NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
12133 |
1slj   |
6122 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
ASSI { 3}
( segid " " and resid 12 and name HD1%)
( segid " " and resid 10 and name HB% )
3.500 1.500 1.500 peak 3 spectrum 1 weight 0.11000E+01 volume 0.11520E-02 ppm1 0.811 ppm2 1.417 CV 1
ASSI { 4}
( segid " " and resid 12 and name HD1%)
( segid " " and resid 75 and name HD1%)
2.700 2.700 3.300 peak 4 spectrum 1 weight 0.11000E+01 volume 0.70587E-02 ppm1 0.810 ppm2 0.791 CV 1
ASSI { 7}
( segid " " and resid 17 and name HD1%)
( segid " " and resid 65 and name HD1%)
3.100 1.200 1.200 peak 7 spectrum 1 weight 0.11000E+01 volume 0.14340E-02 ppm1 0.537 ppm2 0.550 CV 1
ASSI { 9}
( segid " " and resid 17 and name HD1%)
( segid " " and resid 71 and name HG2%)
2.900 1.100 1.100 peak 9 spectrum 1 weight 0.11000E+01 volume 0.23502E-02 ppm1 0.533 ppm2 0.379 CV 1
ASSI { 14}
( segid " " and resid 27 and name HB% )
( segid " " and resid 17 and name HD1%)
3.300 1.400 1.400 peak 14 spectrum 1 weight 0.11000E+01 volume 0.23895E-02 ppm1 1.154 ppm2 0.537 CV 1
ASSI { 16}
( segid " " and resid 27 and name HB% )
( segid " " and resid 20 and name HD1%)
3.700 1.700 1.700 peak 16 spectrum 1 weight 0.11000E+01 volume 0.15026E-02 ppm1 1.152 ppm2 0.694 CV 1
ASSI { 21}
( segid " " and resid 29 and name HG2%)
( segid " " and resid 17 and name HD1%)
2.800 1.000 1.000 peak 21 spectrum 1 weight 0.11000E+01 volume 0.30069E-02 ppm1 0.581 ppm2 0.537 CV 1
ASSI { 22}
( segid " " and resid 39 and name HD1%)
( segid " " and resid 89 and name HG2%)
3.100 1.200 1.200 peak 22 spectrum 1 weight 0.11000E+01 volume 0.16260E-02 ppm1 0.606 ppm2 0.974 CV 1
ASSI { 23}
( segid " " and resid 39 and name HD2%)
( segid " " and resid 44 and name HD1%)
3.500 1.600 1.600 peak 23 spectrum 1 weight 0.11000E+01 volume 0.99920E-03 ppm1 0.316 ppm2 0.586 CV 1
ASSI { 24}
( segid " " and resid 39 and name HD2%)
( segid " " and resid 65 and name HD1%)
3.300 3.300 2.700 peak 24 spectrum 1 weight 0.11000E+01 volume 0.15045E-02 ppm1 0.340 ppm2 0.550 CV 1
ASSI { 25}
( segid " " and resid 39 and name HD2%)
( segid " " and resid 71 and name HG2%)
3.900 1.900 1.900 peak 25 spectrum 1 weight 0.11000E+01 volume 0.72168E-03 ppm1 0.317 ppm2 0.379 CV 1
ASSI { 26}
( segid " " and resid 39 and name HD2%)
( segid " " and resid 73 and name HG1%)
3.900 1.900 1.900 peak 26 spectrum 1 weight 0.11000E+01 volume 0.71915E-03 ppm1 0.317 ppm2 0.551 CV 1
ASSI { 27}
( segid " " and resid 41 and name HD1%)
( segid " " and resid 44 and name HD1%)
2.800 1.000 1.000 peak 27 spectrum 1 weight 0.11000E+01 volume 0.21046E-02 ppm1 0.798 ppm2 0.586 CV 1
ASSI { 28}
( segid " " and resid 41 and name HD1%)
( segid " " and resid 44 and name HG2%)
4.000 2.000 2.000 peak 28 spectrum 1 weight 0.11000E+01 volume 0.62550E-03 ppm1 0.798 ppm2 0.833 CV 1
ASSI { 29}
( segid " " and resid 41 and name HD1%)
( segid " " and resid 61 and name HD1%)
3.500 1.600 1.600 peak 29 spectrum 1 weight 0.11000E+01 volume 0.17484E-02 ppm1 0.795 ppm2 0.578 CV 1
ASSI { 30}
( segid " " and resid 41 and name HD1%)
( segid " " and resid 64 and name HG2%)
3.200 1.300 1.300 peak 30 spectrum 1 weight 0.11000E+01 volume 0.18476E-02 ppm1 0.800 ppm2 0.366 CV 1
ASSI { 34}
( segid " " and resid 61 and name HD1%)
( segid " " and resid 27 and name HB% )
2.800 1.000 1.000 peak 34 spectrum 1 weight 0.11000E+01 volume 0.19933E-02 ppm1 0.580 ppm2 1.155 CV 1
ASSI { 35}
( segid " " and resid 61 and name HD1%)
( segid " " and resid 65 and name HD1%)
3.200 1.300 1.300 peak 35 spectrum 1 weight 0.11000E+01 volume 0.12795E-02 ppm1 0.575 ppm2 0.550 CV 1
ASSI { 37}
( segid " " and resid 61 and name HG2%)
( segid " " and resid 44 and name HG2%)
2.800 2.800 3.200 peak 37 spectrum 1 weight 0.11000E+01 volume 0.12112E-01 ppm1 0.879 ppm2 0.833 CV 1
ASSI { 40}
( segid " " and resid 64 and name HG2%)
( segid " " and resid 61 and name HD1%)
4.000 2.000 2.000 peak 40 spectrum 1 weight 0.11000E+01 volume 0.10505E-02 ppm1 0.363 ppm2 0.578 CV 1
ASSI { 41}
( segid " " and resid 64 and name HG2%)
( segid " " and resid 65 and name HD2%)
3.400 3.400 2.600 peak 41 spectrum 1 weight 0.11000E+01 volume 0.52284E-02 ppm1 0.364 ppm2 0.624 CV 1
ASSI { 43}
( segid " " and resid 65 and name HD1%)
( segid " " and resid 27 and name HB% )
3.300 1.300 1.300 peak 43 spectrum 1 weight 0.11000E+01 volume 0.13647E-02 ppm1 0.551 ppm2 1.156 CV 1
ASSI { 45}
( segid " " and resid 65 and name HD1%)
( segid " " and resid 44 and name HD1%)
3.000 1.100 1.100 peak 45 spectrum 1 weight 0.11000E+01 volume 0.15804E-02 ppm1 0.547 ppm2 0.586 CV 1
ASSI { 47}
( segid " " and resid 65 and name HD2%)
( segid " " and resid 17 and name HD1%)
3.000 1.100 1.100 peak 47 spectrum 1 weight 0.11000E+01 volume 0.20449E-02 ppm1 0.625 ppm2 0.537 CV 1
ASSI { 48}
( segid " " and resid 65 and name HD2%)
( segid " " and resid 44 and name HD1%)
3.400 1.500 1.500 peak 48 spectrum 1 weight 0.11000E+01 volume 0.14842E-02 ppm1 0.625 ppm2 0.586 CV 1
ASSI { 49}
( segid " " and resid 65 and name HD2%)
( segid " " and resid 44 and name HG2%)
