ppm1 8.434 ppm2 1.640 CV 1
ASSI { 662}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 6 and name HB2 ))
3.500 3.500 2.500 peak 662 spectrum 1 weight 0.10000E+01 volume 0.78525E-03 ppm1 4.004 ppm2 2.201 CV 1
ASSI { 680}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 20 and name HG2 ))
2.800 2.800 3.200 peak 680 spectrum 1 weight 0.10000E+01 volume 0.48619E-03 ppm1 4.325 ppm2 2.119 CV 1
ASSI { 690}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HA1 ))
3.600 1.600 1.600 peak 690 spectrum 1 weight 0.10000E+01 volume 0.31274E-03 ppm1 8.544 ppm2 3.691 CV 1
ASSI { 713}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 39 and name HB ))
3.800 3.800 2.200 peak 713 spectrum 1 weight 0.10000E+01 volume 0.77311E-03 ppm1 8.127 ppm2 1.900 CV 1
ASSI { 733}
(( segid " " and resid 46 and name HB2 ))
( segid " " and resid 39 and name HG2%)
5.000 3.200 1.000 peak 733 spectrum 1 weight 0.10000E+01 volume 0.16163E-03 ppm1 1.720 ppm2 0.724 CV 1
ASSI { 750}
( segid " " and resid 38 and name HE% )
( segid " " and resid 38 and name HD% )
1.900 0.400 0.400 peak 750 spectrum 1 weight 0.10000E+01 volume 0.14679E-01 ppm1 6.780 ppm2 7.000 CV 1
ASSI { 753}
( segid " " and resid 21 and name HE% )
( segid " " and resid 21 and name HD% )
2.200 0.600 0.600 peak 753 spectrum 1 weight 0.10000E+01 volume 0.55028E-02 ppm1 6.691 ppm2 6.973 CV 1
ASSI { 760}
(( segid " " and resid 15 and name HA1 ))
(( segid " " and resid 15 and name HA2 ))
1.600 0.300 0.600 peak 760 spectrum 1 weight 0.10000E+01 volume 0.13980E-01 ppm1 3.676 ppm2 3.869 CV 1
ASSI { 783}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 25 and name HZ2 ))
2.500 2.500 3.500 peak 783 spectrum 1 weight 0.10000E+01 volume 0.46399E-02 ppm1 6.957 ppm2 7.411 CV 1
ASSI { 818}
(( segid " " and resid 13 and name HG1 ))
(( segid " " and resid 13 and name HB ))
2.100 0.600 0.600 peak 818 spectrum 1 weight 0.10000E+01 volume 0.35867E-02 ppm1 1.064 ppm2 4.006 CV 1
ASSI { 823}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 18 and name HA ))
2.200 0.600 0.600 peak 823 spectrum 1 weight 0.10000E+01 volume 0.50844E-02 ppm1 1.249 ppm2 4.457 CV 1
ASSI { 828}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 8 and name HA ))
2.800 1.000 1.000 peak 828 spectrum 1 weight 0.10000E+01 volume 0.63860E-02 ppm1 0.674 ppm2 4.061 CV 1
ASSI { 829}
( segid " " and resid 14 and name HB% )
(( segid " " and resid 14 and name HA ))
2.500 0.800 0.800 peak 829 spectrum 1 weight 0.10000E+01 volume 0.37074E-02 ppm1 1.009 ppm2 4.361 CV 1
ASSI { 844}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HA ))
2.500 0.800 0.800 peak 844 spectrum 1 weight 0.10000E+01 volume 0.43736E-02 ppm1 2.883 ppm2 4.457 CV 1
ASSI { 853}
( segid " " and resid 39 and name HG2%)
(( segid " " and resid 34 and name HB ))
2.300 0.700 0.700 peak 853 spectrum 1 weight 0.10000E+01 volume 0.31904E-02 ppm1 0.715 ppm2 1.968 CV 1
ASSI { 876}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 26 and name HA ))
2.700 0.900 0.900 peak 876 spectrum 1 weight 0.10000E+01 volume 0.28867E-02 ppm1 1.679 ppm2 4.006 CV 1
ASSI { 877}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 11 and name HB2 ))
2.400 2.400 3.600 peak 877 spectrum 1 weight 0.10000E+01 volume 0.11875E-02 ppm1 3.436 ppm2 3.787 CV 1
ASSI { 883}
(( segid " " and resid 7 and name HG2 ))
(( segid " " and resid 8 and name HB ))
4.300 2.300 1.700 peak 883 spectrum 1 weight 0.10000E+01 volume 0.14615E-02 ppm1 1.085 ppm2 1.422 CV 1
ASSI { 884}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 5 and name HB ))
2.000 2.000 4.000 peak 884 spectrum 1 weight 0.10000E+01 volume 0.33721E-02 ppm1 0.551 ppm2 1.996 CV 1
ASSI { 890}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 47 and name HA ))
2.800 1.000 1.000 peak 890 spectrum 1 weight 0.10000E+01 volume 0.11830E-02 ppm1 2.684 ppm2 4.238 CV 1
ASSI { 953}
(( segid " " and resid 9 and name HB ))
(( segid " " and resid 23 and name HA ))
3.500 3.500 2.500 peak 953 spectrum 1 weight 0.10000E+01 volume 0.13764E-02 ppm1 1.864 ppm2 4.006 CV 1
ASSI { 963}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 31 and name HA ))
3.000 3.000 3.000 peak 963 spectrum 1 weight 0.10000E+01 volume 0.24040E-02 ppm1 3.450 ppm2 4.908 CV 1
ASSI { 965}
( segid " " and resid 9 and name HG2%)
( segid " " and resid 23 and name HG2%)
3.000 1.100 1.100 peak 965 spectrum 1 weight 0.10000E+01 volume 0.19289E-02 ppm1 0.551 ppm2 0.902 CV 1
ASSI { 982}
(( segid " " and resid 34 and name HB ))
(( segid " " and resid 34 and name HA ))
2.400 0.700 0.700 peak 982 spectrum 1 weight 0.10000E+01 volume 0.25849E-02 ppm1 1.960 ppm2 4.908 CV 1
ASSI { 1016}
(( segid " " and resid 13 and name HG1 ))
(( segid " " and resid 19 and name HB2 ))
3.700 1.700 1.700 peak 1016 spectrum 1 weight 0.10000E+01 volume 0.17590E-02 ppm1 1.044 ppm2 1.627 CV 1
ASSI { 1019}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 46 and name HA ))
2.700 0.900 0.900 peak 1019 spectrum 1 weight 0.10000E+01 volume 0.13689E-02 ppm1 1.727 ppm2 4.129 CV 1
ASSI { 1027}
(( segid " " and resid 8 and name HB ))
(( segid " " and resid 7 and name HA ))
3.500 3.500 2.500 peak 1027 spectrum 1 weight 0.10000E+01 volume 0.19063E-02 ppm1 1.420 ppm2 4.252 CV 1
ASSI { 1052}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 30 and name HB2 ))
3.300 1.300 1.300 peak 1052 spectrum 1 weight 0.10000E+01 volume 0.18880E-03 ppm1 3.047 ppm2 3.773 CV 1
ASSI { 1062}
(( segid " " and resid 46 and name HG2 ))
(( segid " " and resid 37 and name HA ))
2.500 2.500 3.500 peak 1062 spectrum 1 weight 0.10000E+01 volume 0.10031E-02 ppm1 2.021 ppm2 4.184 CV 1
ASSI { 1127}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 39 and name HB ))
4.300 2.300 1.700 peak 1127 spectrum 1 weight 0.10000E+01 volume 0.46421E-03 ppm1 1.235 ppm2 1.886 CV 1
ASSI { 1167}
(( segid " " and resid 25 and name HZ3 ))
(( segid " " and resid 25 and name HZ2 ))
4.300 2.300 1.700 peak 1167 spectrum 1 weight 0.10000E+01 volume 0.54378E-03 ppm1 6.773 ppm2 7.411 CV 1
ASSI { 1210}
(( segid " " and resid 13 and name HG1 ))
(( segid " " and resid 35 and name HB2 ))
4.600 2.600 1.400 peak 1210 spectrum 1 weight 0.10000E+01 volume 0.70283E-03 ppm1 1.044 ppm2 2.721 CV 1
ASSI { 1212}
(( segid " " and resid 25 and name HD1 ))
(( segid " " and resid 6 and name HD21))
4.300 2.300 1.700 peak 1212 spectrum 1 weight 0.10000E+01 volume 0.23114E-03 ppm1 6.821 ppm2 7.096 CV 1
ASSI { 1243}
(( segid " " and resid 13 and name HB ))
(( segid " " and resid 18 and name HA ))
3.800 1.800 1.800 peak 1243 spectrum 1 weight 0.10000E+01 volume 0.66339E-03 ppm1 3.997 ppm2 4.471 CV 1
ASSI { 1249}
( segid " " and resid 47 and name HE% )
( segid " " and resid 47 and name HD% )
4.600 2.700 1.400 peak 1249 spectrum 1 weight 0.10000E+01 volume 0.78260E-04 ppm1 6.650 ppm2 7.014 CV 1
ASSI { 1289}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 14 and name HA ))
4.300 2.300 1.700 peak 1289 spectrum 1 weight 0.10000E+01 volume 0.71952E-03 ppm1 1.235 ppm2 4.361 CV 1
ASSI { 1297}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 32 and name HA ))
4.100 2.100 1.900 peak 1297 spectrum 1 weight 0.10000E+01 volume 0.46367E-04 ppm1 4.230 ppm2 4.649 CV 1
ASSI { 1314}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 44 and name HB ))
4.300 2.300 1.700 peak 1314 spectrum 1 weight 0.10000E+01 volume 0.28966E-03 ppm1 1.242 ppm2 1.914 CV 1
ASSI { 36}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HA1 ))
2.300 0.700 0.700 peak 36 spectrum 1 weight 0.10000E+01 volume 0.73999E-02 ppm1 7.798 ppm2 3.716 CV 1
ASSI { 84}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HA ))
3.400 1.500 1.500 peak 84 spectrum 1 weight 0.10000E+01 volume 0.31887E-02 ppm1 8.109 ppm2 4.349 CV 1
ASSI { 86}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 18 and name HN ))
3.400 1.500 1.500 peak 86 spectrum 1 weight 0.10000E+01 volume 0.74206E-03 ppm1 8.109 ppm2 7.583 CV 1
ASSI { 89}
(( segid " " and resid 15 and name HN ))
( segid " " and resid 14 and name HB% )
2.300 0.700 0.700 peak 89 spectrum 1 weight 0.10000E+01 volume 0.61069E-02 ppm1 8.109 ppm2 1.021 CV 1
ASSI { 94}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 16 and name HN ))
3.000 1.200 1.200 peak 94 spectrum 1 weight 0.10000E+01 volume 0.16652E-02 ppm1 8.109 ppm2 8.544 CV 1
ASSI { 95}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HN ))
2.400 0.700 0.700 peak 95 spectrum 1 weight 0.10000E+01 volume 0.26188E-02 ppm1 8.109 ppm2 8.403 CV 1
ASSI { 109}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 10 and name HA1 ))
3.000 1.100 1.100 peak 109 spectrum 1 weight 0.10000E+01 volume 0.14952E-02 ppm1 7.305 ppm2 4.091 CV 1
ASSI { 115}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 10 and name HA2 ))
3.500 1.600 1.600 peak 115 spectrum 1 weight 0.10000E+01 volume 0.12463E-02 ppm1 7.305 ppm2 3.763 CV 1
ASSI { 116}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 9 and name HN ))
3.600 1.600 1.600 peak 116 spectrum 1 weight 0.10000E+01 volume 0.21102E-02 ppm1 7.305 ppm2 8.849 CV 1
ASSI { 121}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 22 and name HN ))
3.600 1.600 1.600 peak 121 spectrum 1 weight 0.10000E+01 volume 0.86797E-03 ppm1 7.305 ppm2 7.677 CV 1
ASSI { 122}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 18 and name HN ))
2.500 0.800 0.800 peak 122 spectrum 1 weight 0.10000E+01 volume 0.46231E-02 ppm1 8.332 ppm2 7.583 CV 1
ASSI { 124}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 18 and name HB% )
4.600 2.600 1.400 peak 124 spectrum 1 weight 0.10000E+01 volume 0.10946E-02 ppm1 8.332 ppm2 1.232 CV 1
ASSI { 128}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HA1 ))
2.300 0.700 0.700 peak 128 spectrum 1 weight 0.10000E+01 volume 0.73383E-02 ppm1 8.332 ppm2 3.575 CV 1
ASSI { 130}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HA2 ))
2.500 0.800 0.800 peak 130 spectrum 1 weight 0.10000E+01 volume 0.10533E-01 ppm1 8.332 ppm2 3.974 CV 1
ASSI { 132}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HN ))
2.800 1.000 1.000 peak 132 spectrum 1 weight 0.10000E+01 volume 0.17888E-02 ppm1 8.332 ppm2 8.544 CV 1
ASSI { 160}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 3 and name HA2 ))
3.000 1.200 1.200 peak 160 spectrum 1 weight 0.10000E+01 volume 0.33308E-02 ppm1 8.579 ppm2 3.857 CV 1
ASSI { 167}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 4 and name HN ))
4.500 2.600 1.500 peak 167 spectrum 1 weight 0.10000E+01 volume 0.10956E-02 ppm1 8.579 ppm2 8.263 CV 1
ASSI { 230}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HA2 ))
2.500 0.800 0.800 peak 230 spectrum 1 weight 0.10000E+01 volume 0.37629E-02 ppm1 8.573 ppm2 3.763 CV 1
ASSI { 232}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HA1 ))
3.500 1.500 1.500 peak 232 spectrum 1 weight 0.10000E+01 volume 0.39160E-02 ppm1 8.573 ppm2 4.114 CV 1
ASSI { 233}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 21 and name HE% )
4.400 2.400 1.600 peak 233 spectrum 1 weight 0.10000E+01 volume 0.76012E-03 ppm1 8.579 ppm2 6.693 CV 1
ASSI { 258}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HN ))
3.400 1.500 1.500 peak 258 spectrum 1 weight 0.10000E+01 volume 0.91635E-03 ppm1 8.232 ppm2 8.872 CV 1
ASSI { 260}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 34 and name HA ))
3.900 3.900 2.100 peak 260 spectrum 1 weight 0.10000E+01 volume 0.17047E-02 ppm1 8.232 ppm2 4.888 CV 1
ASSI { 265}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HB2 ))
2.700 0.900 0.900 peak 265 spectrum 1 weight 0.10000E+01 volume 0.40559E-02 ppm1 7.986 ppm2 3.833 CV 1
ASSI { 269}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 36 and name HN ))
2.900 1.100 1.100 peak 269 spectrum 1 weight 0.10000E+01 volume 0.19213E-02 ppm1 7.986 ppm2 8.286 CV 1
ASSI { 279}
(( segid " " and resid 6 and name HD22))
(( segid " " and resid 6 and name HB2 ))
4.500 2.500 1.500 peak 279 spectrum 1 weight 0.10000E+01 volume 0.95432E-03 ppm1 7.845 ppm2 2.193 CV 1
ASSI { 283}
(( segid " " and resid 6 and name HD22))
(( segid " " and resid 6 and name HD21))
2.100 0.500 0.500 peak 283 spectrum 1 weight 0.10000E+01 volume 0.44510E-02 ppm1 7.845 ppm2 7.068 CV 1
ASSI { 302}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 21 and name HD% )
3.800 1.800 1.800 peak 302 spectrum 1 weight 0.10000E+01 volume 0.79479E-03 ppm1 7.710 ppm2 6.974 CV 1
ASSI { 312}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 38 and name HE% )
3.600 3.600 2.400 peak 312 spectrum 1 weight 0.10000E+01 volume 0.15760E-02 ppm1 7.710 ppm2 6.763 CV 1
ASSI { 315}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 23 and name HG2%)
2.700 2.700 3.300 peak 315 spectrum 1 weight 0.10000E+01 volume 0.10280E-02 ppm1 7.710 ppm2 0.880 CV 1
ASSI { 316}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 25 and name HE1 ))
3.600 1.600 1.600 peak 316 spectrum 1 weight 0.10000E+01 volume 0.22171E-02 ppm1 7.710 ppm2 9.646 CV 1
ASSI { 333}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 25 and name HH2 ))
4.200 2.200 1.800 peak 333 spectrum 1 weight 0.10000E+01 volume 0.73213E-03 ppm1 8.309 ppm2 6.880 CV 1
ASSI { 334}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 6 and name HA ))
2.200 2.200 3.800 peak 334 spectrum 1 weight 0.10000E+01 volume 0.32110E-02 ppm1 8.309 ppm2 3.669 CV 1
ASSI { 336}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 8 and name HB ))
4.700 2.700 1.300 peak 336 spectrum 1 weight 0.10000E+01 volume 0.80382E-03 ppm1 7.558 ppm2 1.419 CV 1
ASSI { 384}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 43 and name HN ))
3.500 1.500 1.500 peak 384 spectrum 1 weight 0.10000E+01 volume 0.10834E-02 ppm1 8.168 ppm2 7.677 CV 1
ASSI { 396}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 12 and name HB2 ))
3.500 1.500 1.500 peak 396 spectrum 1 weight 0.10000E+01 volume 0.95187E-03 ppm1 8.890 ppm2 1.794 CV 1
ASSI { 400}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 19 and name HA ))
4.500 2.500 1.500 peak 400 spectrum 1 weight 0.10000E+01 volume 0.81938E-03 ppm1 8.890 ppm2 4.958 CV 1
ASSI { 403}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 21 and name HA ))
4.000 2.000 2.000 peak 403 spectrum 1 weight 0.10000E+01 volume 0.90796E-03 ppm1 8.890 ppm2 5.193 CV 1
ASSI { 413}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HA ))
2.300 0.700 0.700 peak 413 spectrum 1 weight 0.10000E+01 volume 0.64568E-02 ppm1 8.473 ppm2 4.443 CV 1
ASSI { 414}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HB2 ))
4.100 2.100 1.900 peak 414 spectrum 1 weight 0.10000E+01 volume 0.18623E-02 ppm1 8.473 ppm2 2.872 CV 1
ASSI { 416}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HA ))
2.900 1.000 1.000 peak 416 spectrum 1 weight 0.10000E+01 volume 0.19402E-02 ppm1 8.473 ppm2 3.857 CV 1
ASSI { 419}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 38 and name HD% )
3.700 1.700 1.700 peak 419 spectrum 1 weight 0.10000E+01 volume 0.79315E-03 ppm1 8.473 ppm2 6.997 CV 1
ASSI { 429}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HN ))
3.500 1.500 1.500 peak 429 spectrum 1 weight 0.10000E+01 volume 0.27703E-02 ppm1 8.180 ppm2 8.005 CV 1
ASSI { 436}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HB ))
3.700 1.700 1.700 peak 436 spectrum 1 weight 0.10000E+01 volume 0.17748E-02 ppm1 8.186 ppm2 1.911 CV 1
ASSI { 437}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HB2 ))
3.100 1.200 1.200 peak 437 spectrum 1 weight 0.10000E+01 volume 0.32385E-02 ppm1 8.186 ppm2 3.646 CV 1
ASSI { 438}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HA ))
2.300 0.600 0.600 peak 438 spectrum 1 weight 0.10000E+01 volume 0.66050E-02 ppm1 8.186 ppm2 3.927 CV 1
ASSI { 449}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 3 and name HA2 ))
2.800 1.000 1.000 peak 449 spectrum 1 weight 0.10000E+01 volume 0.44280E-02 ppm1 8.285 ppm2 3.857 CV 1
ASSI { 451}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HA1 ))
2.900 1.100 1.100 peak 451 spectrum 1 weight 0.10000E+01 volume 0.19656E-02 ppm1 7.921 ppm2 3.716 CV 1
ASSI { 452}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 47 and name HB2 ))
3.500 3.500 2.500 peak 452 spectrum 1 weight 0.10000E+01 volume 0.18245E-02 ppm1 7.921 ppm2 2.685 CV 1
ASSI { 458}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HA ))
2.800 1.000 1.000 peak 458 spectrum 1 weight 0.10000E+01 volume 0.33118E-02 ppm1 7.921 ppm2 4.443 CV 1
ASSI { 459}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HB2 ))
2.600 0.900 0.900 peak 459 spectrum 1 weight 0.10000E+01 volume 0.44909E-02 ppm1 7.921 ppm2 2.872 CV 1
ASSI { 470}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 25 and name HZ2 ))
3.600 3.600 2.400 peak 470 spectrum 1 weight 0.10000E+01 volume 0.74382E-03 ppm1 8.285 ppm2 7.396 CV 1
ASSI { 486}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HB ))
3.400 1.500 1.500 peak 486 spectrum 1 weight 0.10000E+01 volume 0.13423E-02 ppm1 7.699 ppm2 1.935 CV 1
ASSI { 526}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 19 and name HA ))
2.400 0.700 0.700 peak 526 spectrum 1 weight 0.10000E+01 volume 0.26272E-02 ppm1 8.461 ppm2 4.958 CV 1
ASSI { 529}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HN ))
4.000 2.000 2.000 peak 529 spectrum 1 weight 0.10000E+01 volume 0.82607E-03 ppm1 8.467 ppm2 7.560 CV 1
ASSI { 536}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HA ))
2.000 0.500 0.500 peak 536 spectrum 1 weight 0.10000E+01 volume 0.10028E-01 ppm1 8.461 ppm2 4.443 CV 1
ASSI { 538}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 19 and name HG2 ))
3.800 1.800 1.800 peak 538 spectrum 1 weight 0.10000E+01 volume 0.14466E-02 ppm1 8.461 ppm2 2.216 CV 1
ASSI { 558}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 8 and name HA ))
2.500 0.800 0.800 peak 558 spectrum 1 weight 0.10000E+01 volume 0.30013E-02 ppm1 8.860 ppm2 4.044 CV 1
ASSI { 607}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 4 and name HA ))
3.300 1.400 1.400 peak 607 spectrum 1 weight 0.10000E+01 volume 0.17818E-02 ppm1 8.221 ppm2 4.372 CV 1
ASSI { 618}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HB2 ))
2.500 2.500 3.500 peak 618 spectrum 1 weight 0.10000E+01 volume 0.46214E-02 ppm1 8.045 ppm2 3.060 CV 1
ASSI { 621}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 39 and name HN ))
3.300 1.300 1.300 peak 621 spectrum 1 weight 0.10000E+01 volume 0.23480E-02 ppm1 8.045 ppm2 7.232 CV 1
ASSI { 626}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 34 and name HB ))
3.200 1.300 1.300 peak 626 spectrum 1 weight 0.10000E+01 volume 0.17786E-02 ppm1 8.051 ppm2 1.958 CV 1
ASSI { 639}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 47 and name HN ))
3.000 1.100 1.100 peak 639 spectrum 1 weight 0.10000E+01 volume 0.31358E-02 ppm1 8.115 ppm2 7.513 CV 1
ASSI { 649}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HB2 ))
3.300 1.400 1.400 peak 649 spectrum 1 weight 0.10000E+01 volume 0.12745E-02 ppm1 8.121 ppm2 3.646 CV 1
ASSI { 676}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HN ))
3.900 1.900 1.900 peak 676 spectrum 1 weight 0.10000E+01 volume 0.10065E-02 ppm1 7.986 ppm2 7.700 CV 1
ASSI { 681}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 18 and name HB% )
2.300 0.700 0.700 peak 681 spectrum 1 weight 0.10000E+01 volume 0.92283E-02 ppm1 7.599 ppm2 1.255 CV 1
ASSI { 682}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 18 and name HA ))
2.700 0.900 0.900 peak 682 spectrum 1 weight 0.10000E+01 volume 0.28214E-02 ppm1 7.593 ppm2 4.443 CV 1
ASSI { 684}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HA1 ))
2.900 1.100 1.100 peak 684 spectrum 1 weight 0.10000E+01 volume 0.17066E-02 ppm1 7.593 ppm2 3.575 CV 1
ASSI { 685}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 13 and name HG1 ))
4.100 2.100 1.900 peak 685 spectrum 1 weight 0.10000E+01 volume 0.12630E-02 ppm1 7.593 ppm2 1.044 CV 1
ASSI { 687}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HB ))
3.000 1.200 1.200 peak 687 spectrum 1 weight 0.10000E+01 volume 0.25402E-02 ppm1 7.992 ppm2 1.911 CV 1
ASSI { 711}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 7 and name HN ))
3.900 1.900 1.900 peak 711 spectrum 1 weight 0.10000E+01 volume 0.84715E-03 ppm1 8.860 ppm2 7.536 CV 1
ASSI { 717}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HB2 ))
3.500 1.500 1.500 peak 717 spectrum 1 weight 0.10000E+01 volume 0.92612E-03 ppm1 8.860 ppm2 2.193 CV 1
ASSI { 726}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 26 and name HB2 ))
3.700 1.700 1.700 peak 726 spectrum 1 weight 0.10000E+01 volume 0.98782E-03 ppm1 9.036 ppm2 1.677 CV 1
ASSI { 756}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HB2 ))
2.800 0.900 0.900 peak 756 spectrum 1 weight 0.10000E+01 volume 0.31827E-02 ppm1 7.517 ppm2 2.685 CV 1
ASSI { 791}
(( segid " " and resid 40 and name HN ))
( segid " " and resid 41 and name HB% )
4.200 2.200 1.800 peak 791 spectrum 1 weight 0.10000E+01 volume 0.98373E-03 ppm1 7.916 ppm2 1.279 CV 1
ASSI { 792}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HA ))
3.400 1.400 1.400 peak 792 spectrum 1 weight 0.10000E+01 volume 0.80042E-03 ppm1 7.921 ppm2 4.068 CV 1
ASSI { 803}
(( segid " " and resid 23 and name HN ))
( segid " " and resid 23 and name HG2%)
3.000 1.200 1.200 peak 803 spectrum 1 weight 0.10000E+01 volume 0.23642E-02 ppm1 8.133 ppm2 0.880 CV 1
ASSI { 811}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 7 and name HG2 ))
2.400 2.400 3.600 peak 811 spectrum 1 weight 0.10000E+01 volume 0.20161E-02 ppm1 8.133 ppm2 1.091 CV 1
ASSI { 825}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HB2 ))
3.700 1.700 1.700 peak 825 spectrum 1 weight 0.10000E+01 volume 0.93424E-03 ppm1 7.699 ppm2 2.286 CV 1
ASSI { 838}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 12 and name HN ))
4.300 2.300 1.700 peak 838 spectrum 1 weight 0.10000E+01 volume 0.86967E-03 ppm1 7.699 ppm2 8.872 CV 1
ASSI { 839}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HA ))
2.500 0.800 0.800 peak 839 spectrum 1 weight 0.10000E+01 volume 0.36316E-02 ppm1 7.699 ppm2 5.193 CV 1
ASSI { 840}
(( segid " " and resid 22 and name HN ))
( segid " " and resid 22 and name HD2%)
3.400 1.500 1.500 peak 840 spectrum 1 weight 0.10000E+01 volume 0.24237E-02 ppm1 7.699 ppm2 0.435 CV 1
OR { 840}
(( segid " " and resid 22 and name HN ))
( segid " " and resid 22 and name HD1%)
ASSI { 870}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 19 and name HA ))
1.900 0.500 0.500 peak 870 spectrum 1 weight 0.10000E+01 volume 0.37544E-02 ppm1 8.420 ppm2 4.958 CV 1
ASSI { 871}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 18 and name HB% )
3.700 1.700 1.700 peak 871 spectrum 1 weight 0.10000E+01 volume 0.15304E-02 ppm1 8.420 ppm2 1.232 CV 1
ASSI { 881}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HA ))
2.700 0.900 0.900 peak 881 spectrum 1 weight 0.10000E+01 volume 0.25157E-02 ppm1 8.420 ppm2 4.349 CV 1
ASSI { 887}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 14 and name HB% )
2.300 0.700 0.700 peak 887 spectrum 1 weight 0.10000E+01 volume 0.76431E-02 ppm1 8.420 ppm2 1.021 CV 1
ASSI { 888}
(( segid " " and resid 25 and name HE1 ))
( segid " " and resid 38 and name HE% )
3.200 3.200 2.800 peak 888 spectrum 1 weight 0.10000E+01 volume 0.38023E-02 ppm1 9.658 ppm2 6.763 CV 1
ASSI { 909}
(( segid " " and resid 33 and name HE1 ))
(( segid " " and resid 11 and name HA ))
4.000 2.000 2.000 peak 909 spectrum 1 weight 0.10000E+01 volume 0.15628E-02 ppm1 9.928 ppm2 5.661 CV 1
ASSI { 912}
(( segid " " and resid 33 and name HE1 ))
(( segid " " and resid 33 and name HZ2 ))
2.500 0.800 0.800 peak 912 spectrum 1 weight 0.10000E+01 volume 0.61536E-02 ppm1 9.928 ppm2 7.232 CV 1
ASSI { 6}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 25 and name HZ3 ))
2.100 2.100 3.900 peak 6 spectrum 1 weight 0.10000E+01 volume 0.14929E-01 ppm1 6.971 ppm2 6.782 CV 1
ASSI { 14}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 47 and name HB2 ))
2.300 2.300 3.700 peak 14 spectrum 1 weight 0.10000E+01 volume 0.92569E-02 ppm1 2.883 ppm2 2.693 CV 1
ASSI { 23}
(( segid " " and resid 3 and name HA2 ))
(( segid " " and resid 5 and name HA ))
3.200 3.200 2.800 peak 23 spectrum 1 weight 0.10000E+01 volume 0.87482E-02 ppm1 3.860 ppm2 3.691 CV 1
ASSI { 31}
(( segid " " and resid 33 and name HE1 ))
(( segid " " and resid 33 and name HD1 ))
2.400 0.700 0.700 peak 31 spectrum 1 weight 0.10000E+01 volume 0.34326E-02 ppm1 9.925 ppm2 7.124 CV 1
ASSI { 45}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HB2 ))
3.200 1.300 1.300 peak 45 spectrum 1 weight 0.10000E+01 volume 0.75205E-03 ppm1 3.860 ppm2 3.760 CV 1
ASSI { 62}
(( segid " " and resid 20 and name HB2 ))
( segid " " and resid 39 and name HG2%)
2.500 2.500 3.500 peak 62 spectrum 1 weight 0.10000E+01 volume 0.58780E-02 ppm1 1.932 ppm2 0.724 CV 1
ASSI { 63}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 23 and name HA ))
2.300 0.700 0.700 peak 63 spectrum 1 weight 0.10000E+01 volume 0.52884E-02 ppm1 8.086 ppm2 3.979 CV 1
ASSI { 68}
(( segid " " and resid 33 and name HZ2 ))
(( segid " " and resid 33 and name HH2 ))
2.600 0.900 0.900 peak 68 spectrum 1 weight 0.10000E+01 volume 0.30412E-02 ppm1 7.231 ppm2 6.713 CV 1
ASSI { 69}
( segid " " and resid 40 and name HB% )
( segid " " and resid 39 and name HG2%)
2.900 2.900 3.100 peak 69 spectrum 1 weight 0.10000E+01 volume 0.39247E-02 ppm1 1.290 ppm2 0.697 CV 1
ASSI { 80}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 45 and name HB2 ))
3.500 1.500 1.500 peak 80 spectrum 1 weight 0.10000E+01 volume 0.32172E-02 ppm1 3.936 ppm2 3.623 CV 1
ASSI { 83}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 46 and name HA ))
3.200 1.300 1.300 peak 83 spectrum 1 weight 0.10000E+01 volume 0.32150E-02 ppm1 8.072 ppm2 4.115 CV 1
ASSI { 84}
(( segid " " and resid 15 and name HN ))
( segid " " and resid 18 and name HB% )
3.100 1.200 1.200 peak 84 spectrum 1 weight 0.10000E+01 volume 0.33446E-02 ppm1 8.086 ppm2 1.257 CV 1
ASSI { 91}
( segid " " and resid 38 and name HD% )
( segid " " and resid 39 and name HG2%)