2.900 1.000 1.000 peak 49 spectrum 1 weight 0.11000E+01 volume 0.11856E-02 ppm1 0.630 ppm2 0.833 CV 1
ASSI { 51}
( segid " " and resid 65 and name HD2%)
( segid " " and resid 93 and name HD2%)
2.600 2.600 3.400 peak 51 spectrum 1 weight 0.11000E+01 volume 0.12177E-01 ppm1 0.627 ppm2 0.867 CV 1
ASSI { 55}
( segid " " and resid 71 and name HG2%)
( segid " " and resid 29 and name HG2%)
3.200 1.300 1.300 peak 55 spectrum 1 weight 0.11000E+01 volume 0.12107E-02 ppm1 0.379 ppm2 0.581 CV 1
ASSI { 60}
( segid " " and resid 73 and name HG1%)
( segid " " and resid 71 and name HG2%)
2.900 1.100 1.100 peak 60 spectrum 1 weight 0.11000E+01 volume 0.22903E-02 ppm1 0.549 ppm2 0.379 CV 1
ASSI { 62}
( segid " " and resid 73 and name HG2%)
( segid " " and resid 29 and name HG1%)
3.300 1.300 1.300 peak 62 spectrum 1 weight 0.11000E+01 volume 0.12214E-02 ppm1 0.586 ppm2 0.567 CV 1
ASSI { 63}
( segid " " and resid 73 and name HG2%)
( segid " " and resid 87 and name HD1%)
3.800 1.800 1.800 peak 63 spectrum 1 weight 0.11000E+01 volume 0.72832E-03 ppm1 0.587 ppm2 0.545 CV 1
ASSI { 65}
( segid " " and resid 75 and name HD1%)
( segid " " and resid 85 and name HB% )
3.000 1.200 1.200 peak 65 spectrum 1 weight 0.11000E+01 volume 0.24347E-02 ppm1 0.788 ppm2 1.476 CV 1
ASSI { 72}
( segid " " and resid 86 and name HB% )
( segid " " and resid 75 and name HG2%)
3.700 1.700 1.700 peak 72 spectrum 1 weight 0.11000E+01 volume 0.14114E-02 ppm1 1.663 ppm2 0.852 CV 1
ASSI { 74}
( segid " " and resid 87 and name HD2%)
( segid " " and resid 85 and name HB% )
2.900 1.000 1.000 peak 74 spectrum 1 weight 0.11000E+01 volume 0.11744E-02 ppm1 0.192 ppm2 1.476 CV 1
ASSI { 76}
( segid " " and resid 91 and name HD1%)
( segid " " and resid 12 and name HD1%)
2.800 1.000 1.000 peak 76 spectrum 1 weight 0.11000E+01 volume 0.13187E-02 ppm1 0.709 ppm2 0.809 CV 1
ASSI { 77}
( segid " " and resid 93 and name HD2%)
( segid " " and resid 71 and name HG1%)
2.900 1.000 1.000 peak 77 spectrum 1 weight 0.11000E+01 volume 0.11549E-02 ppm1 0.869 ppm2 0.318 CV 1
ASSI { 78}
( segid " " and resid 93 and name HD2%)
( segid " " and resid 72 and name HD1%)
3.000 1.100 1.100 peak 78 spectrum 1 weight 0.11000E+01 volume 0.10222E-02 ppm1 0.863 ppm2 0.890 CV 1
ASSI { 3}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 9 and name HA ))
2.300 0.700 0.700 peak 3 spectrum 1 weight 0.11000E+01 volume 0.92713E-02 ppm1 8.299 ppm2 4.342 CV 1
ASSI { 4}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 10 and name HA ))
2.800 1.000 1.000 peak 4 spectrum 1 weight 0.11000E+01 volume 0.32167E-02 ppm1 8.298 ppm2 4.372 CV 1
ASSI { 5}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HA ))
2.600 0.800 0.800 peak 5 spectrum 1 weight 0.11000E+01 volume 0.49961E-02 ppm1 8.299 ppm2 4.372 CV 1
ASSI { 6}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 11 and name HA ))
2.200 0.600 0.600 peak 6 spectrum 1 weight 0.11000E+01 volume 0.11851E-01 ppm1 7.385 ppm2 4.633 CV 1
ASSI { 7}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 12 and name HA ))
2.800 1.000 1.000 peak 7 spectrum 1 weight 0.11000E+01 volume 0.24610E-02 ppm1 7.387 ppm2 4.723 CV 1
ASSI { 9}
(( segid " " and resid 12 and name HN ))
( segid " " and resid 12 and name HD1%)
3.700 1.700 1.700 peak 9 spectrum 1 weight 0.11000E+01 volume 0.16127E-02 ppm1 7.388 ppm2 0.808 CV 1
ASSI { 10}
(( segid " " and resid 12 and name HN ))
( segid " " and resid 12 and name HG2%)
3.300 1.300 1.300 peak 10 spectrum 1 weight 0.11000E+01 volume 0.20303E-02 ppm1 7.382 ppm2 0.778 CV 1
ASSI { 11}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 12 and name HD1%)
3.300 1.400 1.400 peak 11 spectrum 1 weight 0.11000E+01 volume 0.24620E-02 ppm1 9.233 ppm2 0.808 CV 1
ASSI { 12}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 12 and name HG2%)
2.800 1.000 1.000 peak 12 spectrum 1 weight 0.11000E+01 volume 0.39668E-02 ppm1 9.231 ppm2 0.778 CV 1
ASSI { 13}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HA ))
3.000 1.100 1.100 peak 13 spectrum 1 weight 0.11000E+01 volume 0.19180E-02 ppm1 9.233 ppm2 4.911 CV 1
ASSI { 14}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 74 and name HA ))
3.300 1.400 1.400 peak 14 spectrum 1 weight 0.11000E+01 volume 0.11923E-02 ppm1 9.234 ppm2 5.126 CV 1
ASSI { 15}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HA ))
2.100 0.600 0.600 peak 15 spectrum 1 weight 0.11000E+01 volume 0.14692E-01 ppm1 8.737 ppm2 4.911 CV 1
ASSI { 16}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HA ))
2.200 0.600 0.600 peak 16 spectrum 1 weight 0.11000E+01 volume 0.97148E-02 ppm1 9.052 ppm2 4.849 CV 1
ASSI { 17}
(( segid " " and resid 15 and name HN ))
( segid " " and resid 71 and name HG2%)
3.200 1.300 1.300 peak 17 spectrum 1 weight 0.11000E+01 volume 0.15935E-02 ppm1 9.052 ppm2 0.379 CV 1
ASSI { 18}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 72 and name HA ))
3.500 1.600 1.600 peak 18 spectrum 1 weight 0.11000E+01 volume 0.15887E-02 ppm1 9.052 ppm2 4.912 CV 1
ASSI { 20}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HA ))
2.100 0.600 0.600 peak 20 spectrum 1 weight 0.11000E+01 volume 0.76925E-02 ppm1 8.819 ppm2 5.256 CV 1