3.400 3.400 2.600 peak 91 spectrum 1 weight 0.10000E+01 volume 0.31713E-02 ppm1 6.978 ppm2 0.724 CV 1
ASSI { 109}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 39 and name HA ))
2.400 2.400 3.600 peak 109 spectrum 1 weight 0.10000E+01 volume 0.49971E-02 ppm1 8.092 ppm2 4.074 CV 1
ASSI { 120}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HA ))
2.600 0.800 0.800 peak 120 spectrum 1 weight 0.10000E+01 volume 0.41289E-02 ppm1 7.792 ppm2 4.430 CV 1
ASSI { 131}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 36 and name HA ))
2.300 0.700 0.700 peak 131 spectrum 1 weight 0.10000E+01 volume 0.57389E-02 ppm1 8.284 ppm2 4.006 CV 1
ASSI { 143}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 35 and name HG2 ))
2.200 2.200 3.800 peak 143 spectrum 1 weight 0.10000E+01 volume 0.22063E-02 ppm1 1.734 ppm2 1.449 CV 1
ASSI { 176}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 45 and name HB2 ))
5.100 3.300 0.900 peak 176 spectrum 1 weight 0.10000E+01 volume 0.11505E-03 ppm1 3.751 ppm2 3.650 CV 1
ASSI { 177}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HB ))
1.900 0.500 0.500 peak 177 spectrum 1 weight 0.10000E+01 volume 0.20551E-02 ppm1 8.400 ppm2 4.006 CV 1
ASSI { 188}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 46 and name HA ))
2.900 1.100 1.100 peak 188 spectrum 1 weight 0.10000E+01 volume 0.15415E-02 ppm1 7.504 ppm2 4.129 CV 1
ASSI { 190}
(( segid " " and resid 25 and name HZ3 ))
( segid " " and resid 39 and name HG2%)
3.800 3.800 2.200 peak 190 spectrum 1 weight 0.10000E+01 volume 0.10818E-02 ppm1 6.773 ppm2 0.724 CV 1
ASSI { 212}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 13 and name HA ))
4.500 2.500 1.500 peak 212 spectrum 1 weight 0.10000E+01 volume 0.41640E-03 ppm1 4.811 ppm2 4.621 CV 1
ASSI { 213}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HA ))
2.200 0.600 0.600 peak 213 spectrum 1 weight 0.10000E+01 volume 0.24587E-02 ppm1 7.709 ppm2 4.895 CV 1
ASSI { 221}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 40 and name HB% )
4.100 2.100 1.900 peak 221 spectrum 1 weight 0.10000E+01 volume 0.15371E-02 ppm1 8.092 ppm2 1.312 CV 1
ASSI { 236}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HA ))
2.300 0.700 0.700 peak 236 spectrum 1 weight 0.10000E+01 volume 0.26791E-02 ppm1 8.113 ppm2 3.432 CV 1
ASSI { 248}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HA ))
3.000 1.100 1.100 peak 248 spectrum 1 weight 0.10000E+01 volume 0.15013E-02 ppm1 8.154 ppm2 4.416 CV 1
ASSI { 262}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HA1 ))
2.700 0.900 0.900 peak 262 spectrum 1 weight 0.10000E+01 volume 0.19977E-02 ppm1 8.086 ppm2 3.678 CV 1
ASSI { 266}
(( segid " " and resid 7 and name HG2 ))
( segid " " and resid 23 and name HG2%)
4.100 2.100 1.900 peak 266 spectrum 1 weight 0.10000E+01 volume 0.25855E-03 ppm1 1.078 ppm2 0.902 CV 1
ASSI { 280}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HA2 ))
3.000 1.100 1.100 peak 280 spectrum 1 weight 0.10000E+01 volume 0.92431E-03 ppm1 8.092 ppm2 3.869 CV 1
ASSI { 311}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HB2 ))
3.100 1.200 1.200 peak 311 spectrum 1 weight 0.10000E+01 volume 0.14234E-02 ppm1 8.147 ppm2 2.529 CV 1
ASSI { 319}
( segid " " and resid 23 and name HG2%)
( segid " " and resid 8 and name HG2%)
3.900 1.900 1.900 peak 319 spectrum 1 weight 0.10000E+01 volume 0.69385E-04 ppm1 0.873 ppm2 0.697 CV 1
ASSI { 324}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 34 and name HB ))
3.600 1.700 1.700 peak 324 spectrum 1 weight 0.10000E+01 volume 0.16901E-02 ppm1 6.978 ppm2 1.968 CV 1
ASSI { 370}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HN ))
4.600 2.600 1.400 peak 370 spectrum 1 weight 0.10000E+01 volume 0.14359E-03 ppm1 7.901 ppm2 7.807 CV 1
ASSI { 371}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HD1 ))
4.300 2.300 1.700 peak 371 spectrum 1 weight 0.10000E+01 volume 0.57893E-03 ppm1 8.393 ppm2 7.124 CV 1
ASSI { 407}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HA ))
3.000 1.100 1.100 peak 407 spectrum 1 weight 0.10000E+01 volume 0.10581E-02 ppm1 7.511 ppm2 4.238 CV 1
ASSI { 411}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 11 and name HA ))
2.500 0.800 0.800 peak 411 spectrum 1 weight 0.10000E+01 volume 0.13345E-02 ppm1 8.879 ppm2 5.647 CV 1
ASSI { 415}
(( segid " " and resid 19 and name HB2 ))
( segid " " and resid 14 and name HB% )
2.400 2.400 3.600 peak 415 spectrum 1 weight 0.10000E+01 volume 0.11005E-02 ppm1 1.631 ppm2 1.025 CV 1
ASSI { 426}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 20 and name HA ))
3.500 1.500 1.500 peak 426 spectrum 1 weight 0.10000E+01 volume 0.38107E-03 ppm1 4.995 ppm2 4.799 CV 1
ASSI { 436}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HA ))
2.800 1.000 1.000 peak 436 spectrum 1 weight 0.10000E+01 volume 0.15288E-02 ppm1 9.029 ppm2 4.826 CV 1
ASSI { 441}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HA ))
2.800 1.000 1.000 peak 441 spectrum 1 weight 0.10000E+01 volume 0.14346E-02 ppm1 8.851 ppm2 3.664 CV 1
ASSI { 447}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 20 and name HA ))
2.900 2.900 3.100 peak 447 spectrum 1 weight 0.10000E+01 volume 0.42924E-03 ppm1 8.284 ppm2 4.826 CV 1
ASSI { 470}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 34 and name HB ))
5.000 3.100 1.000 peak 470 spectrum 1 weight 0.10000E+01 volume 0.33058E-03 ppm1 4.653 ppm2 1.968 CV 1
ASSI { 471}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HA ))
3.100 1.200 1.200 peak 471 spectrum 1 weight 0.10000E+01 volume 0.65832E-03 ppm1 8.209 ppm2 4.621 CV 1
ASSI { 478}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 19 and name HG2 ))
4.900 3.000 1.100 peak 478 spectrum 1 weight 0.10000E+01 volume 0.25846E-03 ppm1 4.653 ppm2 2.228 CV 1
ASSI { 486}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 19 and name HB2 ))
3.400 1.400 1.400 peak 486 spectrum 1 weight 0.10000E+01 volume 0.64058E-03 ppm1 2.219 ppm2 1.627 CV 1
ASSI { 487}
(( segid " " and resid 32 and name HA ))
( segid " " and resid 40 and name HB% )
4.800 2.800 1.200 peak 487 spectrum 1 weight 0.10000E+01 volume 0.23636E-03 ppm1 4.667 ppm2 1.298 CV 1
ASSI { 494}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 25 and name HH2 ))
3.600 1.600 1.600 peak 494 spectrum 1 weight 0.10000E+01 volume 0.54447E-03 ppm1 7.682 ppm2 6.891 CV 1
ASSI { 505}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HA2 ))
4.100 2.100 1.900 peak 505 spectrum 1 weight 0.10000E+01 volume 0.71344E-03 ppm1 8.544 ppm2 3.883 CV 1
ASSI { 554}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HB2 ))
3.100 1.200 1.200 peak 554 spectrum 1 weight 0.10000E+01 volume 0.94954E-03 ppm1 8.393 ppm2 2.721 CV 1
ASSI { 564}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 5 and name HB ))
3.700 1.700 1.700 peak 564 spectrum 1 weight 0.10000E+01 volume 0.79055E-03 ppm1 3.648 ppm2 1.996 CV 1
ASSI { 565}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HN ))
4.300 2.300 1.700 peak 565 spectrum 1 weight 0.10000E+01 volume 0.81168E-04 ppm1 8.065 ppm2 7.971 CV 1
ASSI { 573}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 13 and name HA ))
4.900 3.000 1.100 peak 573 spectrum 1 weight 0.10000E+01 volume 0.18232E-03 ppm1 4.968 ppm2 4.621 CV 1
ASSI { 610}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 46 and name HG2 ))
3.300 1.300 1.300 peak 610 spectrum 1 weight 0.10000E+01 volume 0.70606E-03 ppm1 8.065 ppm2 2.037 CV 1
ASSI { 622}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 33 and name HB2 ))
5.400 3.600 0.600 peak 622 spectrum 1 weight 0.10000E+01 volume 0.20789E-03 ppm1 4.647 ppm2 2.707 CV 1
ASSI { 625}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HB ))
3.400 1.400 1.400 peak 625 spectrum 1 weight 0.10000E+01 volume 0.59353E-03 ppm1 7.238 ppm2 1.873 CV 1
ASSI { 628}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 19 and name HB2 ))
3.400 1.400 1.400 peak 628 spectrum 1 weight 0.10000E+01 volume 0.77313E-03 ppm1 8.434 ppm2 1.640 CV 1
ASSI { 662}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 6 and name HB2 ))
3.600 3.600 2.400 peak 662 spectrum 1 weight 0.10000E+01 volume 0.78417E-03 ppm1 4.004 ppm2 2.201 CV 1
ASSI { 673}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HB% )
4.700 2.800 1.300 peak 673 spectrum 1 weight 0.10000E+01 volume 0.10714E-03 ppm1 4.182 ppm2 3.869 CV 1
ASSI { 690}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HA1 ))
3.400 1.500 1.500 peak 690 spectrum 1 weight 0.10000E+01 volume 0.31232E-03 ppm1 8.544 ppm2 3.691 CV 1
ASSI { 733}
(( segid " " and resid 46 and name HB2 ))
( segid " " and resid 39 and name HG2%)
3.400 3.400 2.600 peak 733 spectrum 1 weight 0.10000E+01 volume 0.16141E-03 ppm1 1.720 ppm2 0.724 CV 1
ASSI { 750}
( segid " " and resid 38 and name HE% )
( segid " " and resid 38 and name HD% )
1.900 0.400 0.400 peak 750 spectrum 1 weight 0.10000E+01 volume 0.14659E-01 ppm1 6.780 ppm2 7.000 CV 1
ASSI { 753}
( segid " " and resid 21 and name HE% )
( segid " " and resid 21 and name HD% )
2.200 0.600 0.600 peak 753 spectrum 1 weight 0.10000E+01 volume 0.54956E-02 ppm1 6.691 ppm2 6.973 CV 1
ASSI { 760}
(( segid " " and resid 15 and name HA1 ))
(( segid " " and resid 15 and name HA2 ))
1.600 0.300 0.600 peak 760 spectrum 1 weight 0.10000E+01 volume 0.13961E-01 ppm1 3.676 ppm2 3.869 CV 1
ASSI { 783}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 25 and name HZ2 ))
2.500 2.500 3.500 peak 783 spectrum 1 weight 0.10000E+01 volume 0.46336E-02 ppm1 6.957 ppm2 7.411 CV 1
ASSI { 818}
(( segid " " and resid 13 and name HG1 ))
(( segid " " and resid 13 and name HB ))
2.000 0.500 0.500 peak 818 spectrum 1 weight 0.10000E+01 volume 0.35818E-02 ppm1 1.064 ppm2 4.006 CV 1
ASSI { 823}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 18 and name HA ))
2.200 0.600 0.600 peak 823 spectrum 1 weight 0.10000E+01 volume 0.50775E-02 ppm1 1.249 ppm2 4.457 CV 1
ASSI { 828}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 8 and name HA ))
2.600 0.900 0.900 peak 828 spectrum 1 weight 0.10000E+01 volume 0.63772E-02 ppm1 0.674 ppm2 4.061 CV 1
ASSI { 829}
( segid " " and resid 14 and name HB% )
(( segid " " and resid 14 and name HA ))
2.500 0.800 0.800 peak 829 spectrum 1 weight 0.10000E+01 volume 0.37023E-02 ppm1 1.009 ppm2 4.361 CV 1
ASSI { 844}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HA ))
2.600 0.800 0.800 peak 844 spectrum 1 weight 0.10000E+01 volume 0.43676E-02 ppm1 2.883 ppm2 4.457 CV 1
ASSI { 853}
( segid " " and resid 39 and name HG2%)
(( segid " " and resid 34 and name HB ))
2.200 0.600 0.600 peak 853 spectrum 1 weight 0.10000E+01 volume 0.31861E-02 ppm1 0.715 ppm2 1.968 CV 1
ASSI { 876}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 26 and name HA ))
2.600 0.900 0.900 peak 876 spectrum 1 weight 0.10000E+01 volume 0.28828E-02 ppm1 1.679 ppm2 4.006 CV 1
ASSI { 877}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 11 and name HB2 ))
2.400 2.400 3.600 peak 877 spectrum 1 weight 0.10000E+01 volume 0.11858E-02 ppm1 3.436 ppm2 3.787 CV 1
ASSI { 883}
(( segid " " and resid 7 and name HG2 ))
(( segid " " and resid 8 and name HB ))
4.200 2.200 1.800 peak 883 spectrum 1 weight 0.10000E+01 volume 0.14595E-02 ppm1 1.085 ppm2 1.422 CV 1
ASSI { 884}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 5 and name HB ))
2.000 2.000 4.000 peak 884 spectrum 1 weight 0.10000E+01 volume 0.33675E-02 ppm1 0.551 ppm2 1.996 CV 1
ASSI { 890}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 47 and name HA ))
3.000 1.100 1.100 peak 890 spectrum 1 weight 0.10000E+01 volume 0.11814E-02 ppm1 2.684 ppm2 4.238 CV 1
ASSI { 953}
(( segid " " and resid 9 and name HB ))
(( segid " " and resid 23 and name HA ))
3.300 3.300 2.700 peak 953 spectrum 1 weight 0.10000E+01 volume 0.13745E-02 ppm1 1.864 ppm2 4.006 CV 1
ASSI { 963}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 31 and name HA ))
3.000 3.000 3.000 peak 963 spectrum 1 weight 0.10000E+01 volume 0.24007E-02 ppm1 3.450 ppm2 4.908 CV 1
ASSI { 965}
( segid " " and resid 9 and name HG2%)
( segid " " and resid 23 and name HG2%)
2.900 1.100 1.100 peak 965 spectrum 1 weight 0.10000E+01 volume 0.19263E-02 ppm1 0.551 ppm2 0.902 CV 1
ASSI { 982}
(( segid " " and resid 34 and name HB ))
(( segid " " and resid 34 and name HA ))
2.200 0.600 0.600 peak 982 spectrum 1 weight 0.10000E+01 volume 0.25813E-02 ppm1 1.960 ppm2 4.908 CV 1
ASSI { 1016}
(( segid " " and resid 13 and name HG1 ))
(( segid " " and resid 19 and name HB2 ))
3.700 1.700 1.700 peak 1016 spectrum 1 weight 0.10000E+01 volume 0.17567E-02 ppm1 1.044 ppm2 1.627 CV 1
ASSI { 1019}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 46 and name HA ))
2.600 0.900 0.900 peak 1019 spectrum 1 weight 0.10000E+01 volume 0.13670E-02 ppm1 1.727 ppm2 4.129 CV 1
ASSI { 1027}
(( segid " " and resid 8 and name HB ))
(( segid " " and resid 7 and name HA ))
3.300 3.300 2.700 peak 1027 spectrum 1 weight 0.10000E+01 volume 0.19036E-02 ppm1 1.420 ppm2 4.252 CV 1
ASSI { 1052}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 30 and name HB2 ))
4.700 2.700 1.300 peak 1052 spectrum 1 weight 0.10000E+01 volume 0.18854E-03 ppm1 3.047 ppm2 3.773 CV 1
ASSI { 1062}
(( segid " " and resid 46 and name HG2 ))
(( segid " " and resid 37 and name HA ))
2.500 2.500 3.500 peak 1062 spectrum 1 weight 0.10000E+01 volume 0.10018E-02 ppm1 2.021 ppm2 4.184 CV 1
ASSI { 1127}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 39 and name HB ))
4.500 2.500 1.500 peak 1127 spectrum 1 weight 0.10000E+01 volume 0.46358E-03 ppm1 1.235 ppm2 1.886 CV 1
ASSI { 1167}
(( segid " " and resid 25 and name HZ3 ))
(( segid " " and resid 25 and name HZ2 ))
4.300 2.300 1.700 peak 1167 spectrum 1 weight 0.10000E+01 volume 0.54303E-03 ppm1 6.773 ppm2 7.411 CV 1
ASSI { 1173}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 6 and name HA ))
3.500 1.500 1.500 peak 1173 spectrum 1 weight 0.10000E+01 volume 0.90206E-03 ppm1 0.551 ppm2 3.664 CV 1
ASSI { 1204}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 38 and name HN ))
3.400 1.500 1.500 peak 1204 spectrum 1 weight 0.10000E+01 volume 0.80903E-03 ppm1 6.992 ppm2 8.053 CV 1
ASSI { 1212}
(( segid " " and resid 25 and name HD1 ))
(( segid " " and resid 6 and name HD21))
4.000 2.000 2.000 peak 1212 spectrum 1 weight 0.10000E+01 volume 0.23083E-03 ppm1 6.821 ppm2 7.096 CV 1
ASSI { 1243}
(( segid " " and resid 13 and name HB ))
(( segid " " and resid 18 and name HA ))
3.800 1.800 1.800 peak 1243 spectrum 1 weight 0.10000E+01 volume 0.66246E-03 ppm1 3.997 ppm2 4.471 CV 1
ASSI { 1249}
( segid " " and resid 47 and name HE% )
( segid " " and resid 47 and name HD% )
4.600 2.700 1.400 peak 1249 spectrum 1 weight 0.10000E+01 volume 0.78152E-04 ppm1 6.650 ppm2 7.014 CV 1
ASSI { 1289}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 14 and name HA ))
4.600 2.700 1.400 peak 1289 spectrum 1 weight 0.10000E+01 volume 0.71854E-03 ppm1 1.235 ppm2 4.361 CV 1
ASSI { 1297}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 32 and name HA ))
6.000 6.000 0.000 peak 1297 spectrum 1 weight 0.10000E+01 volume 0.46304E-04 ppm1 4.230 ppm2 4.649 CV 1
ASSI { 1314}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 44 and name HB ))
4.200 2.200 1.800 peak 1314 spectrum 1 weight 0.10000E+01 volume 0.28927E-03 ppm1 1.242 ppm2 1.914 CV 1
ASSI { 36}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HA1 ))
2.400 0.700 0.700 peak 36 spectrum 1 weight 0.10000E+01 volume 0.61676E-02 ppm1 7.798 ppm2 3.716 CV 1
ASSI { 84}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HA ))
2.900 1.100 1.100 peak 84 spectrum 1 weight 0.10000E+01 volume 0.26577E-02 ppm1 8.109 ppm2 4.349 CV 1
ASSI { 86}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 18 and name HN ))
3.700 1.700 1.700 peak 86 spectrum 1 weight 0.10000E+01 volume 0.61847E-03 ppm1 8.109 ppm2 7.583 CV 1
ASSI { 89}
(( segid " " and resid 15 and name HN ))
( segid " " and resid 14 and name HB% )
2.600 0.900 0.900 peak 89 spectrum 1 weight 0.10000E+01 volume 0.50897E-02 ppm1 8.109 ppm2 1.021 CV 1
ASSI { 94}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 16 and name HN ))
3.200 1.300 1.300 peak 94 spectrum 1 weight 0.10000E+01 volume 0.13878E-02 ppm1 8.109 ppm2 8.544 CV 1
ASSI { 95}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HN ))
2.700 0.900 0.900 peak 95 spectrum 1 weight 0.10000E+01 volume 0.21827E-02 ppm1 8.109 ppm2 8.403 CV 1
ASSI { 109}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 10 and name HA1 ))
3.200 1.200 1.200 peak 109 spectrum 1 weight 0.10000E+01 volume 0.12462E-02 ppm1 7.305 ppm2 4.091 CV 1
ASSI { 115}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 10 and name HA2 ))
3.700 1.700 1.700 peak 115 spectrum 1 weight 0.10000E+01 volume 0.10387E-02 ppm1 7.305 ppm2 3.763 CV 1
ASSI { 116}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 9 and name HN ))
3.100 1.200 1.200 peak 116 spectrum 1 weight 0.10000E+01 volume 0.17588E-02 ppm1 7.305 ppm2 8.849 CV 1
ASSI { 122}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 18 and name HN ))
2.500 0.800 0.800 peak 122 spectrum 1 weight 0.10000E+01 volume 0.38531E-02 ppm1 8.332 ppm2 7.583 CV 1
ASSI { 124}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 18 and name HB% )
4.600 2.600 1.400 peak 124 spectrum 1 weight 0.10000E+01 volume 0.91228E-03 ppm1 8.332 ppm2 1.232 CV 1
ASSI { 128}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HA1 ))
2.300 0.600 0.600 peak 128 spectrum 1 weight 0.10000E+01 volume 0.61165E-02 ppm1 8.332 ppm2 3.575 CV 1
ASSI { 130}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HA2 ))
2.600 0.800 0.800 peak 130 spectrum 1 weight 0.10000E+01 volume 0.87791E-02 ppm1 8.332 ppm2 3.974 CV 1
ASSI { 132}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HN ))
2.900 1.000 1.000 peak 132 spectrum 1 weight 0.10000E+01 volume 0.14909E-02 ppm1 8.332 ppm2 8.544 CV 1
ASSI { 160}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 3 and name HA2 ))
3.100 1.200 1.200 peak 160 spectrum 1 weight 0.10000E+01 volume 0.27761E-02 ppm1 8.579 ppm2 3.857 CV 1
ASSI { 167}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 4 and name HN ))
4.500 2.600 1.500 peak 167 spectrum 1 weight 0.10000E+01 volume 0.91314E-03 ppm1 8.579 ppm2 8.263 CV 1
ASSI { 230}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HA2 ))
2.900 1.000 1.000 peak 230 spectrum 1 weight 0.10000E+01 volume 0.31362E-02 ppm1 8.573 ppm2 3.763 CV 1
ASSI { 232}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HA1 ))
3.300 1.300 1.300 peak 232 spectrum 1 weight 0.10000E+01 volume 0.32638E-02 ppm1 8.573 ppm2 4.114 CV 1
ASSI { 258}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HN ))
4.500 1.500 1.500 peak 258 spectrum 1 weight 0.10000E+01 volume 0.76375E-03 ppm1 8.232 ppm2 8.872 CV 1
ASSI { 260}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 34 and name HA ))
4.100 2.100 1.900 peak 260 spectrum 1 weight 0.10000E+01 volume 0.14208E-02 ppm1 8.232 ppm2 4.888 CV 1
ASSI { 265}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HB2 ))
2.700 0.900 0.900 peak 265 spectrum 1 weight 0.10000E+01 volume 0.33804E-02 ppm1 7.986 ppm2 3.833 CV 1
ASSI { 269}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 36 and name HN ))
3.100 1.200 1.200 peak 269 spectrum 1 weight 0.10000E+01 volume 0.16013E-02 ppm1 7.986 ppm2 8.286 CV 1
ASSI { 279}
(( segid " " and resid 6 and name HD22))
(( segid " " and resid 6 and name HB2 ))
4.400 2.500 1.600 peak 279 spectrum 1 weight 0.10000E+01 volume 0.79537E-03 ppm1 7.845 ppm2 2.193 CV 1
ASSI { 283}
(( segid " " and resid 6 and name HD22))
(( segid " " and resid 6 and name HD21))
2.100 0.600 0.600 peak 283 spectrum 1 weight 0.10000E+01 volume 0.37098E-02 ppm1 7.845 ppm2 7.068 CV 1
ASSI { 302}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 21 and name HD% )
4.300 2.300 1.700 peak 302 spectrum 1 weight 0.10000E+01 volume 0.66243E-03 ppm1 7.710 ppm2 6.974 CV 1
ASSI { 312}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 38 and name HE% )
3.400 3.400 2.600 peak 312 spectrum 1 weight 0.10000E+01 volume 0.13135E-02 ppm1 7.710 ppm2 6.763 CV 1
ASSI { 315}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 23 and name HG2%)
2.700 2.700 3.300 peak 315 spectrum 1 weight 0.10000E+01 volume 0.85676E-03 ppm1 7.710 ppm2 0.880 CV 1
ASSI { 316}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 25 and name HE1 ))
3.200 1.300 1.300 peak 316 spectrum 1 weight 0.10000E+01 volume 0.18479E-02 ppm1 7.710 ppm2 9.646 CV 1
ASSI { 333}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 25 and name HH2 ))
3.500 3.500 2.500 peak 333 spectrum 1 weight 0.10000E+01 volume 0.61021E-03 ppm1 8.309 ppm2 6.880 CV 1
ASSI { 334}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 6 and name HA ))
2.200 2.200 3.800 peak 334 spectrum 1 weight 0.10000E+01 volume 0.26763E-02 ppm1 8.309 ppm2 3.669 CV 1
ASSI { 336}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 8 and name HB ))
4.600 2.700 1.400 peak 336 spectrum 1 weight 0.10000E+01 volume 0.66997E-03 ppm1 7.558 ppm2 1.419 CV 1
ASSI { 384}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 43 and name HN ))
3.700 1.700 1.700 peak 384 spectrum 1 weight 0.10000E+01 volume 0.90298E-03 ppm1 8.168 ppm2 7.677 CV 1
ASSI { 396}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 12 and name HB2 ))
3.500 1.500 1.500 peak 396 spectrum 1 weight 0.10000E+01 volume 0.79339E-03 ppm1 8.890 ppm2 1.794 CV 1
ASSI { 400}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 19 and name HA ))
4.100 2.100 1.900 peak 400 spectrum 1 weight 0.10000E+01 volume 0.68294E-03 ppm1 8.890 ppm2 4.958 CV 1
ASSI { 403}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 21 and name HA ))
4.100 2.100 1.900 peak 403 spectrum 1 weight 0.10000E+01 volume 0.75675E-03 ppm1 8.890 ppm2 5.193 CV 1
ASSI { 413}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HA ))
2.300 0.600 0.600 peak 413 spectrum 1 weight 0.10000E+01 volume 0.53815E-02 ppm1 8.473 ppm2 4.443 CV 1
ASSI { 414}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HB2 ))
4.300 2.300 1.700 peak 414 spectrum 1 weight 0.10000E+01 volume 0.15521E-02 ppm1 8.473 ppm2 2.872 CV 1
ASSI { 416}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HA ))
2.700 0.900 0.900 peak 416 spectrum 1 weight 0.10000E+01 volume 0.16170E-02 ppm1 8.473 ppm2 3.857 CV 1
ASSI { 419}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 38 and name HD% )
4.100 2.100 1.900 peak 419 spectrum 1 weight 0.10000E+01 volume 0.66103E-03 ppm1 8.473 ppm2 6.997 CV 1
ASSI { 429}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HN ))
3.400 1.400 1.400 peak 429 spectrum 1 weight 0.10000E+01 volume 0.23089E-02 ppm1 8.180 ppm2 8.005 CV 1
ASSI { 436}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HB ))
3.900 1.900 1.900 peak 436 spectrum 1 weight 0.10000E+01 volume 0.14793E-02 ppm1 8.186 ppm2 1.911 CV 1
ASSI { 437}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HB2 ))
3.200 1.200 1.200 peak 437 spectrum 1 weight 0.10000E+01 volume 0.26991E-02 ppm1 8.186 ppm2 3.646 CV 1
ASSI { 438}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HA ))
2.100 0.600 0.600 peak 438 spectrum 1 weight 0.10000E+01 volume 0.55049E-02 ppm1 8.186 ppm2 3.927 CV 1
ASSI { 449}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 3 and name HA2 ))
2.700 0.900 0.900 peak 449 spectrum 1 weight 0.10000E+01 volume 0.36906E-02 ppm1 8.285 ppm2 3.857 CV 1
ASSI { 451}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HA1 ))
2.900 1.100 1.100 peak 451 spectrum 1 weight 0.10000E+01 volume 0.16382E-02 ppm1 7.921 ppm2 3.716 CV 1
ASSI { 452}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 47 and name HB2 ))
3.700 3.700 2.300 peak 452 spectrum 1 weight 0.10000E+01 volume 0.15207E-02 ppm1 7.921 ppm2 2.685 CV 1
ASSI { 458}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HA ))
2.900 1.000 1.000 peak 458 spectrum 1 weight 0.10000E+01 volume 0.27602E-02 ppm1 7.921 ppm2 4.443 CV 1
ASSI { 459}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HB2 ))
2.700 0.900 0.900 peak 459 spectrum 1 weight 0.10000E+01 volume 0.37430E-02 ppm1 7.921 ppm2 2.872 CV 1
ASSI { 470}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 25 and name HZ2 ))
3.700 3.700 2.300 peak 470 spectrum 1 weight 0.10000E+01 volume 0.61992E-03 ppm1 8.285 ppm2 7.396 CV 1
ASSI { 486}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HB ))
3.200 1.300 1.300 peak 486 spectrum 1 weight 0.10000E+01 volume 0.11187E-02 ppm1 7.699 ppm2 1.935 CV 1
ASSI { 526}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 19 and name HA ))
2.600 0.800 0.800 peak 526 spectrum 1 weight 0.10000E+01 volume 0.21896E-02 ppm1 8.461 ppm2 4.958 CV 1
ASSI { 529}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HN ))
4.000 2.000 2.000 peak 529 spectrum 1 weight 0.10000E+01 volume 0.68854E-03 ppm1 8.467 ppm2 7.560 CV 1
ASSI { 538}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 19 and name HG2 ))
4.000 2.000 2.000 peak 538 spectrum 1 weight 0.10000E+01 volume 0.12057E-02 ppm1 8.461 ppm2 2.216 CV 1
ASSI { 558}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 8 and name HA ))
2.600 0.800 0.800 peak 558 spectrum 1 weight 0.10000E+01 volume 0.25015E-02 ppm1 8.860 ppm2 4.044 CV 1
ASSI { 607}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 4 and name HA ))
3.300 1.300 1.300 peak 607 spectrum 1 weight 0.10000E+01 volume 0.14850E-02 ppm1 8.221 ppm2 4.372 CV 1
ASSI { 618}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HB2 ))
2.500 0.800 0.800 peak 618 spectrum 1 weight 0.10000E+01 volume 0.38517E-02 ppm1 8.045 ppm2 3.060 CV 1
ASSI { 621}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 39 and name HN ))
3.500 1.500 1.500 peak 621 spectrum 1 weight 0.10000E+01 volume 0.19570E-02 ppm1 8.045 ppm2 7.232 CV 1
ASSI { 626}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 34 and name HB ))
3.100 1.200 1.200 peak 626 spectrum 1 weight 0.10000E+01 volume 0.14824E-02 ppm1 8.051 ppm2 1.958 CV 1
ASSI { 635}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HA ))