ASSI { 23}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 18 and name HB ))
3.800 1.800 1.800 peak 23 spectrum 1 weight 0.11000E+01 volume 0.10896E-02 ppm1 9.219 ppm2 4.218 CV 1
ASSI { 24}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HA ))
3.100 1.200 1.200 peak 24 spectrum 1 weight 0.11000E+01 volume 0.21466E-02 ppm1 7.400 ppm2 4.520 CV 1
ASSI { 25}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HB ))
3.600 1.600 1.600 peak 25 spectrum 1 weight 0.11000E+01 volume 0.14822E-02 ppm1 7.404 ppm2 4.218 CV 1
ASSI { 26}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 19 and name HA ))
2.500 0.800 0.800 peak 26 spectrum 1 weight 0.11000E+01 volume 0.41411E-02 ppm1 7.400 ppm2 4.747 CV 1
ASSI { 27}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 19 and name HA ))
2.100 0.500 0.500 peak 27 spectrum 1 weight 0.11000E+01 volume 0.14543E-01 ppm1 9.375 ppm2 4.747 CV 1
ASSI { 28}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 20 and name HA ))
2.900 1.000 1.000 peak 28 spectrum 1 weight 0.11000E+01 volume 0.20865E-02 ppm1 9.373 ppm2 4.272 CV 1
ASSI { 31}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 23 and name HA ))
3.400 1.400 1.400 peak 31 spectrum 1 weight 0.11000E+01 volume 0.98558E-03 ppm1 7.303 ppm2 4.371 CV 1
ASSI { 32}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 24 and name HA ))
2.900 1.000 1.000 peak 32 spectrum 1 weight 0.11000E+01 volume 0.22065E-02 ppm1 7.309 ppm2 4.649 CV 1
ASSI { 33}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 22 and name HA ))
3.000 1.100 1.100 peak 33 spectrum 1 weight 0.11000E+01 volume 0.17432E-02 ppm1 7.975 ppm2 4.203 CV 1
ASSI { 34}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 23 and name HA ))
3.800 1.800 1.800 peak 34 spectrum 1 weight 0.11000E+01 volume 0.85746E-03 ppm1 7.989 ppm2 4.371 CV 1
ASSI { 35}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 25 and name HA ))
2.200 0.600 0.600 peak 35 spectrum 1 weight 0.11000E+01 volume 0.73373E-02 ppm1 7.979 ppm2 3.791 CV 1
ASSI { 37}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HA ))
2.400 0.700 0.700 peak 37 spectrum 1 weight 0.11000E+01 volume 0.47954E-02 ppm1 7.330 ppm2 3.791 CV 1
ASSI { 38}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 26 and name HA ))
2.600 0.900 0.900 peak 38 spectrum 1 weight 0.11000E+01 volume 0.28899E-02 ppm1 7.330 ppm2 4.646 CV 1
ASSI { 39}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 40 and name HA ))
4.400 2.400 1.600 peak 39 spectrum 1 weight 0.11000E+01 volume 0.70984E-03 ppm1 7.317 ppm2 4.426 CV 1
ASSI { 40}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 26 and name HA ))
2.300 0.700 0.700 peak 40 spectrum 1 weight 0.11000E+01 volume 0.64509E-02 ppm1 8.172 ppm2 4.646 CV 1
ASSI { 43}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 20 and name HA ))
3.300 1.400 1.400 peak 43 spectrum 1 weight 0.11000E+01 volume 0.17529E-02 ppm1 8.987 ppm2 4.272 CV 1
ASSI { 44}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HA ))
2.300 0.600 0.600 peak 44 spectrum 1 weight 0.11000E+01 volume 0.71402E-02 ppm1 8.988 ppm2 5.003 CV 1
ASSI { 45}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HA ))
2.900 1.100 1.100 peak 45 spectrum 1 weight 0.11000E+01 volume 0.20087E-02 ppm1 8.989 ppm2 5.606 CV 1
ASSI { 46}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HA ))
2.400 0.700 0.700 peak 46 spectrum 1 weight 0.11000E+01 volume 0.70129E-02 ppm1 8.996 ppm2 5.606 CV 1
ASSI { 47}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HA ))
3.100 1.200 1.200 peak 47 spectrum 1 weight 0.11000E+01 volume 0.13793E-02 ppm1 8.996 ppm2 4.655 CV 1
ASSI { 48}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HA ))
2.200 0.600 0.600 peak 48 spectrum 1 weight 0.11000E+01 volume 0.77116E-02 ppm1 8.983 ppm2 4.655 CV 1
ASSI { 49}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HA ))
3.100 1.200 1.200 peak 49 spectrum 1 weight 0.11000E+01 volume 0.15809E-02 ppm1 8.983 ppm2 5.078 CV 1
ASSI { 50}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HA ))
2.300 0.700 0.700 peak 50 spectrum 1 weight 0.11000E+01 volume 0.66544E-02 ppm1 9.022 ppm2 5.078 CV 1
ASSI { 51}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 31 and name HA ))
3.000 1.200 1.200 peak 51 spectrum 1 weight 0.11000E+01 volume 0.16592E-02 ppm1 9.022 ppm2 5.274 CV 1
ASSI { 52}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HA ))
2.900 1.100 1.100 peak 52 spectrum 1 weight 0.11000E+01 volume 0.22179E-02 ppm1 8.249 ppm2 5.274 CV 1
ASSI { 55}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 33 and name HA ))
2.900 1.000 1.000 peak 55 spectrum 1 weight 0.11000E+01 volume 0.23769E-02 ppm1 8.711 ppm2 4.480 CV 1
ASSI { 56}
(( segid " " and resid 34 and name HN ))
( segid " " and resid 33 and name HB% )
2.800 1.000 1.000 peak 56 spectrum 1 weight 0.11000E+01 volume 0.28886E-02 ppm1 8.713 ppm2 1.109 CV 1
ASSI { 57}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 34 and name HA ))
3.200 1.300 1.300 peak 57 spectrum 1 weight 0.11000E+01 volume 0.15398E-02 ppm1 8.711 ppm2 3.931 CV 1
ASSI { 58}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 33 and name HA ))
4.500 2.500 1.500 peak 58 spectrum 1 weight 0.11000E+01 volume 0.81284E-03 ppm1 7.688 ppm2 4.480 CV 1
ASSI { 59}
(( segid " " and resid 35 and name HN ))
( segid " " and resid 33 and name HB% )
2.700 0.900 0.900 peak 59 spectrum 1 weight 0.11000E+01 volume 0.47840E-02 ppm1 7.689 ppm2 1.109 CV 1
ASSI { 60}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 34 and name HA ))
3.200 1.200 1.200 peak 60 spectrum 1 weight 0.11000E+01 volume 0.21667E-02 ppm1 7.690 ppm2 3.931 CV 1
ASSI { 61}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 35 and name HA ))
2.700 0.900 0.900 peak 61 spectrum 1 weight 0.11000E+01 volume 0.37362E-02 ppm1 7.689 ppm2 4.533 CV 1
ASSI { 62}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 35 and name HA ))
3.300 1.400 1.400 peak 62 spectrum 1 weight 0.11000E+01 volume 0.12311E-02 ppm1 8.841 ppm2 4.533 CV 1
ASSI { 63}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 36 and name HA ))
2.400 0.700 0.700 peak 63 spectrum 1 weight 0.11000E+01 volume 0.45478E-02 ppm1 9.798 ppm2 5.087 CV 1
ASSI { 64}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HA ))
3.200 1.200 1.200 peak 64 spectrum 1 weight 0.11000E+01 volume 0.13137E-02 ppm1 9.136 ppm2 4.616 CV 1
ASSI { 65}
(( segid " " and resid 38 and name HN ))
( segid " " and resid 85 and name HB% )
3.600 1.600 1.600 peak 65 spectrum 1 weight 0.11000E+01 volume 0.11049E-02 ppm1 9.131 ppm2 1.476 CV 1
ASSI { 66}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 86 and name HA ))
3.100 1.200 1.200 peak 66 spectrum 1 weight 0.11000E+01 volume 0.14072E-02 ppm1 9.144 ppm2 4.955 CV 1
ASSI { 67}
(( segid " " and resid 38 and name HN ))
( segid " " and resid 87 and name HD1%)
3.300 1.400 1.400 peak 67 spectrum 1 weight 0.11000E+01 volume 0.13004E-02 ppm1 9.130 ppm2 0.545 CV 1
ASSI { 68}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 26 and name HA ))
3.700 1.700 1.700 peak 68 spectrum 1 weight 0.11000E+01 volume 0.13200E-02 ppm1 8.887 ppm2 4.646 CV 1
ASSI { 69}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 38 and name HA ))
2.300 0.700 0.700 peak 69 spectrum 1 weight 0.11000E+01 volume 0.72531E-02 ppm1 8.892 ppm2 4.616 CV 1
ASSI { 70}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HA ))
3.100 1.200 1.200 peak 70 spectrum 1 weight 0.11000E+01 volume 0.12084E-02 ppm1 8.894 ppm2 4.986 CV 1
ASSI { 71}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 26 and name HA ))
2.700 0.900 0.900 peak 71 spectrum 1 weight 0.11000E+01 volume 0.23030E-02 ppm1 8.481 ppm2 4.646 CV 1
ASSI { 73}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HA ))
2.800 1.000 1.000 peak 73 spectrum 1 weight 0.11000E+01 volume 0.20372E-02 ppm1 8.477 ppm2 3.924 CV 1
ASSI { 74}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 40 and name HA ))
3.800 1.800 1.800 peak 74 spectrum 1 weight 0.11000E+01 volume 0.94280E-03 ppm1 8.763 ppm2 4.426 CV 1
ASSI { 75}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HA ))
2.600 0.800 0.800 peak 75 spectrum 1 weight 0.11000E+01 volume 0.46078E-02 ppm1 8.763 ppm2 4.314 CV 1
ASSI { 76}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 42 and name HA ))
2.900 1.100 1.100 peak 76 spectrum 1 weight 0.11000E+01 volume 0.21863E-02 ppm1 7.889 ppm2 4.314 CV 1
ASSI { 77}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HA ))
2.900 1.000 1.000 peak 77 spectrum 1 weight 0.11000E+01 volume 0.26807E-02 ppm1 7.889 ppm2 4.972 CV 1
ASSI { 78}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 42 and name HA ))
3.200 1.300 1.300 peak 78 spectrum 1 weight 0.11000E+01 volume 0.16702E-02 ppm1 7.688 ppm2 4.314 CV 1
ASSI { 79}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HA ))
3.000 1.100 1.100 peak 79 spectrum 1 weight 0.11000E+01 volume 0.23332E-02 ppm1 7.689 ppm2 4.972 CV 1
ASSI { 80}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HA ))
2.900 1.100 1.100 peak 80 spectrum 1 weight 0.11000E+01 volume 0.17924E-02 ppm1 7.692 ppm2 3.802 CV 1
ASSI { 81}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HA ))
2.500 0.800 0.800 peak 81 spectrum 1 weight 0.11000E+01 volume 0.40862E-02 ppm1 7.835 ppm2 3.802 CV 1
ASSI { 83}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HA ))
2.300 0.700 0.700 peak 83 spectrum 1 weight 0.11000E+01 volume 0.75830E-02 ppm1 8.488 ppm2 4.100 CV 1
ASSI { 84}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 46 and name HA ))
2.700 0.900 0.900 peak 84 spectrum 1 weight 0.11000E+01 volume 0.32749E-02 ppm1 8.487 ppm2 3.377 CV 1
ASSI { 85}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 46 and name HA ))
3.400 1.400 1.400 peak 85 spectrum 1 weight 0.11000E+01 volume 0.11191E-02 ppm1 8.901 ppm2 3.377 CV 1
ASSI { 86}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HA ))
2.800 1.000 1.000 peak 86 spectrum 1 weight 0.11000E+01 volume 0.27414E-02 ppm1 8.899 ppm2 4.078 CV 1
ASSI { 87}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 48 and name HA ))
2.800 1.000 1.000 peak 87 spectrum 1 weight 0.11000E+01 volume 0.32172E-02 ppm1 7.803 ppm2 4.358 CV 1
ASSI { 88}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 48 and name HA ))