2.300 0.700 0.700 peak 635 spectrum 1 weight 0.10000E+01 volume 0.66536E-02 ppm1 8.098 ppm2 4.138 CV 1
ASSI { 639}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 47 and name HN ))
2.700 0.900 0.900 peak 639 spectrum 1 weight 0.10000E+01 volume 0.26136E-02 ppm1 8.115 ppm2 7.513 CV 1
ASSI { 649}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HB2 ))
3.800 1.800 1.800 peak 649 spectrum 1 weight 0.10000E+01 volume 0.10622E-02 ppm1 8.121 ppm2 3.646 CV 1
ASSI { 676}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HN ))
3.200 1.300 1.300 peak 676 spectrum 1 weight 0.10000E+01 volume 0.83888E-03 ppm1 7.986 ppm2 7.700 CV 1
ASSI { 681}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 18 and name HB% )
2.300 0.700 0.700 peak 681 spectrum 1 weight 0.10000E+01 volume 0.76913E-02 ppm1 7.599 ppm2 1.255 CV 1
ASSI { 682}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 18 and name HA ))
2.600 0.800 0.800 peak 682 spectrum 1 weight 0.10000E+01 volume 0.23516E-02 ppm1 7.593 ppm2 4.443 CV 1
ASSI { 684}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HA1 ))
3.000 1.100 1.100 peak 684 spectrum 1 weight 0.10000E+01 volume 0.14223E-02 ppm1 7.593 ppm2 3.575 CV 1
ASSI { 685}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 13 and name HG1 ))
4.100 2.100 1.900 peak 685 spectrum 1 weight 0.10000E+01 volume 0.10527E-02 ppm1 7.593 ppm2 1.044 CV 1
ASSI { 687}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HB ))
3.100 1.200 1.200 peak 687 spectrum 1 weight 0.10000E+01 volume 0.21172E-02 ppm1 7.992 ppm2 1.911 CV 1
ASSI { 711}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 7 and name HN ))
3.400 1.500 1.500 peak 711 spectrum 1 weight 0.10000E+01 volume 0.70606E-03 ppm1 8.860 ppm2 7.536 CV 1
ASSI { 717}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HB2 ))
3.400 1.500 1.500 peak 717 spectrum 1 weight 0.10000E+01 volume 0.77188E-03 ppm1 8.860 ppm2 2.193 CV 1
ASSI { 726}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 26 and name HB2 ))
3.700 1.700 1.700 peak 726 spectrum 1 weight 0.10000E+01 volume 0.82334E-03 ppm1 9.036 ppm2 1.677 CV 1
ASSI { 756}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HB2 ))
2.800 0.900 0.900 peak 756 spectrum 1 weight 0.10000E+01 volume 0.26526E-02 ppm1 7.517 ppm2 2.685 CV 1
ASSI { 791}
(( segid " " and resid 40 and name HN ))
( segid " " and resid 41 and name HB% )
4.200 2.200 1.800 peak 791 spectrum 1 weight 0.10000E+01 volume 0.81990E-03 ppm1 7.916 ppm2 1.279 CV 1
ASSI { 792}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HA ))
3.100 1.200 1.200 peak 792 spectrum 1 weight 0.10000E+01 volume 0.66712E-03 ppm1 7.921 ppm2 4.068 CV 1
ASSI { 797}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HN ))
3.700 1.700 1.700 peak 797 spectrum 1 weight 0.10000E+01 volume 0.10158E-02 ppm1 8.139 ppm2 7.677 CV 1
ASSI { 803}
(( segid " " and resid 23 and name HN ))
( segid " " and resid 23 and name HG2%)
3.100 1.200 1.200 peak 803 spectrum 1 weight 0.10000E+01 volume 0.19704E-02 ppm1 8.133 ppm2 0.880 CV 1
ASSI { 811}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 7 and name HG2 ))
2.900 2.900 3.100 peak 811 spectrum 1 weight 0.10000E+01 volume 0.16803E-02 ppm1 8.133 ppm2 1.091 CV 1
ASSI { 818}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 10 and name HN ))
3.300 1.400 1.400 peak 818 spectrum 1 weight 0.10000E+01 volume 0.98763E-03 ppm1 7.699 ppm2 7.278 CV 1
ASSI { 825}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HB2 ))
3.800 1.800 1.800 peak 825 spectrum 1 weight 0.10000E+01 volume 0.77866E-03 ppm1 7.699 ppm2 2.286 CV 1
ASSI { 838}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 12 and name HN ))
4.500 2.500 1.500 peak 838 spectrum 1 weight 0.10000E+01 volume 0.72481E-03 ppm1 7.699 ppm2 8.872 CV 1
ASSI { 839}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HA ))
2.600 0.900 0.900 peak 839 spectrum 1 weight 0.10000E+01 volume 0.30267E-02 ppm1 7.699 ppm2 5.193 CV 1
ASSI { 840}
(( segid " " and resid 22 and name HN ))
( segid " " and resid 22 and name HD1%)
3.500 1.600 1.600 peak 840 spectrum 1 weight 0.10000E+01 volume 0.20200E-02 ppm1 7.699 ppm2 0.435 CV 1
ASSI { 870}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 19 and name HA ))
2.300 0.700 0.700 peak 870 spectrum 1 weight 0.10000E+01 volume 0.31292E-02 ppm1 8.420 ppm2 4.958 CV 1
ASSI { 871}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 18 and name HB% )
3.800 1.800 1.800 peak 871 spectrum 1 weight 0.10000E+01 volume 0.12756E-02 ppm1 8.420 ppm2 1.232 CV 1
ASSI { 879}
(( segid " " and resid 25 and name HE1 ))
( segid " " and resid 21 and name HD% )
3.700 3.700 2.300 peak 879 spectrum 1 weight 0.10000E+01 volume 0.18630E-02 ppm1 9.658 ppm2 6.974 CV 1
ASSI { 881}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HA ))
2.800 1.000 1.000 peak 881 spectrum 1 weight 0.10000E+01 volume 0.20967E-02 ppm1 8.420 ppm2 4.349 CV 1
ASSI { 887}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 14 and name HB% )
2.400 0.700 0.700 peak 887 spectrum 1 weight 0.10000E+01 volume 0.63704E-02 ppm1 8.420 ppm2 1.021 CV 1
ASSI { 888}
(( segid " " and resid 25 and name HE1 ))
( segid " " and resid 38 and name HE% )
3.000 3.000 3.000 peak 888 spectrum 1 weight 0.10000E+01 volume 0.31691E-02 ppm1 9.658 ppm2 6.763 CV 1
ASSI { 909}
(( segid " " and resid 33 and name HE1 ))
(( segid " " and resid 11 and name HA ))
3.800 1.800 1.800 peak 909 spectrum 1 weight 0.10000E+01 volume 0.13025E-02 ppm1 9.928 ppm2 5.661 CV 1
ASSI { 912}
(( segid " " and resid 33 and name HE1 ))
(( segid " " and resid 33 and name HZ2 ))
2.600 0.800 0.800 peak 912 spectrum 1 weight 0.10000E+01 volume 0.51286E-02 ppm1 9.928 ppm2 7.232 CV 1
ASSI { 6}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 25 and name HZ3 ))
2.500 2.500 3.500 peak 6 spectrum 1 weight 0.10000E+01 volume 0.12620E-01 ppm1 6.971 ppm2 6.782 CV 1
ASSI { 14}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 47 and name HB2 ))
2.600 2.600 3.400 peak 14 spectrum 1 weight 0.10000E+01 volume 0.78254E-02 ppm1 2.883 ppm2 2.693 CV 1
ASSI { 23}
(( segid " " and resid 3 and name HA2 ))
(( segid " " and resid 5 and name HA ))
2.900 2.900 3.100 peak 23 spectrum 1 weight 0.10000E+01 volume 0.73954E-02 ppm1 3.860 ppm2 3.691 CV 1
ASSI { 31}
(( segid " " and resid 33 and name HE1 ))
(( segid " " and resid 33 and name HD1 ))
2.500 0.800 0.800 peak 31 spectrum 1 weight 0.10000E+01 volume 0.29017E-02 ppm1 9.925 ppm2 7.124 CV 1
ASSI { 45}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HB2 ))
3.200 1.300 1.300 peak 45 spectrum 1 weight 0.10000E+01 volume 0.63573E-03 ppm1 3.860 ppm2 3.760 CV 1
ASSI { 62}
(( segid " " and resid 44 and name HB ))
( segid " " and resid 39 and name HG2%)
3.200 3.200 2.800 peak 62 spectrum 1 weight 0.10000E+01 volume 0.49687E-02 ppm1 1.932 ppm2 0.724 CV 1
ASSI { 63}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 23 and name HA ))
2.200 0.600 0.600 peak 63 spectrum 1 weight 0.10000E+01 volume 0.44705E-02 ppm1 8.086 ppm2 3.979 CV 1
ASSI { 68}
(( segid " " and resid 33 and name HZ2 ))
(( segid " " and resid 33 and name HH2 ))
2.700 0.900 0.900 peak 68 spectrum 1 weight 0.10000E+01 volume 0.25708E-02 ppm1 7.231 ppm2 6.713 CV 1
ASSI { 69}
( segid " " and resid 40 and name HB% )
( segid " " and resid 39 and name HG2%)
3.200 1.300 1.300 peak 69 spectrum 1 weight 0.10000E+01 volume 0.33177E-02 ppm1 1.290 ppm2 0.697 CV 1
ASSI { 75}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HA ))
1.900 1.900 4.100 peak 75 spectrum 1 weight 0.10000E+01 volume 0.41401E-02 ppm1 8.448 ppm2 4.471 CV 1
ASSI { 80}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 45 and name HB2 ))
3.900 1.900 1.900 peak 80 spectrum 1 weight 0.10000E+01 volume 0.27196E-02 ppm1 3.936 ppm2 3.623 CV 1
ASSI { 83}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 46 and name HA ))
2.900 2.900 3.100 peak 83 spectrum 1 weight 0.10000E+01 volume 0.27177E-02 ppm1 8.072 ppm2 4.115 CV 1
ASSI { 84}
(( segid " " and resid 15 and name HN ))
( segid " " and resid 18 and name HB% )
3.200 3.200 2.800 peak 84 spectrum 1 weight 0.10000E+01 volume 0.28273E-02 ppm1 8.086 ppm2 1.257 CV 1
ASSI { 91}
( segid " " and resid 38 and name HD% )
( segid " " and resid 39 and name HG2%)
3.400 3.400 2.600 peak 91 spectrum 1 weight 0.10000E+01 volume 0.26808E-02 ppm1 6.978 ppm2 0.724 CV 1
ASSI { 109}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 39 and name HA ))
2.300 2.300 3.700 peak 109 spectrum 1 weight 0.10000E+01 volume 0.42242E-02 ppm1 8.092 ppm2 4.074 CV 1
ASSI { 120}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HA ))
2.500 0.800 0.800 peak 120 spectrum 1 weight 0.10000E+01 volume 0.34903E-02 ppm1 7.792 ppm2 4.430 CV 1
ASSI { 131}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 36 and name HA ))
2.300 0.600 0.600 peak 131 spectrum 1 weight 0.10000E+01 volume 0.48512E-02 ppm1 8.284 ppm2 4.006 CV 1
ASSI { 176}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 45 and name HB2 ))
5.000 3.100 1.000 peak 176 spectrum 1 weight 0.10000E+01 volume 0.97254E-04 ppm1 3.751 ppm2 3.650 CV 1
ASSI { 177}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HB ))
2.100 0.600 0.600 peak 177 spectrum 1 weight 0.10000E+01 volume 0.17372E-02 ppm1 8.400 ppm2 4.006 CV 1
ASSI { 188}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 46 and name HA ))
2.900 1.100 1.100 peak 188 spectrum 1 weight 0.10000E+01 volume 0.13031E-02 ppm1 7.504 ppm2 4.129 CV 1
ASSI { 190}
(( segid " " and resid 25 and name HZ3 ))
( segid " " and resid 39 and name HG2%)
3.200 3.200 2.800 peak 190 spectrum 1 weight 0.10000E+01 volume 0.91445E-03 ppm1 6.773 ppm2 0.724 CV 1
ASSI { 213}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HA ))
2.300 0.700 0.700 peak 213 spectrum 1 weight 0.10000E+01 volume 0.20784E-02 ppm1 7.709 ppm2 4.895 CV 1
ASSI { 221}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 40 and name HB% )
3.900 1.900 1.900 peak 221 spectrum 1 weight 0.10000E+01 volume 0.12994E-02 ppm1 8.092 ppm2 1.312 CV 1
ASSI { 236}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HA ))
2.300 0.700 0.700 peak 236 spectrum 1 weight 0.10000E+01 volume 0.22648E-02 ppm1 8.113 ppm2 3.432 CV 1
ASSI { 248}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HA ))
3.000 1.100 1.100 peak 248 spectrum 1 weight 0.10000E+01 volume 0.12692E-02 ppm1 8.154 ppm2 4.416 CV 1
ASSI { 262}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HA1 ))
3.000 1.100 1.100 peak 262 spectrum 1 weight 0.10000E+01 volume 0.16888E-02 ppm1 8.086 ppm2 3.678 CV 1
ASSI { 266}
(( segid " " and resid 7 and name HG2 ))
( segid " " and resid 23 and name HG2%)
4.400 2.500 1.600 peak 266 spectrum 1 weight 0.10000E+01 volume 0.21856E-03 ppm1 1.078 ppm2 0.902 CV 1
ASSI { 280}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HA2 ))
3.100 1.200 1.200 peak 280 spectrum 1 weight 0.10000E+01 volume 0.78137E-03 ppm1 8.092 ppm2 3.869 CV 1
ASSI { 295}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 38 and name HA ))
2.800 1.000 1.000 peak 295 spectrum 1 weight 0.10000E+01 volume 0.13641E-02 ppm1 6.985 ppm2 4.238 CV 1
ASSI { 303}
(( segid " " and resid 25 and name HZ3 ))
(( segid " " and resid 31 and name HA ))
3.800 3.800 2.200 peak 303 spectrum 1 weight 0.10000E+01 volume 0.13785E-02 ppm1 6.800 ppm2 4.881 CV 1
ASSI { 309}
(( segid " " and resid 44 and name HA ))
( segid " " and resid 39 and name HG2%)
3.500 1.600 1.600 peak 309 spectrum 1 weight 0.10000E+01 volume 0.99107E-03 ppm1 3.942 ppm2 0.724 CV 1
ASSI { 311}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HB2 ))
3.300 1.300 1.300 peak 311 spectrum 1 weight 0.10000E+01 volume 0.12032E-02 ppm1 8.147 ppm2 2.529 CV 1
ASSI { 319}
( segid " " and resid 23 and name HG2%)
( segid " " and resid 8 and name HG2%)
3.900 1.900 1.900 peak 319 spectrum 1 weight 0.10000E+01 volume 0.58653E-04 ppm1 0.873 ppm2 0.697 CV 1
ASSI { 324}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 34 and name HB ))
3.400 3.400 2.600 peak 324 spectrum 1 weight 0.10000E+01 volume 0.14287E-02 ppm1 6.978 ppm2 1.968 CV 1
ASSI { 342}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 39 and name HB ))
3.500 3.500 2.500 peak 342 spectrum 1 weight 0.10000E+01 volume 0.21820E-02 ppm1 4.018 ppm2 1.873 CV 1
ASSI { 370}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HN ))
4.700 2.800 1.300 peak 370 spectrum 1 weight 0.10000E+01 volume 0.12138E-03 ppm1 7.901 ppm2 7.807 CV 1
ASSI { 371}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HD1 ))
4.300 2.300 1.700 peak 371 spectrum 1 weight 0.10000E+01 volume 0.48937E-03 ppm1 8.393 ppm2 7.124 CV 1
ASSI { 389}
(( segid " " and resid 6 and name HA ))
( segid " " and resid 9 and name HG2%)
3.800 3.800 2.200 peak 389 spectrum 1 weight 0.10000E+01 volume 0.82410E-03 ppm1 3.642 ppm2 0.560 CV 1
ASSI { 407}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HA ))
3.200 1.300 1.300 peak 407 spectrum 1 weight 0.10000E+01 volume 0.89448E-03 ppm1 7.511 ppm2 4.238 CV 1
ASSI { 411}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 11 and name HA ))