2.900 1.100 1.100 peak 88 spectrum 1 weight 0.11000E+01 volume 0.33832E-02 ppm1 7.911 ppm2 4.358 CV 1
ASSI { 89}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 49 and name HA ))
2.500 0.800 0.800 peak 89 spectrum 1 weight 0.11000E+01 volume 0.39398E-02 ppm1 7.911 ppm2 4.772 CV 1
ASSI { 90}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 50 and name HA ))
2.600 0.800 0.800 peak 90 spectrum 1 weight 0.11000E+01 volume 0.33757E-02 ppm1 8.746 ppm2 4.570 CV 1
ASSI { 91}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 51 and name HA ))
3.200 1.300 1.300 peak 91 spectrum 1 weight 0.11000E+01 volume 0.13776E-02 ppm1 8.743 ppm2 4.214 CV 1
ASSI { 92}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 51 and name HA ))
3.200 1.200 1.200 peak 92 spectrum 1 weight 0.11000E+01 volume 0.17473E-02 ppm1 8.538 ppm2 4.214 CV 1
ASSI { 93}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 52 and name HA ))
3.000 1.200 1.200 peak 93 spectrum 1 weight 0.11000E+01 volume 0.22419E-02 ppm1 8.537 ppm2 4.655 CV 1
ASSI { 94}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 51 and name HA ))
3.400 1.400 1.400 peak 94 spectrum 1 weight 0.11000E+01 volume 0.10518E-02 ppm1 7.769 ppm2 4.214 CV 1
ASSI { 95}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 52 and name HA ))
2.800 1.000 1.000 peak 95 spectrum 1 weight 0.11000E+01 volume 0.36316E-02 ppm1 7.767 ppm2 4.655 CV 1
ASSI { 96}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 53 and name HA ))
2.700 0.900 0.900 peak 96 spectrum 1 weight 0.11000E+01 volume 0.38505E-02 ppm1 7.768 ppm2 4.424 CV 1
ASSI { 97}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 53 and name HA ))
2.900 1.000 1.000 peak 97 spectrum 1 weight 0.11000E+01 volume 0.20100E-02 ppm1 8.024 ppm2 4.424 CV 1
ASSI { 98}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 54 and name HA ))
3.500 1.600 1.600 peak 98 spectrum 1 weight 0.11000E+01 volume 0.74947E-03 ppm1 8.031 ppm2 4.335 CV 1
ASSI { 100}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 59 and name HA ))
2.100 0.600 0.600 peak 100 spectrum 1 weight 0.11000E+01 volume 0.12720E-01 ppm1 8.301 ppm2 4.543 CV 1
ASSI { 101}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 60 and name HA ))
2.900 1.000 1.000 peak 101 spectrum 1 weight 0.11000E+01 volume 0.23385E-02 ppm1 8.301 ppm2 4.967 CV 1
ASSI { 102}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 60 and name HA ))
2.400 0.700 0.700 peak 102 spectrum 1 weight 0.11000E+01 volume 0.49213E-02 ppm1 9.568 ppm2 4.967 CV 1
ASSI { 103}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 61 and name HA ))
2.900 1.100 1.100 peak 103 spectrum 1 weight 0.11000E+01 volume 0.14903E-02 ppm1 9.565 ppm2 3.789 CV 1
ASSI { 104}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 60 and name HA ))
3.600 1.600 1.600 peak 104 spectrum 1 weight 0.11000E+01 volume 0.10903E-02 ppm1 8.301 ppm2 4.967 CV 1
ASSI { 105}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 61 and name HA ))
3.000 1.200 1.200 peak 105 spectrum 1 weight 0.11000E+01 volume 0.17539E-02 ppm1 8.300 ppm2 3.789 CV 1
ASSI { 106}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 62 and name HA ))
2.500 0.800 0.800 peak 106 spectrum 1 weight 0.11000E+01 volume 0.54508E-02 ppm1 8.299 ppm2 4.175 CV 1
ASSI { 107}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 61 and name HA ))
3.400 1.500 1.500 peak 107 spectrum 1 weight 0.11000E+01 volume 0.10167E-02 ppm1 7.832 ppm2 3.789 CV 1
ASSI { 108}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 62 and name HA ))
3.100 1.200 1.200 peak 108 spectrum 1 weight 0.11000E+01 volume 0.18791E-02 ppm1 7.833 ppm2 4.175 CV 1
ASSI { 109}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 63 and name HA ))
2.700 0.900 0.900 peak 109 spectrum 1 weight 0.11000E+01 volume 0.45066E-02 ppm1 7.833 ppm2 4.730 CV 1
ASSI { 110}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 64 and name HA ))
4.100 2.100 1.900 peak 110 spectrum 1 weight 0.11000E+01 volume 0.71860E-03 ppm1 7.836 ppm2 3.841 CV 1
ASSI { 113}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 63 and name HA ))
3.100 1.200 1.200 peak 113 spectrum 1 weight 0.11000E+01 volume 0.16365E-02 ppm1 7.181 ppm2 4.730 CV 1
ASSI { 115}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 62 and name HA ))
3.200 3.200 2.800 peak 115 spectrum 1 weight 0.11000E+01 volume 0.64798E-03 ppm1 7.148 ppm2 4.175 CV 1
ASSI { 116}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 64 and name HA ))
3.400 1.500 1.500 peak 116 spectrum 1 weight 0.11000E+01 volume 0.14779E-02 ppm1 7.144 ppm2 3.841 CV 1
ASSI { 117}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 65 and name HA ))
3.000 1.100 1.100 peak 117 spectrum 1 weight 0.11000E+01 volume 0.14051E-02 ppm1 7.147 ppm2 5.115 CV 1
ASSI { 119}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 66 and name HA ))
2.600 0.900 0.900 peak 119 spectrum 1 weight 0.11000E+01 volume 0.33873E-02 ppm1 8.016 ppm2 4.577 CV 1
ASSI { 120}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 66 and name HA ))
2.000 0.500 0.500 peak 120 spectrum 1 weight 0.11000E+01 volume 0.14709E-01 ppm1 9.043 ppm2 4.577 CV 1