2.600 0.900 0.900 peak 411 spectrum 1 weight 0.10000E+01 volume 0.11281E-02 ppm1 8.879 ppm2 5.647 CV 1
ASSI { 415}
(( segid " " and resid 19 and name HB2 ))
( segid " " and resid 14 and name HB% )
3.600 1.600 1.600 peak 415 spectrum 1 weight 0.10000E+01 volume 0.93026E-03 ppm1 1.631 ppm2 1.025 CV 1
ASSI { 419}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 32 and name HB2 ))
4.400 2.400 1.600 peak 419 spectrum 1 weight 0.10000E+01 volume 0.40249E-03 ppm1 4.640 ppm2 3.842 CV 1
ASSI { 426}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 20 and name HA ))
3.600 1.600 1.600 peak 426 spectrum 1 weight 0.10000E+01 volume 0.32213E-03 ppm1 4.995 ppm2 4.799 CV 1
ASSI { 436}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HA ))
3.000 1.100 1.100 peak 436 spectrum 1 weight 0.10000E+01 volume 0.12923E-02 ppm1 9.029 ppm2 4.826 CV 1
ASSI { 439}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 30 and name HB2 ))
4.300 2.400 1.700 peak 439 spectrum 1 weight 0.10000E+01 volume 0.25155E-03 ppm1 4.667 ppm2 3.760 CV 1
ASSI { 441}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HA ))
3.000 1.100 1.100 peak 441 spectrum 1 weight 0.10000E+01 volume 0.12127E-02 ppm1 8.851 ppm2 3.664 CV 1
ASSI { 447}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 20 and name HA ))
2.900 2.900 3.100 peak 447 spectrum 1 weight 0.10000E+01 volume 0.36286E-03 ppm1 8.284 ppm2 4.826 CV 1
ASSI { 466}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 38 and name HB2 ))
5.600 3.900 0.400 peak 466 spectrum 1 weight 0.10000E+01 volume 0.12720E-03 ppm1 4.653 ppm2 3.062 CV 1
ASSI { 470}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 34 and name HB ))
4.000 2.000 2.000 peak 470 spectrum 1 weight 0.10000E+01 volume 0.27945E-03 ppm1 4.653 ppm2 1.968 CV 1
ASSI { 471}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HA ))
3.300 1.400 1.400 peak 471 spectrum 1 weight 0.10000E+01 volume 0.55649E-03 ppm1 8.209 ppm2 4.621 CV 1
ASSI { 478}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 19 and name HG2 ))
4.900 3.000 1.100 peak 478 spectrum 1 weight 0.10000E+01 volume 0.21849E-03 ppm1 4.653 ppm2 2.228 CV 1
ASSI { 486}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 19 and name HB2 ))
3.500 1.500 1.500 peak 486 spectrum 1 weight 0.10000E+01 volume 0.54154E-03 ppm1 2.219 ppm2 1.627 CV 1
ASSI { 494}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 25 and name HH2 ))
3.700 1.700 1.700 peak 494 spectrum 1 weight 0.10000E+01 volume 0.46023E-03 ppm1 7.682 ppm2 6.891 CV 1
ASSI { 505}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HA2 ))
3.600 1.600 1.600 peak 505 spectrum 1 weight 0.10000E+01 volume 0.60311E-03 ppm1 8.544 ppm2 3.883 CV 1
ASSI { 554}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HB2 ))
3.300 1.300 1.300 peak 554 spectrum 1 weight 0.10000E+01 volume 0.80269E-03 ppm1 8.393 ppm2 2.721 CV 1
ASSI { 564}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 5 and name HB ))
2.600 2.600 3.400 peak 564 spectrum 1 weight 0.10000E+01 volume 0.66830E-03 ppm1 3.648 ppm2 1.996 CV 1
ASSI { 565}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HN ))
5.200 3.300 0.800 peak 565 spectrum 1 weight 0.10000E+01 volume 0.68614E-04 ppm1 8.065 ppm2 7.971 CV 1
ASSI { 573}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 13 and name HA ))
5.000 3.100 1.000 peak 573 spectrum 1 weight 0.10000E+01 volume 0.15413E-03 ppm1 4.968 ppm2 4.621 CV 1
ASSI { 622}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 33 and name HB2 ))
5.800 4.100 0.200 peak 622 spectrum 1 weight 0.10000E+01 volume 0.17574E-03 ppm1 4.647 ppm2 2.707 CV 1
ASSI { 625}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HB ))
3.400 1.400 1.400 peak 625 spectrum 1 weight 0.10000E+01 volume 0.50174E-03 ppm1 7.238 ppm2 1.873 CV 1
ASSI { 628}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 19 and name HB2 ))
3.300 1.400 1.400 peak 628 spectrum 1 weight 0.10000E+01 volume 0.65353E-03 ppm1 8.434 ppm2 1.640 CV 1
ASSI { 640}
(( segid " " and resid 25 and name HH2 ))
(( segid " " and resid 33 and name HB2 ))
5.500 3.700 0.500 peak 640 spectrum 1 weight 0.10000E+01 volume 0.28612E-03 ppm1 7.395 ppm2 2.721 CV 1
ASSI { 662}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 6 and name HB2 ))
3.600 1.600 1.600 peak 662 spectrum 1 weight 0.10000E+01 volume 0.66288E-03 ppm1 4.004 ppm2 2.201 CV 1
ASSI { 690}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HA1 ))
3.700 1.700 1.700 peak 690 spectrum 1 weight 0.10000E+01 volume 0.26401E-03 ppm1 8.544 ppm2 3.691 CV 1
ASSI { 733}
(( segid " " and resid 46 and name HB2 ))
( segid " " and resid 39 and name HG2%)
3.400 3.400 2.600 peak 733 spectrum 1 weight 0.10000E+01 volume 0.13645E-03 ppm1 1.720 ppm2 0.724 CV 1
ASSI { 750}
( segid " " and resid 38 and name HE% )
( segid " " and resid 38 and name HD% )
1.900 0.400 0.400 peak 750 spectrum 1 weight 0.10000E+01 volume 0.12392E-01 ppm1 6.780 ppm2 7.000 CV 1
ASSI { 753}
( segid " " and resid 21 and name HE% )
( segid " " and resid 21 and name HD% )
2.200 0.600 0.600 peak 753 spectrum 1 weight 0.10000E+01 volume 0.46457E-02 ppm1 6.691 ppm2 6.973 CV 1
ASSI { 760}
(( segid " " and resid 15 and name HA1 ))
(( segid " " and resid 15 and name HA2 ))
1.600 0.300 0.600 peak 760 spectrum 1 weight 0.10000E+01 volume 0.11802E-01 ppm1 3.676 ppm2 3.869 CV 1
ASSI { 783}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 25 and name HZ2 ))
2.400 2.400 3.600 peak 783 spectrum 1 weight 0.10000E+01 volume 0.39170E-02 ppm1 6.957 ppm2 7.411 CV 1
ASSI { 816}
( segid " " and resid 38 and name HE% )
(( segid " " and resid 47 and name HN ))
2.500 2.500 3.500 peak 816 spectrum 1 weight 0.10000E+01 volume 0.14767E-02 ppm1 6.793 ppm2 7.493 CV 1
ASSI { 818}
(( segid " " and resid 13 and name HG1 ))
(( segid " " and resid 13 and name HB ))
2.000 0.500 0.500 peak 818 spectrum 1 weight 0.10000E+01 volume 0.30278E-02 ppm1 1.064 ppm2 4.006 CV 1
ASSI { 823}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 18 and name HA ))
2.000 0.500 0.500 peak 823 spectrum 1 weight 0.10000E+01 volume 0.42922E-02 ppm1 1.249 ppm2 4.457 CV 1
ASSI { 828}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 8 and name HA ))
2.700 0.900 0.900 peak 828 spectrum 1 weight 0.10000E+01 volume 0.53910E-02 ppm1 0.674 ppm2 4.061 CV 1
ASSI { 829}
( segid " " and resid 14 and name HB% )
(( segid " " and resid 14 and name HA ))
2.500 0.800 0.800 peak 829 spectrum 1 weight 0.10000E+01 volume 0.31298E-02 ppm1 1.009 ppm2 4.361 CV 1
ASSI { 844}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HA ))
2.500 0.800 0.800 peak 844 spectrum 1 weight 0.10000E+01 volume 0.36921E-02 ppm1 2.883 ppm2 4.457 CV 1
ASSI { 853}
( segid " " and resid 39 and name HG2%)
(( segid " " and resid 34 and name HB ))
3.100 1.200 1.200 peak 853 spectrum 1 weight 0.10000E+01 volume 0.26933E-02 ppm1 0.715 ppm2 1.968 CV 1
ASSI { 876}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 26 and name HA ))
2.500 0.800 0.800 peak 876 spectrum 1 weight 0.10000E+01 volume 0.24369E-02 ppm1 1.679 ppm2 4.006 CV 1
ASSI { 877}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 11 and name HB2 ))
4.000 2.000 2.000 peak 877 spectrum 1 weight 0.10000E+01 volume 0.10024E-02 ppm1 3.436 ppm2 3.787 CV 1
ASSI { 883}
(( segid " " and resid 7 and name HG2 ))
(( segid " " and resid 8 and name HB ))
3.200 1.300 1.300 peak 883 spectrum 1 weight 0.10000E+01 volume 0.12338E-02 ppm1 1.085 ppm2 1.422 CV 1
ASSI { 884}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 5 and name HB ))
2.000 2.000 4.000 peak 884 spectrum 1 weight 0.10000E+01 volume 0.28467E-02 ppm1 0.551 ppm2 1.996 CV 1
ASSI { 885}
(( segid " " and resid 13 and name HG1 ))
( segid " " and resid 18 and name HB% )
3.300 1.400 1.400 peak 885 spectrum 1 weight 0.10000E+01 volume 0.35731E-03 ppm1 1.030 ppm2 1.230 CV 1
ASSI { 890}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 47 and name HA ))
3.100 1.200 1.200 peak 890 spectrum 1 weight 0.10000E+01 volume 0.99865E-03 ppm1 2.684 ppm2 4.238 CV 1
ASSI { 963}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 31 and name HA ))
3.200 3.200 2.800 peak 963 spectrum 1 weight 0.10000E+01 volume 0.20294E-02 ppm1 3.450 ppm2 4.908 CV 1
ASSI { 965}
( segid " " and resid 9 and name HG2%)
( segid " " and resid 23 and name HG2%)
3.000 3.000 3.000 peak 965 spectrum 1 weight 0.10000E+01 volume 0.16283E-02 ppm1 0.551 ppm2 0.902 CV 1
ASSI { 982}
(( segid " " and resid 34 and name HB ))
(( segid " " and resid 34 and name HA ))
2.500 0.800 0.800 peak 982 spectrum 1 weight 0.10000E+01 volume 0.21821E-02 ppm1 1.960 ppm2 4.908 CV 1
ASSI { 1016}
(( segid " " and resid 13 and name HG1 ))
(( segid " " and resid 19 and name HB2 ))
3.500 1.500 1.500 peak 1016 spectrum 1 weight 0.10000E+01 volume 0.14849E-02 ppm1 1.044 ppm2 1.627 CV 1
ASSI { 1019}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 46 and name HA ))
3.100 1.200 1.200 peak 1019 spectrum 1 weight 0.10000E+01 volume 0.11556E-02 ppm1 1.727 ppm2 4.129 CV 1
ASSI { 1027}
(( segid " " and resid 8 and name HB ))
(( segid " " and resid 7 and name HA ))
2.200 2.200 3.800 peak 1027 spectrum 1 weight 0.10000E+01 volume 0.16092E-02 ppm1 1.420 ppm2 4.252 CV 1
ASSI { 1052}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 30 and name HB2 ))
5.300 3.600 0.700 peak 1052 spectrum 1 weight 0.10000E+01 volume 0.15938E-03 ppm1 3.047 ppm2 3.773 CV 1
ASSI { 1075}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 46 and name HA ))
2.900 1.000 1.000 peak 1075 spectrum 1 weight 0.10000E+01 volume 0.11375E-02 ppm1 1.748 ppm2 4.061 CV 1
ASSI { 1108}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 21 and name HA ))
6.000 4.500 0.000 peak 1108 spectrum 1 weight 0.10000E+01 volume 0.10244E-03 ppm1 4.653 ppm2 5.182 CV 1
ASSI { 1127}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 39 and name HB ))
4.500 2.500 1.500 peak 1127 spectrum 1 weight 0.10000E+01 volume 0.39188E-03 ppm1 1.235 ppm2 1.886 CV 1
ASSI { 1167}
(( segid " " and resid 25 and name HZ3 ))
(( segid " " and resid 25 and name HZ2 ))
4.500 2.500 1.500 peak 1167 spectrum 1 weight 0.10000E+01 volume 0.45905E-03 ppm1 6.773 ppm2 7.411 CV 1
ASSI { 1204}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 38 and name HN ))
3.700 1.700 1.700 peak 1204 spectrum 1 weight 0.10000E+01 volume 0.68393E-03 ppm1 6.992 ppm2 8.053 CV 1
ASSI { 1210}
(( segid " " and resid 13 and name HG1 ))
(( segid " " and resid 35 and name HB2 ))
4.600 2.600 1.400 peak 1210 spectrum 1 weight 0.10000E+01 volume 0.59331E-03 ppm1 1.044 ppm2 2.721 CV 1
ASSI { 1243}
(( segid " " and resid 13 and name HB ))
(( segid " " and resid 18 and name HA ))
3.600 1.600 1.600 peak 1243 spectrum 1 weight 0.10000E+01 volume 0.56002E-03 ppm1 3.997 ppm2 4.471 CV 1
ASSI { 1249}
( segid " " and resid 47 and name HE% )
( segid " " and resid 47 and name HD% )
4.600 2.700 1.400 peak 1249 spectrum 1 weight 0.10000E+01 volume 0.66066E-04 ppm1 6.650 ppm2 7.014 CV 1
ASSI { 1289}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 14 and name HA ))
4.600 2.700 1.400 peak 1289 spectrum 1 weight 0.10000E+01 volume 0.60741E-03 ppm1 1.235 ppm2 4.361 CV 1
ASSI { 1297}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 32 and name HA ))
5.200 3.400 0.800 peak 1297 spectrum 1 weight 0.10000E+01 volume 0.39143E-04 ppm1 4.230 ppm2 4.649 CV 1
ASSI { 1306}
(( segid " " and resid 39 and name HB ))
(( segid " " and resid 47 and name HB2 ))
3.500 3.500 2.500 peak 1306 spectrum 1 weight 0.10000E+01 volume 0.91666E-03 ppm1 1.891 ppm2 2.707 CV 1
ASSI { 1314}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 44 and name HB ))
4.400 2.400 1.600 peak 1314 spectrum 1 weight 0.10000E+01 volume 0.24453E-03 ppm1 1.242 ppm2 1.914 CV 1
ASSI { 1337}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 47 and name HA ))
4.300 2.400 1.700 peak 1337 spectrum 1 weight 0.10000E+01 volume 0.51846E-03 ppm1 1.755 ppm2 4.238 CV 1
ASSI { 1345}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 38 and name HA ))
5.600 4.000 0.400 peak 1345 spectrum 1 weight 0.10000E+01 volume 0.79903E-04 ppm1 3.778 ppm2 4.238 CV 1
!modified chromo1 noe constraint table 121504
!G3
assign (resid 3 and name HA# )(resid 3 and name HN ) 3.0 1.2 1.0
assign (resid 2 and name HA1 )(resid 3 and name HN ) 4.0 2.2 0.5
!E4
assign (resid 4 and name HB# )(resid 4 and name HN ) 3.5 1.7 1.0
assign (resid 4 and name HA )(resid 4 and name HN ) 4.0 2.2 0.5
assign (resid 4 and name HG# )(resid 4 and name HN ) 3.5 1.7 1.0
assign (resid 3 and name HA )(resid 4 and name HN ) 2.5 0.7 1.0
assign (resid 5 and name HG* )(resid 4 and name HN ) 5.0 3.2 1.5
assign (resid 3 and name HN )(resid 4 and name HN ) 4.0 2.2 0.5
assign (resid 25 and name HZ2 )(resid 4 and name HN ) 5.0 3.2 0.5
assign (resid 24 and name HB# )(resid 4 and name HN ) 6.5 4.7 1.0
!V5
assign (resid 5 and name HA )(resid 5 and name HN ) 4.0 2.2 0.5
assign (resid 4 and name HA )(resid 5 and name HN ) 4.0 2.2 0.5
assign (resid 5 and name HB )(resid 5 and name HN ) 4.0 2.2 0.5