ASSI { 121}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HA ))
2.500 0.800 0.800 peak 121 spectrum 1 weight 0.11000E+01 volume 0.40034E-02 ppm1 9.042 ppm2 3.646 CV 1
ASSI { 122}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 18 and name HA ))
3.500 1.500 1.500 peak 122 spectrum 1 weight 0.11000E+01 volume 0.94212E-03 ppm1 9.235 ppm2 4.520 CV 1
ASSI { 123}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 66 and name HA ))
3.200 3.200 2.800 peak 123 spectrum 1 weight 0.11000E+01 volume 0.60485E-03 ppm1 9.234 ppm2 4.577 CV 1
ASSI { 126}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 69 and name HA ))
2.500 0.800 0.800 peak 126 spectrum 1 weight 0.11000E+01 volume 0.42491E-02 ppm1 7.719 ppm2 4.221 CV 1
ASSI { 127}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 69 and name HA ))
2.000 0.500 0.500 peak 127 spectrum 1 weight 0.11000E+01 volume 0.13196E-01 ppm1 8.680 ppm2 4.221 CV 1
ASSI { 129}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 70 and name HA ))
2.100 0.600 0.600 peak 129 spectrum 1 weight 0.11000E+01 volume 0.86355E-02 ppm1 8.605 ppm2 5.230 CV 1
ASSI { 130}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 71 and name HA ))
3.000 3.000 3.000 peak 130 spectrum 1 weight 0.11000E+01 volume 0.16704E-02 ppm1 8.606 ppm2 4.777 CV 1
ASSI { 131}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 71 and name HA ))
2.300 2.300 3.700 peak 131 spectrum 1 weight 0.11000E+01 volume 0.61965E-02 ppm1 7.287 ppm2 4.777 CV 1
ASSI { 133}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 14 and name HA ))
3.500 1.500 1.500 peak 133 spectrum 1 weight 0.11000E+01 volume 0.96231E-03 ppm1 9.068 ppm2 4.849 CV 1
ASSI { 134}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 72 and name HA ))
2.200 0.600 0.600 peak 134 spectrum 1 weight 0.11000E+01 volume 0.94239E-02 ppm1 9.070 ppm2 4.912 CV 1
ASSI { 135}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 73 and name HA ))
3.000 1.100 1.100 peak 135 spectrum 1 weight 0.11000E+01 volume 0.15678E-02 ppm1 9.071 ppm2 5.325 CV 1
ASSI { 136}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 73 and name HA ))
2.400 0.700 0.700 peak 136 spectrum 1 weight 0.11000E+01 volume 0.58407E-02 ppm1 8.656 ppm2 5.325 CV 1
ASSI { 137}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 74 and name HA ))
3.000 1.200 1.200 peak 137 spectrum 1 weight 0.11000E+01 volume 0.15183E-02 ppm1 8.656 ppm2 5.126 CV 1
ASSI { 138}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 89 and name HA ))
3.600 1.600 1.600 peak 138 spectrum 1 weight 0.11000E+01 volume 0.12092E-02 ppm1 8.655 ppm2 5.177 CV 1
ASSI { 139}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 74 and name HA ))
2.500 0.800 0.800 peak 139 spectrum 1 weight 0.11000E+01 volume 0.46355E-02 ppm1 8.632 ppm2 5.126 CV 1
ASSI { 140}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 75 and name HA ))
3.200 1.300 1.300 peak 140 spectrum 1 weight 0.11000E+01 volume 0.10626E-02 ppm1 8.636 ppm2 3.945 CV 1
ASSI { 141}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 75 and name HB ))
2.700 0.900 0.900 peak 141 spectrum 1 weight 0.11000E+01 volume 0.30617E-02 ppm1 8.635 ppm2 1.947 CV 1
ASSI { 142}
(( segid " " and resid 75 and name HN ))
( segid " " and resid 75 and name HG2%)
4.000 2.000 2.000 peak 142 spectrum 1 weight 0.11000E+01 volume 0.12782E-02 ppm1 8.638 ppm2 0.852 CV 1
ASSI { 143}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 75 and name HA ))
2.400 0.700 0.700 peak 143 spectrum 1 weight 0.11000E+01 volume 0.45678E-02 ppm1 9.265 ppm2 3.945 CV 1
ASSI { 145}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 76 and name HA ))
3.100 1.200 1.200 peak 145 spectrum 1 weight 0.11000E+01 volume 0.18863E-02 ppm1 9.267 ppm2 4.820 CV 1
ASSI { 146}
(( segid " " and resid 76 and name HN ))
( segid " " and resid 86 and name HB% )
3.400 1.500 1.500 peak 146 spectrum 1 weight 0.11000E+01 volume 0.13688E-02 ppm1 9.265 ppm2 1.664 CV 1
ASSI { 147}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 87 and name HA ))
3.200 1.300 1.300 peak 147 spectrum 1 weight 0.11000E+01 volume 0.17555E-02 ppm1 9.267 ppm2 5.159 CV 1
ASSI { 148}
(( segid " " and resid 76 and name HN ))
( segid " " and resid 87 and name HD2%)
4.000 2.000 2.000 peak 148 spectrum 1 weight 0.11000E+01 volume 0.13816E-02 ppm1 9.267 ppm2 0.185 CV 1
ASSI { 149}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 75 and name HA ))
3.900 1.900 1.900 peak 149 spectrum 1 weight 0.11000E+01 volume 0.85931E-03 ppm1 7.829 ppm2 3.945 CV 1
ASSI { 150}
(( segid " " and resid 77 and name HN ))
( segid " " and resid 75 and name HG2%)
2.900 1.000 1.000 peak 150 spectrum 1 weight 0.11000E+01 volume 0.26540E-02 ppm1 7.833 ppm2 0.852 CV 1
ASSI { 151}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HA ))
2.900 1.100 1.100 peak 151 spectrum 1 weight 0.11000E+01 volume 0.35646E-02 ppm1 7.831 ppm2 4.820 CV 1
ASSI { 152}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 77 and name HA ))
2.800 1.000 1.000 peak 152 spectrum 1 weight 0.11000E+01 volume 0.26850E-02 ppm1 7.831 ppm2 4.540 CV 1
ASSI { 153}
(( segid " " and resid 77 and name HN ))
( segid " " and resid 86 and name HB% )
2.700 0.900 0.900 peak 153 spectrum 1 weight 0.11000E+01 volume 0.39644E-02 ppm1 7.833 ppm2 1.664 CV 1
ASSI { 154}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 77 and name HA ))
2.200 0.600 0.600 peak 154 spectrum 1 weight 0.11000E+01 volume 0.11709E-01 ppm1 8.634 ppm2 4.540 CV 1
ASSI { 155}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 78 and name HA ))
2.500 0.800 0.800 peak 155 spectrum 1 weight 0.11000E+01 volume 0.58473E-02 ppm1 8.641 ppm2 4.242 CV 1
ASSI { 156}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 79 and name HA ))
2.500 0.800 0.800 peak 156 spectrum 1 weight 0.11000E+01 volume 0.45565E-02 ppm1 8.207 ppm2 4.112 CV 1
ASSI { 157}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 82 and name HA ))
3.400 1.400 1.400 peak 157 spectrum 1 weight 0.11000E+01 volume 0.11596E-02 ppm1 8.058 ppm2 4.688 CV 1
ASSI { 159}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 82 and name HA ))
4.200 2.200 1.800 peak 159 spectrum 1 weight 0.11000E+01 volume 0.67642E-03 ppm1 8.434 ppm2 4.688 CV 1
ASSI { 161}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 85 and name HA ))
3.000 1.100 1.100 peak 161 spectrum 1 weight 0.11000E+01 volume 0.23708E-02 ppm1 8.459 ppm2 4.271 CV 1
ASSI { 163}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 85 and name HA ))
2.200 0.600 0.600 peak 163 spectrum 1 weight 0.11000E+01 volume 0.96922E-02 ppm1 8.633 ppm2 4.271 CV 1
ASSI { 164}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 86 and name HA ))
2.400 0.700 0.700 peak 164 spectrum 1 weight 0.11000E+01 volume 0.57604E-02 ppm1 8.958 ppm2 4.955 CV 1
ASSI { 165}
(( segid " " and resid 88 and name HN ))
( segid " " and resid 39 and name HD1%)
3.600 1.700 1.700 peak 165 spectrum 1 weight 0.11000E+01 volume 0.10043E-02 ppm1 8.436 ppm2 0.612 CV 1
ASSI { 167}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 88 and name HA ))
3.300 1.300 1.300 peak 167 spectrum 1 weight 0.11000E+01 volume 0.10843E-02 ppm1 8.436 ppm2 4.927 CV 1
ASSI { 168}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 88 and name HB ))
3.500 1.600 1.600 peak 168 spectrum 1 weight 0.11000E+01 volume 0.74543E-03 ppm1 8.438 ppm2 4.159 CV 1
ASSI { 169}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 88 and name HA ))
2.900 1.000 1.000 peak 169 spectrum 1 weight 0.11000E+01 volume 0.23754E-02 ppm1 7.951 ppm2 4.927 CV 1
ASSI { 170}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 89 and name HA ))
3.200 1.300 1.300 peak 170 spectrum 1 weight 0.11000E+01 volume 0.13869E-02 ppm1 7.962 ppm2 5.177 CV 1
ASSI { 171}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 89 and name HA ))
3.100 1.200 1.200 peak 171 spectrum 1 weight 0.11000E+01 volume 0.14874E-02 ppm1 9.027 ppm2 5.177 CV 1
ASSI { 172}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 90 and name HA ))
3.100 1.200 1.200 peak 172 spectrum 1 weight 0.11000E+01 volume 0.18393E-02 ppm1 9.038 ppm2 4.690 CV 1
ASSI { 173}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 90 and name HA ))
2.400 0.700 0.700 peak 173 spectrum 1 weight 0.11000E+01 volume 0.72606E-02 ppm1 7.674 ppm2 4.690 CV 1
ASSI { 174}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 91 and name HA ))
2.900 1.100 1.100 peak 174 spectrum 1 weight 0.11000E+01 volume 0.22405E-02 ppm1 7.674 ppm2 4.092 CV 1
ASSI { 175}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 91 and name HA ))
2.500 0.800 0.800 peak 175 spectrum 1 weight 0.11000E+01 volume 0.58593E-02 ppm1 9.061 ppm2 4.092 CV 1
ASSI { 177}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 92 and name HA ))
2.700 0.900 0.900 peak 177 spectrum 1 weight 0.11000E+01 volume 0.45368E-02 ppm1 8.447 ppm2 4.611 CV 1
ASSI { 180}
(( segid " " and resid 96 and name HN ))
(( segid " " and resid 96 and name HA ))
2.900 1.100 1.100 peak 180 spectrum 1 weight 0.11000E+01 volume 0.29052E-02 ppm1 7.887 ppm2 4.335 CV 1
ASSI { 181}
(( segid " " and resid 10 and name HN ))
( segid " " and resid 10 and name HB% )
2.400 0.700 0.700 peak 181 spectrum 1 weight 0.11000E+01 volume 0.85904E-02 ppm1 8.288 ppm2 1.417 CV 1
ASSI { 182}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 10 and name HB% )
3.000 1.100 1.100 peak 182 spectrum 1 weight 0.11000E+01 volume 0.28119E-02 ppm1 8.297 ppm2 1.417 CV 1
ASSI { 183}
(( segid " " and resid 15 and name HN ))
( segid " " and resid 71 and name HG1%)
3.900 1.900 1.900 peak 183 spectrum 1 weight 0.11000E+01 volume 0.13565E-02 ppm1 9.045 ppm2 0.319 CV 1
ASSI { 184}
(( segid " " and resid 16 and name HN ))
( segid " " and resid 29 and name HG1%)
3.000 1.100 1.100 peak 184 spectrum 1 weight 0.11000E+01 volume 0.26455E-02 ppm1 8.101 ppm2 0.567 CV 1
ASSI { 185}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 17 and name HD1%)
2.800 1.000 1.000 peak 185 spectrum 1 weight 0.11000E+01 volume 0.20740E-02 ppm1 8.814 ppm2 0.537 CV 1
ASSI { 188}
(( segid " " and resid 20 and name HN ))
( segid " " and resid 20 and name HD1%)
3.600 1.600 1.600 peak 188 spectrum 1 weight 0.11000E+01 volume 0.14581E-02 ppm1 9.371 ppm2 0.694 CV 1