assign (resid 5 and name HG* )(resid 5 and name HN ) 4.0 2.2 1.5
assign (resid 4 and name HB# )(resid 5 and name HN ) 4.0 2.2 1.0
assign (resid 4 and name HG# )(resid 5 and name HN ) 5.0 3.2 1.0
assign (resid 4 and name HN )(resid 5 and name HN ) 5.5 3.7 0.5
!N6
assign (resid 5 and name HA )(resid 6 and name HN ) 3.0 1.2 0.5
assign (resid 6 and name HA )(resid 6 and name HN ) 4.5 2.7 0.5
assign (resid 6 and name HB# )(resid 6 and name HN ) 4.0 2.2 1.0
assign (resid 5 and name HB )(resid 6 and name HN ) 4.0 2.2 1.0
assign (resid 5 and name HG* )(resid 6 and name HN ) 4.0 2.2 1.5
assign (resid 6 and name HD# )(resid 24 and name HB# ) 4.0 2.2 1.0
assign (resid 6 and name HD# )(resid 24 and name HG# ) 4.0 2.2 1.0
assign (resid 6 and name HB# )(resid 6 and name HD# ) 4.0 2.2 1.0
assign (resid 4 and name HB# )(resid 6 and name HN ) 4.5 2.7 1.0
assign (resid 24 and name HB# )(resid 6 and name HN ) 6.0 4.2 1.0
assign (resid 6 and name HD# )(resid 24 and name HA ) 4.0 2.2 0.5
!K7
assign (resid 6 and name HA )(resid 7 and name HN ) 5.0 3.2 0.5
assign (resid 7 and name HA )(resid 7 and name HN ) 4.0 2.2 0.5
assign (resid 7 and name HB# )(resid 7 and name HN ) 4.0 2.2 1.0
assign (resid 7 and name HG# )(resid 7 and name HN ) 5.0 3.2 1.0
assign (resid 6 and name HB# )(resid 7 and name HN ) 4.5 2.7 1.0
assign (resid 6 and name HN )(resid 7 and name HN ) 4.0 2.2 0.5
assign (resid 24 and name HG# )(resid 7 and name HN ) 5.0 3.2 1.0
assign (resid 5 and name HG* )(resid 7 and name HN ) 5.0 3.2 1.5
assign (resid 23 and name HN )(resid 7 and name HN ) 6.5 4.7 0.5
!I8
assign (resid 7 and name HA )(resid 8 and name HN ) 3.0 1.2 0.5
assign (resid 8 and name HA )(resid 8 and name HN ) 4.5 2.7 0.5
assign (resid 8 and name HB )(resid 8 and name HN ) 3.5 1.7 0.5
assign (resid 8 and name HG* )(resid 8 and name HN ) 4.0 2.2 1.5
assign (resid 7 and name HB# )(resid 8 and name HN ) 5.0 3.2 1.0
assign (resid 23 and name HG* )(resid 8 and name HN ) 4.5 2.7 1.5
assign (resid 22 and name HD* )(resid 8 and name HN ) 6.0 4.2 1.5
assign (resid 7 and name HN )(resid 8 and name HN ) 6.0 4.2 0.5
!I9
assign (resid 8 and name HA )(resid 9 and name HN ) 3.0 1.2 0.5
assign (resid 9 and name HA )(resid 9 and name HN ) 5.0 3.2 0.5
assign (resid 9 and name HB )(resid 9 and name HN ) 4.5 2.7 0.5
assign (resid 9 and name HG* )(resid 9 and name HN ) 4.0 2.2 0.5
assign (resid 8 and name HG* )(resid 9 and name HN ) 6.0 3.2 1.5
assign (resid 9 and name HD* )(resid 9 and name HN ) 4.0 2.2 1.5
assign (resid 23 and name HN )(resid 9 and name HN ) 6.5 4.7 0.5
assign (resid 22 and name HD* )(resid 9 and name HN ) 6.0 4.2 1.5
!G10
assign (resid 9 and name HA )(resid 10 and name HN ) 4.0 2.2 0.5
assign (resid 10 and name HA# )(resid 10 and name HN ) 3.8 2.0 0.5
assign (resid 8 and name HG* )(resid 10 and name HN ) 6.0 4.2 1.5
assign (resid 9 and name HN )(resid 10 and name HN ) 4.0 2.2 0.5
assign (resid 21 and name HA )(resid 10 and name HN ) 6.5 4.7 0.5
assign (resid 22 and name HN )(resid 10 and name HN ) 5.0 3.2 0.5
assign (resid 11 and name HN )(resid 10 and name HN ) 6.0 4.2 0.5
assign (resid 21 and name HD# )(resid 10 and name HN ) 6.0 4.2 2.0
assign (resid 24 and name HB# )(resid 10 and name HN ) 5.5 3.7 1.0
assign (resid 8 and name HD# )(resid 10 and name HN ) 4.0 2.2 1.0
assign (resid 22 and name HA )(resid 10 and name HA ) 5.5 3.7 0.5
!S11
assign (resid 10 and name HA# )(resid 11 and name HN ) 3.0 1.2 1.0
assign (resid 11 and name HA )(resid 11 and name HN ) 5.0 3.2 0.5
assign (resid 11 and name HB# )(resid 11 and name HN ) 4.0 2.2 1.0
assign (resid 21 and name HA )(resid 11 and name HN ) 6.0 4.2 0.5
assign (resid 21 and name HE# )(resid 11 and name HA ) 4.0 2.2 2.0
assign (resid 21 and name HD# )(resid 11 and name HA ) 4.5 2.7 2.0
assign (resid 21 and name HA )(resid 11 and name HA ) 6.0 4.2 0.5
assign (resid 21 and name HE# )(resid 11 and name HN ) 5.5 3.7 2.0
assign (resid 21 and name HE# )(resid 11 and name HA ) 3.5 1.7 2.0
assign (resid 21 and name HD# )(resid 11 and name HA ) 4.0 2.2 2.0
assign (resid 33 and name HH2 )(resid 11 and name HN ) 5.0 3.2 0.5
assign (resid 21 and name HD# )(resid 11 and name HN ) 6.5 4.7 2.0
assign (resid 22 and name HN )(resid 11 and name HN ) 6.0 4.2 0.5
assign (resid 12 and name HN )(resid 11 and name HN ) 6.0 4.2 0.5
assign (resid 11 and name HB# )(resid 25 and name HH2 ) 4.0 2.2 1.0
assign (resid 11 and name HB# )(resid 25 and name HZ3 ) 4.0 2.2 1.0
!R12
assign (resid 11 and name HA )(resid 12 and name HN ) 3.0 1.2 0.5
assign (resid 12 and name HA )(resid 12 and name HN ) 4.5 2.7 0.5
assign (resid 11 and name HB# )(resid 12 and name HN ) 3.7 1.9 1.0
assign (resid 12 and name HB# )(resid 12 and name HN ) 4.0 2.2 1.0
assign (resid 12 and name HG# )(resid 12 and name HN ) 5.0 3.2 1.0
assign (resid 21 and name HE# )(resid 12 and name HN ) 4.0 2.2 2.0
assign (resid 21 and name HD# )(resid 12 and name HN ) 5.0 3.2 2.0
assign (resid 33 and name HH2 )(resid 12 and name HN ) 6.0 4.2 0.5
assign (resid 21 and name HA )(resid 12 and name HN ) 5.0 3.2 0.5
assign (resid 19 and name HA )(resid 12 and name HN ) 5.0 3.2 0.5
assign (resid 21 and name HE# )(resid 12 and name HN ) 4.0 2.2 2.0
assign (resid 21 and name HN )(resid 12 and name HN ) 4.0 2.2 0.5
assign (resid 13 and name HN )(resid 12 and name HN ) 5.5 3.7 0.5
assign (resid 20 and name HB# )(resid 12 and name HN ) 5.5 3.7 1.0
!T13
assign (resid 12 and name HA )(resid 13 and name HN ) 3.5 1.7 0.5
assign (resid 13 and name HA )(resid 13 and name HN ) 4.5 2.7 0.5
assign (resid 13 and name HB )(resid 13 and name HN ) 4.0 2.2 0.5
assign (resid 13 and name HG* )(resid 13 and name HN ) 4.0 2.2 1.5
assign (resid 12 and name HB# )(resid 13 and name HN ) 4.0 2.2 1.0
assign (resid 35 and name HB# )(resid 13 and name HN ) 5.0 3.2 1.0
assign (resid 12 and name HG# )(resid 13 and name HN ) 4.0 2.2 1.0
assign (resid 20 and name HN )(resid 13 and name HN ) 5.5 3.7 0.5
assign (resid 34 and name HG# )(resid 13 and name HN ) 5.0 3.2 1.5
assign (resid 14 and name HN )(resid 13 and name HN ) 5.0 3.2 0.5
assign (resid 34 and name HA )(resid 13 and name HN ) 5.5 3.7 0.5
assign (resid 19 and name HA )(resid 13 and name HA ) 3.0 1.2 0.5
assign (resid 19 and name HA )(resid 13 and name HB ) 5.0 3.2 0.5
!A14
assign (resid 13 and name HA )(resid 14 and name HN ) 3.0 1.2 0.5
assign (resid 14 and name HA )(resid 14 and name HN ) 4.0 2.2 0.5
assign (resid 14 and name HB* )(resid 14 and name HN ) 3.5 1.7 1.5
assign (resid 19 and name HA )(resid 14 and name HN ) 4.0 2.2 0.5
assign (resid 13 and name HB )(resid 14 and name HN ) 4.0 2.2 0.5
assign (resid 18 and name HN )(resid 14 and name HN ) 4.5 2.7 0.5
assign (resid 18 and name HB* )(resid 14 and name HN ) 4.0 2.2 1.5
assign (resid 20 and name HN )(resid 14 and name HN ) 5.0 3.2 0.5
assign (resid 20 and name HG# )(resid 14 and name HN ) 5.0 3.2 1.0
assign (resid 20 and name HB# )(resid 14 and name HN ) 5.5 3.7 1.0
assign (resid 34 and name HG# )(resid 14 and name HN ) 5.0 3.2 1.5
!G15
assign (resid 14 and name HA )(resid 15 and name HN ) 3.5 1.7 0.5
assign (resid 15 and name HA# )(resid 15 and name HN ) 3.5 1.7 1.0
assign (resid 14 and name HB* )(resid 15 and name HN ) 3.0 1.2 1.5
assign (resid 14 and name HN )(resid 15 and name HN ) 4.5 2.7 0.5
assign (resid 18 and name HB* )(resid 15 and name HN ) 4.0 2.2 1.5
assign (resid 18 and name HN )(resid 15 and name HN ) 5.0 3.2 0.5
assign (resid 15 and name HN )(resid 16 and name HN ) 4.5 2.7 0.5
assign (resid 15 and name HN )(resid 14 and name HN ) 4.5 2.7 0.5
assign (resid 15 and name HN )(resid 16 and name HB# ) 6.5 4.7 1.0
assign (resid 15 and name HN )(resid 19 and name HB# ) 5.0 3.2 1.0
assign (resid 15 and name HN )(resid 35 and name HG# ) 5.0 3.2 1.0
!E16
assign (resid 15 and name HA# )(resid 16 and name HN ) 3.0 1.2 0.5
assign (resid 16 and name HA )(resid 16 and name HN ) 4.0 2.2 0.5
assign (resid 16 and name HB# )(resid 16 and name HN ) 4.0 2.2 1.0
assign (resid 16 and name HG# )(resid 16 and name HN ) 4.5 2.7 1.0
assign (resid 16 and name HN )(resid 17 and name HN ) 4.5 2.7 0.5
assign (resid 16 and name HN )(resid 18 and name HN ) 5.0 3.2 0.5
assign (resid 16 and name HN )(resid 17 and name HN ) 5.0 3.2 0.5
assign (resid 14 and name HB* )(resid 16 and name HN ) 5.0 3.2 1.5
!G17
assign (resid 16 and name HA )(resid 17 and name HN ) 3.5 1.7 0.5
assign (resid 17 and name HA# )(resid 17 and name HN ) 3.5 1.7 0.5
assign (resid 16 and name HB# )(resid 17 and name HN ) 4.0 2.2 1.0
assign (resid 16 and name HG# )(resid 17 and name HN ) 4.0 2.2 1.0
assign (resid 18 and name HB* )(resid 17 and name HN ) 5.5 3.7 1.5
assign (resid 14 and name HB* )(resid 17 and name HN ) 4.5 2.7 1.5
assign (resid 17 and name HN )(resid 18 and name HN ) 4.0 2.2 0.5
!A18
assign (resid 17 and name HA# )(resid 18 and name HN ) 3.0 1.2 0.5
assign (resid 18 and name HA )(resid 18 and name HN ) 4.0 2.2 0.5
assign (resid 18 and name HB* )(resid 18 and name HN ) 3.5 1.7 1.5
assign (resid 14 and name HB* )(resid 18 and name HN ) 4.0 2.2 1.5
assign (resid 33 and name HD1 )(resid 18 and name HN ) 6.5 4.7 0.5
assign (resid 19 and name HB# )(resid 18 and name HN ) 4.0 2.2 1.0
assign (resid 19 and name HG# )(resid 18 and name HN ) 4.0 2.2 1.0
assign (resid 16 and name HG# )(resid 18 and name HN ) 5.0 3.2 1.0
!M19
assign (resid 18 and name HA )(resid 19 and name HN ) 3.0 1.2 0.5
assign (resid 19 and name HA )(resid 19 and name HN ) 4.0 2.2 0.5
assign (resid 19 and name HB# )(resid 19 and name HN ) 4.0 2.2 1.0
assign (resid 19 and name HG# )(resid 19 and name HN ) 3.5 1.7 1.0
assign (resid 19 and name HN )(resid 18 and name HN ) 4.5 2.7 0.5
assign (resid 14 and name HB* )(resid 19 and name HN ) 4.0 2.2 1.5
assign (resid 19 and name HN )(resid 20 and name HN ) 5.0 3.2 0.5
assign (resid 20 and name HN )(resid 36 and name HN ) 5.5 3.7 0.5
!E20
assign (resid 19 and name HA )(resid 20 and name HN ) 3.0 1.2 0.5
assign (resid 20 and name HA )(resid 20 and name HN ) 4.0 2.2 0.5
assign (resid 20 and name HA )(resid 35 and name HA ) 4.5 2.7 0.5
assign (resid 20 and name HB# )(resid 20 and name HN ) 3.5 1.7 1.0
assign (resid 20 and name HG# )(resid 20 and name HN ) 4.0 2.2 1.0
assign (resid 13 and name HG* )(resid 20 and name HN ) 4.0 2.2 1.5
assign (resid 19 and name HB# )(resid 20 and name HN ) 4.0 2.2 1.0
assign (resid 19 and name HG# )(resid 20 and name HN ) 5.0 3.2 1.0
assign (resid 14 and name HN )(resid 20 and name HN ) 5.0 3.2 0.5
assign (resid 12 and name HN )(resid 20 and name HN ) 4.0 2.2 0.5
assign (resid 11 and name HA )(resid 20 and name HN ) 6.0 4.2 0.5
assign (resid 34 and name HG# )(resid 20 and name HN ) 5.0 3.2 1.5
assign (resid 21 and name HD# )(resid 20 and name HN ) 6.0 3.2 2.0
assign (resid 20 and name HN )(resid 21 and name HN ) 5.0 3.2 0.5
!Y21
assign (resid 20 and name HA )(resid 21 and name HN ) 3.0 1.2 0.5
assign (resid 21 and name HA )(resid 21 and name HN ) 5.0 3.2 0.5
assign (resid 21 and name HB# )(resid 21 and name HN ) 4.0 2.2 1.0
assign (resid 20 and name HB# )(resid 21 and name HN ) 4.5 2.7 1.0
assign (resid 20 and name HG# )(resid 21 and name HN ) 3.8 2.0 1.0
assign (resid 21 and name HA )(resid 21 and name HD# ) 4.0 2.2 2.0
assign (resid 21 and name HN )(resid 21 and name HD# ) 5.0 3.2 2.0
assign (resid 21 and name HA )(resid 21 and name HE# ) 4.5 2.7 2.0
assign (resid 21 and name HB# )(resid 21 and name HD# ) 4.0 2.2 2.0
assign (resid 21 and name HB# )(resid 21 and name HE# ) 5.0 3.2 2.0
assign (resid 21 and name HN )(resid 34 and name HN ) 5.0 3.2 0.5
assign (resid 20 and name HB# )(resid 21 and name HD# ) 4.5 2.7 2.0
assign (resid 34 and name HG# )(resid 21 and name HN ) 5.0 3.2 1.5
!L22
assign (resid 21 and name HA )(resid 22 and name HN ) 3.0 1.2 0.5
assign (resid 22 and name HA )(resid 22 and name HN ) 4.5 2.7 0.5
assign (resid 22 and name HB# )(resid 22 and name HN ) 5.0 3.2 1.0
assign (resid 22 and name HG# )(resid 22 and name HN ) 4.0 2.2 1.0
assign (resid 21 and name HB# )(resid 22 and name HN ) 4.0 2.2 1.0
assign (resid 21 and name HE# )(resid 22 and name HN ) 4.5 2.7 2.0
assign (resid 21 and name HD# )(resid 22 and name HN ) 4.0 2.2 2.0
assign (resid 20 and name HB# )(resid 22 and name HN ) 5.5 3.7 1.0
assign (resid 11 and name HA )(resid 22 and name HN ) 5.0 3.2 0.5
assign (resid 12 and name HN )(resid 22 and name HN ) 5.5 3.7 0.5
assign (resid 10 and name HA# )(resid 22 and name HN ) 5.0 3.2 1.0
assign (resid 23 and name HN )(resid 22 and name HN ) 5.5 3.7 0.5
assign (resid 9 and name HB )(resid 22 and name HN ) 5.0 3.2 0.5
assign (resid 22 and name HA )(resid 34 and name HG* ) 4.5 2.7 2.0
assign (resid 22 and name HA )(resid 32 and name HN ) 4.5 2.7 0.5
!I23
assign (resid 22 and name HA )(resid 23 and name HN ) 3.0 1.2 0.5
assign (resid 23 and name HA )(resid 23 and name HN ) 4.5 2.7 0.5
assign (resid 23 and name HB# )(resid 23 and name HN ) 3.5 1.7 1.0
assign (resid 23 and name HG# )(resid 23 and name HN ) 4.5 2.7 1.0
assign (resid 32 and name HN )(resid 23 and name HN ) 4.5 2.7 0.5
assign (resid 9 and name HD* )(resid 23 and name HN ) 4.0 2.2 1.5
assign (resid 23 and name HG* )(resid 9 and name HN ) 6.0 4.2 1.5
assign (resid 33 and name HA )(resid 23 and name HN ) 6.0 4.2 0.5
assign (resid 34 and name HN )(resid 23 and name HN ) 6.5 4.7 0.5
!E24
assign (resid 23 and name HA )(resid 24 and name HN ) 4.5 2.7 0.5
assign (resid 24 and name HB# )(resid 24 and name HN ) 4.5 2.7 1.0
assign (resid 24 and name HA )(resid 24 and name HN ) 4.5 2.7 0.5
assign (resid 24 and name HG# )(resid 24 and name HN ) 4.0 2.2 1.0
!W25
assign (resid 24 and name HA )(resid 25 and name HN ) 3.0 1.2 0.5
assign (resid 25 and name HA )(resid 25 and name HN ) 4.5 2.7 0.5
assign (resid 25 and name HB# )(resid 25 and name HN ) 3.5 1.7 1.0
!K26
assign (resid 25 and name HA )(resid 26 and name HN ) 4.0 2.2 0.5
assign (resid 26 and name HA )(resid 26 and name HN ) 4.0 2.2 0.5
assign (resid 25 and name HB# )(resid 26 and name HN ) 4.0 2.2 1.0
assign (resid 26 and name HB# )(resid 26 and name HN ) 4.0 2.2 1.0
assign (resid 26 and name HG# )(resid 26 and name HN ) 4.0 2.2 1.0
assign (resid 27 and name HN )(resid 26 and name HN ) 6.0 4.2 0.5
assign (resid 31 and name HD# )(resid 26 and name HN ) 6.0 4.2 1.0
assign (resid 25 and name HB# )(resid 26 and name HN ) 6.0 4.2 1.0
!D27
assign (resid 26 and name HA )(resid 27 and name HN ) 5.0 3.2 0.5
assign (resid 27 and name HA )(resid 27 and name HN ) 3.5 1.7 0.5
assign (resid 27 and name HB# )(resid 27 and name HN ) 4.0 2.2 1.0
assign (resid 26 and name HG# )(resid 27 and name HN ) 4.5 2.7 1.0
assign (resid 26 and name HB# )(resid 27 and name HN ) 4.0 2.2 1.0
assign (resid 27 and name HN )(resid 28 and name HN ) 4.0 2.2 0.5
assign (resid 31 and name HD1 )(resid 27 and name HN ) 4.5 2.7 0.5
assign (resid 25 and name HB# )(resid 27 and name HN ) 4.5 2.7 1.0
assign (resid 25 and name HZ2 )(resid 27 and name HN ) 6.5 4.7 0.5
!G28
assign (resid 27 and name HA )(resid 28 and name HN ) 4.5 2.7 0.5
assign (resid 28 and name HA# )(resid 28 and name HN ) 3.0 1.2 1.0
assign (resid 27 and name HB# )(resid 28 and name HN ) 4.0 2.2 1.0
assign (resid 26 and name HN )(resid 28 and name HN ) 5.5 3.7 0.5
assign (resid 25 and name HB# )(resid 28 and name HN ) 4.0 2.2 1.0
assign (resid 31 and name HD# )(resid 28 and name HN ) 4.5 2.7 1.0
!H29
assign (resid 28 and name HA# )(resid 29 and name HN ) 4.0 2.2 1.0
assign (resid 29 and name HA )(resid 29 and name HN ) 4.0 2.2 0.5
assign (resid 29 and name HB# )(resid 29 and name HN ) 3.5 1.7 1.0
assign (resid 28 and name HN )(resid 29 and name HN ) 3.5 1.7 0.5
assign (resid 29 and name HB# )(resid 29 and name HD2 ) 4.0 2.2 1.0
assign (resid 31 and name HD# )(resid 29 and name HN ) 4.0 2.2 1.0
assign (resid 25 and name HB# )(resid 29 and name HN ) 4.0 2.2 1.0
assign (resid 27 and name HB# )(resid 29 and name HN ) 4.5 2.7 1.0
assign (resid 38 and name HE# )(resid 29 and name HN ) 5.0 3.2 2.0
assign (resid 38 and name HD# )(resid 29 and name HN ) 5.0 3.2 2.0
assign (resid 25 and name HZ2 )(resid 29 and name HN ) 6.0 4.2 0.5
assign (resid 29 and name HN )(resid 30 and name HN ) 5.0 3.2 0.5
!S30
assign (resid 29 and name HA )(resid 30 and name HN ) 3.0 1.2 0.5
assign (resid 30 and name HA )(resid 30 and name HN ) 4.5 2.7 0.5
assign (resid 30 and name HB# )(resid 30 and name HN ) 4.5 2.7 1.0
assign (resid 29 and name HN )(resid 30 and name HN ) 5.0 3.2 0.5
assign (resid 31 and name HD# )(resid 30 and name HN ) 6.0 4.2 1.0
assign (resid 29 and name HB# )(resid 30 and name HN ) 3.0 1.2 1.0
assign (resid 38 and name HD# )(resid 30 and name HN ) 4.5 2.7 2.0
!S32
assign (resid 25 and name HB# )(resid 29 and name HN ) 4.0 2.2 1.0
assign (resid 31 and name HA )(resid 32 and name HN ) 3.5 1.7 0.5
assign (resid 32 and name HA )(resid 32 and name HN ) 4.5 2.7 0.5
assign (resid 32 and name HB# )(resid 32 and name HN ) 4.0 2.2 1.0
assign (resid 25 and name HH2 )(resid 32 and name HN ) 5.0 3.2 0.5
assign (resid 33 and name HN )(resid 32 and name HN ) 5.5 3.7 0.5
assign (resid 25 and name HE1 )(resid 32 and name HN ) 4.0 2.2 0.5
assign (resid 23 and name HG# )(resid 32 and name HN ) 4.5 2.7 1.0
assign (resid 23 and name HD# )(resid 32 and name HN ) 5.0 3.2 1.0
assign (resid 22 and name HA )(resid 32 and name HN ) 5.5 3.7 0.5
assign (resid 21 and name HA )(resid 32 and name HN ) 6.0 4.2 0.5
assign (resid 38 and name HE# )(resid 32 and name HN ) 4.0 2.2 2.0
assign (resid 38 and name HD# )(resid 32 and name HN ) 6.0 4.2 2.0
assign (resid 32 and name HN )(resid 33 and name HN ) 5.0 3.2 0.5
assign (resid 25 and name HE1 )(resid 32 and name HN ) 3.5 1.7 0.5
assign (resid 32 and name HB# )(resid 25 and name HH2 ) 4.0 2.2 0.5
assign (resid 32 and name HB# )(resid 25 and name HZ3 ) 4.5 2.7 0.5
!W33
assign (resid 32 and name HA )(resid 33 and name HN ) 3.5 1.7 0.5
assign (resid 33 and name HA )(resid 33 and name HN ) 4.0 2.2 0.5
assign (resid 33 and name HB# )(resid 33 and name HN ) 4.0 2.2 1.0
assign (resid 32 and name HB )(resid 33 and name HN ) 4.0 2.2 0.5
assign (resid 33 and name HD1 )(resid 33 and name HN ) 4.5 2.7 0.5
assign (resid 33 and name HN )(resid 34 and name HN ) 5.0 3.2 0.5
assign (resid 33 and name HN )(resid 33 and name HE1 ) 6.5 4.7 0.5
assign (resid 21 and name HA )(resid 33 and name HN ) 4.5 2.7 0.5
assign (resid 33 and name HA )(resid 25 and name HH2 ) 4.0 2.2 0.5
assign (resid 33 and name HA )(resid 25 and name HZ3 ) 4.5 2.7 0.5
assign (resid 33 and name HB# )(resid 25 and name HH2 ) 5.5 3.7 0.5
!V34
assign (resid 33 and name HA )(resid 34 and name HN ) 3.5 1.7 0.5
assign (resid 34 and name HA )(resid 34 and name HN ) 4.5 2.7 0.5
assign (resid 34 and name HB )(resid 34 and name HN ) 4.5 2.7 0.5
assign (resid 34 and name HG* )(resid 34 and name HN ) 4.0 2.2 1.5
assign (resid 34 and name HN )(resid 21 and name HE# ) 6.0 4.2 2.0
assign (resid 33 and name HB# )(resid 34 and name HN ) 5.0 3.2 1.0
assign (resid 34 and name HA )(resid 35 and name HD# ) 4.0 2.2 1.0
assign (resid 34 and name HN )(resid 35 and name HD# ) 5.0 3.2 1.0
assign (resid 21 and name HD# )(resid 34 and name HN ) 5.0 3.2 2.0
!S36
assign (resid 35 and name HA )(resid 35 and name HN ) 4.0 2.2 0.5
assign (resid 36 and name HA )(resid 36 and name HN ) 3.5 1.7 0.5
assign (resid 36 and name HB# )(resid 36 and name HN ) 4.0 2.2 0.5
assign (resid 24 and name HB )(resid 36 and name HN ) 4.0 2.2 1.0
assign (resid 25 and name HZ3 )(resid 36 and name HN ) 5.0 3.2 0.5
assign (resid 25 and name HH1 )(resid 36 and name HN ) 5.0 3.2 0.5
assign (resid 36 and name HN )(resid 37 and name HN ) 3.5 1.7 0.5
assign (resid 35 and name HB# )(resid 36 and name HN ) 4.0 2.2 1.0
assign (resid 35 and name HG# )(resid 36 and name HN ) 4.0 2.2 1.0
assign (resid 34 and name HB )(resid 36 and name HN ) 4.5 2.7 0.5
assign (resid 35 and name HB# )(resid 36 and name HN ) 5.0 3.2 1.0
assign (resid 35 and name HG# )(resid 36 and name HN ) 5.0 3.2 1.0
assign (resid 36 and name HN )(resid 19 and name HN ) 6.0 4.2 0.5
assign (resid 36 and name HN )(resid 20 and name HN ) 6.5 4.7 0.5
!S37
assign (resid 36 and name HA )(resid 37 and name HN ) 4.0 2.2 0.5
assign (resid 37 and name HA )(resid 37 and name HN ) 3.5 1.7 0.5
assign (resid 37 and name HB# )(resid 37 and name HN ) 4.0 2.2 1.0
assign (resid 36 and name HB# )(resid 37 and name HN ) 4.0 2.2 1.0
assign (resid 35 and name HB# )(resid 37 and name HN ) 4.0 2.2 1.0
assign (resid 35 and name HB# )(resid 37 and name HN ) 4.0 2.2 1.0
assign (resid 38 and name HD# )(resid 37 and name HN ) 6.5 4.7 2.0
assign (resid 37 and name HN )(resid 38 and name HN ) 5.0 3.2 1.0
assign (resid 35 and name HB# )(resid 37 and name HN ) 5.0 3.2 1.0
assign (resid 35 and name HG# )(resid 37 and name HN ) 5.0 3.2 1.0
assign (resid 34 and name HG* )(resid 38 and name HN ) 5.0 3.2 1.5
!Y38
assign (resid 37 and name HA )(resid 38 and name HN ) 4.0 2.2 0.5
assign (resid 38 and name HA )(resid 38 and name HN ) 4.0 2.2 0.5
assign (resid 38 and name HB# )(resid 38 and name HN ) 4.0 2.2 1.0
assign (resid 37 and name HB# )(resid 38 and name HN ) 4.0 2.2 1.0
assign (resid 38 and name HA )(resid 38 and name HD# ) 4.0 2.2 2.0
assign (resid 38 and name HA )(resid 38 and name HE# ) 5.0 3.2 2.0
assign (resid 38 and name HB# )(resid 38 and name HD# ) 4.0 2.2 1.0
assign (resid 38 and name HB# )(resid 38 and name HE# ) 5.5 3.7 2.0
assign (resid 38 and name HN )(resid 38 and name HD# ) 5.0 3.2 2.0
assign (resid 38 and name HN )(resid 39 and name HN ) 4.0 2.2 0.5
assign (resid 35 and name HB# )(resid 38 and name HN ) 5.0 3.2 1.0
assign (resid 34 and name HB )(resid 38 and name HN ) 5.0 3.2 0.5
assign (resid 34 and name HG* )(resid 38 and name HN ) 5.0 3.2 1.5
!I39
assign (resid 38 and name HA )(resid 39 and name HN ) 5.0 3.2 0.5
assign (resid 39 and name HA )(resid 39 and name HN ) 4.0 2.2 0.5
assign (resid 39 and name HB )(resid 39 and name HN ) 4.0 2.2 0.5
assign (resid 39 and name HG# )(resid 39 and name HN ) 4.5 2.7 1.0
assign (resid 38 and name HB# )(resid 39 and name HN ) 5.0 3.2 1.0
assign (resid 39 and name HN )(resid 40 and name HN ) 4.5 2.7 0.5
assign (resid 41 and name HB* )(resid 39 and name HN ) 5.0 3.2 1.5
!A40
assign (resid 39 and name HA )(resid 40 and name HN ) 4.0 2.2 0.5
assign (resid 40 and name HA )(resid 40 and name HN ) 3.5 1.7 0.5
assign (resid 40 and name HB* )(resid 40 and name HN ) 3.5 1.7 2.0
assign (resid 39 and name HB )(resid 40 and name HN ) 5.0 3.2 0.5
assign (resid 38 and name HB# )(resid 40 and name HN ) 6.0 4.2 1.0
!A41
assign (resid 40 and name HA )(resid 41 and name HN ) 4.0 2.2 0.5
assign (resid 41 and name HA )(resid 41 and name HN ) 4.0 2.2 0.5
assign (resid 40 and name HB* )(resid 41 and name HN ) 3.5 1.7 1.5
assign (resid 41 and name HB* )(resid 41 and name HN ) 4.0 2.2 1.5
!D42
assign (resid 41 and name HA )(resid 42 and name HN ) 3.5 1.7 0.5
assign (resid 42 and name HA )(resid 42 and name HN ) 4.0 2.2 0.5
assign (resid 41 and name HB* )(resid 42 and name HN ) 4.0 2.2 1.5
assign (resid 42 and name HB# )(resid 42 and name HN ) 3.5 1.7 1.0
assign (resid 40 and name HA )(resid 42 and name HN ) 4.0 2.2 0.5
!V43
assign (resid 42 and name HA )(resid 43 and name HN ) 4.0 2.2 0.5
assign (resid 43 and name HA )(resid 43 and name HN ) 4.0 2.2 0.5
assign (resid 43 and name HB )(resid 43 and name HN ) 4.0 2.2 0.5
assign (resid 43 and name HG* )(resid 43 and name HN ) 3.7 1.9 1.5
assign (resid 42 and name HB# )(resid 43 and name HN ) 5.0 3.2 1.0
assign (resid 40 and name HB* )(resid 43 and name HN ) 5.0 3.2 1.5
assign (resid 42 and name HN )(resid 43 and name HN ) 5.0 3.2 0.5
assign (resid 44 and name HN )(resid 43 and name HN ) 5.0 3.2 0.5
!V44
assign (resid 43 and name HA )(resid 44 and name HN ) 3.5 1.7 0.5
assign (resid 44 and name HA )(resid 44 and name HN ) 4.0 2.2 0.5
assign (resid 44 and name HB )(resid 44 and name HN ) 4.0 2.2 0.5
assign (resid 44 and name HG* )(resid 44 and name HN ) 4.0 2.2 1.5
assign (resid 45 and name HN )(resid 44 and name HN ) 5.0 3.2 0.5
!S45
assign (resid 44 and name HA )(resid 45 and name HN ) 3.0 1.2 0.5
assign (resid 45 and name HA )(resid 45 and name HN ) 4.0 2.2 0.5
assign (resid 45 and name HB# )(resid 45 and name HN ) 3.5 1.7 1.0
assign (resid 44 and name HG* )(resid 45 and name HN ) 4.0 2.2 1.5
assign (resid 44 and name HB )(resid 45 and name HN ) 4.0 2.2 1.0
assign (resid 47 and name HD# )(resid 45 and name HN ) 6.5 4.7 2.0
assign (resid 17 and name HN )(resid 45 and name HN ) 6.5 4.7 0.5
assign (resid 35 and name HB# )(resid 45 and name HN ) 5.0 3.2 1.0
!E46
assign (resid 45 and name HA )(resid 46 and name HN ) 3.5 1.7 0.5
assign (resid 46 and name HA )(resid 46 and name HN ) 4.0 2.2 0.5
assign (resid 46 and name HB# )(resid 46 and name HN ) 4.0 2.2 1.0
assign (resid 46 and name HG# )(resid 46 and name HN ) 4.5 2.7 1.0
assign (resid 45 and name HB# )(resid 46 and name HN ) 4.0 2.2 0.5
assign (resid 44 and name HG* )(resid 46 and name HN ) 4.0 2.2 1.5
assign (resid 47 and name HN )(resid 46 and name HN ) 4.0 2.2 0.5
!Y47
assign (resid 46 and name HA )(resid 47 and name HN ) 3.0 1.2 0.5
assign (resid 47 and name HA )(resid 47 and name HN ) 4.5 2.7 0.5
assign (resid 47 and name HB# )(resid 47 and name HN ) 4.0 2.2 1.0
assign (resid 47 and name HB# )(resid 47 and name HN ) 4.0 2.2 1.0
assign (resid 46 and name HB# )(resid 47 and name HN ) 4.0 2.2 1.0
assign (resid 46 and name HG# )(resid 47 and name HN ) 4.0 2.2 1.0
assign (resid 44 and name HG* )(resid 46 and name HN ) 4.0 2.2 1.5
assign (resid 47 and name HD# )(resid 47 and name HN ) 4.0 2.2 2.0
assign (resid 47 and name HE# )(resid 47 and name HN ) 6.0 4.2 2.0
assign (resid 47 and name HB# )(resid 47 and name HD# ) 3.5 1.7 2.0
assign (resid 47 and name HB# )(resid 47 and name HE# ) 6.0 4.2 2.0
assign (resid 47 and name HA )(resid 47 and name HD# ) 4.0 2.2 2.0
assign (resid 47 and name HA )(resid 47 and name HE# ) 6.5 4.7 2.0
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