ASSI { 191}
(( segid " " and resid 26 and name HN ))
( segid " " and resid 61 and name HD1%)
3.000 1.100 1.100 peak 191 spectrum 1 weight 0.11000E+01 volume 0.18138E-02 ppm1 7.310 ppm2 0.578 CV 1
ASSI { 195}
(( segid " " and resid 27 and name HN ))
( segid " " and resid 61 and name HD1%)
3.100 1.200 1.200 peak 195 spectrum 1 weight 0.11000E+01 volume 0.16260E-02 ppm1 8.179 ppm2 0.578 CV 1
ASSI { 196}
(( segid " " and resid 28 and name HN ))
( segid " " and resid 27 and name HB% )
2.600 0.800 0.800 peak 196 spectrum 1 weight 0.11000E+01 volume 0.41482E-02 ppm1 8.984 ppm2 1.156 CV 1
ASSI { 197}
(( segid " " and resid 29 and name HN ))
( segid " " and resid 29 and name HG2%)
3.200 1.200 1.200 peak 197 spectrum 1 weight 0.11000E+01 volume 0.18591E-02 ppm1 8.985 ppm2 0.580 CV 1
ASSI { 198}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 18 and name HG2%)
2.700 0.900 0.900 peak 198 spectrum 1 weight 0.11000E+01 volume 0.30300E-02 ppm1 8.973 ppm2 1.019 CV 1
ASSI { 199}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 29 and name HG1%)
2.900 1.100 1.100 peak 199 spectrum 1 weight 0.11000E+01 volume 0.19670E-02 ppm1 8.975 ppm2 0.567 CV 1
ASSI { 202}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 29 and name HG2%)
3.300 1.400 1.400 peak 202 spectrum 1 weight 0.11000E+01 volume 0.13131E-02 ppm1 8.890 ppm2 0.580 CV 1
ASSI { 205}
(( segid " " and resid 45 and name HN ))
( segid " " and resid 44 and name HG2%)
2.800 1.000 1.000 peak 205 spectrum 1 weight 0.11000E+01 volume 0.19571E-02 ppm1 7.840 ppm2 0.833 CV 1
ASSI { 206}
(( segid " " and resid 45 and name HN ))
( segid " " and resid 45 and name HB% )
2.500 0.800 0.800 peak 206 spectrum 1 weight 0.11000E+01 volume 0.46121E-02 ppm1 7.834 ppm2 1.148 CV 1
ASSI { 207}
(( segid " " and resid 46 and name HN ))
( segid " " and resid 45 and name HB% )
2.700 0.900 0.900 peak 207 spectrum 1 weight 0.11000E+01 volume 0.35346E-02 ppm1 8.475 ppm2 1.148 CV 1
ASSI { 208}
(( segid " " and resid 51 and name HN ))
( segid " " and resid 51 and name HB% )
2.700 0.900 0.900 peak 208 spectrum 1 weight 0.11000E+01 volume 0.40167E-02 ppm1 8.739 ppm2 1.469 CV 1
ASSI { 209}
(( segid " " and resid 55 and name HN ))
( segid " " and resid 55 and name HB% )
2.700 0.900 0.900 peak 209 spectrum 1 weight 0.11000E+01 volume 0.37445E-02 ppm1 7.669 ppm2 1.284 CV 1
ASSI { 210}
(( segid " " and resid 61 and name HN ))
( segid " " and resid 61 and name HG2%)
2.800 0.900 0.900 peak 210 spectrum 1 weight 0.11000E+01 volume 0.29919E-02 ppm1 9.556 ppm2 0.878 CV 1
ASSI { 212}
(( segid " " and resid 63 and name HN ))
( segid " " and resid 64 and name HG1%)
3.900 1.900 1.900 peak 212 spectrum 1 weight 0.11000E+01 volume 0.14812E-02 ppm1 7.819 ppm2 0.109 CV 1
ASSI { 213}
(( segid " " and resid 63 and name HN ))
( segid " " and resid 64 and name HG2%)
3.100 1.200 1.200 peak 213 spectrum 1 weight 0.11000E+01 volume 0.19458E-02 ppm1 7.823 ppm2 0.366 CV 1
ASSI { 214}
(( segid " " and resid 64 and name HN ))
( segid " " and resid 64 and name HG1%)
3.800 1.800 1.800 peak 214 spectrum 1 weight 0.11000E+01 volume 0.13316E-02 ppm1 7.179 ppm2 0.109 CV 1
ASSI { 215}
(( segid " " and resid 64 and name HN ))
( segid " " and resid 64 and name HG2%)
2.800 1.000 1.000 peak 215 spectrum 1 weight 0.11000E+01 volume 0.48439E-02 ppm1 7.177 ppm2 0.366 CV 1
ASSI { 216}
(( segid " " and resid 65 and name HN ))
( segid " " and resid 64 and name HG1%)
3.300 1.300 1.300 peak 216 spectrum 1 weight 0.11000E+01 volume 0.14128E-02 ppm1 7.155 ppm2 0.109 CV 1
ASSI { 217}
(( segid " " and resid 65 and name HN ))
( segid " " and resid 64 and name HG2%)
3.700 1.700 1.700 peak 217 spectrum 1 weight 0.11000E+01 volume 0.20915E-02 ppm1 7.137 ppm2 0.366 CV 1
ASSI { 220}
(( segid " " and resid 71 and name HN ))
( segid " " and resid 71 and name HG1%)
3.100 1.200 1.200 peak 220 spectrum 1 weight 0.11000E+01 volume 0.19107E-02 ppm1 8.607 ppm2 0.319 CV 1
ASSI { 221}
(( segid " " and resid 71 and name HN ))
( segid " " and resid 71 and name HG2%)
2.500 0.800 0.800 peak 221 spectrum 1 weight 0.11000E+01 volume 0.48223E-02 ppm1 8.603 ppm2 0.379 CV 1
ASSI { 224}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 73 and name HG2%)
2.300 0.700 0.700 peak 224 spectrum 1 weight 0.11000E+01 volume 0.76603E-02 ppm1 9.066 ppm2 0.590 CV 1
ASSI { 226}
(( segid " " and resid 75 and name HN ))
( segid " " and resid 75 and name HD1%)
3.200 1.300 1.300 peak 226 spectrum 1 weight 0.11000E+01 volume 0.16865E-02 ppm1 8.625 ppm2 0.791 CV 1
ASSI { 227}
(( segid " " and resid 78 and name HN ))
( segid " " and resid 75 and name HG2%)
3.300 1.400 1.400 peak 227 spectrum 1 weight 0.11000E+01 volume 0.15462E-02 ppm1 8.633 ppm2 0.852 CV 1
ASSI { 228}
(( segid " " and resid 79 and name HN ))
( segid " " and resid 85 and name HB% )
3.500 1.500 1.500 peak 228 spectrum 1 weight 0.11000E+01 volume 0.12199E-02 ppm1 8.691 ppm2 1.476 CV 1
ASSI { 229}
(( segid " " and resid 86 and name HN ))
( segid " " and resid 86 and name HB% )
2.300 0.700 0.700 peak 229 spectrum 1 weight 0.11000E+01 volume 0.10381E-01 ppm1 8.631 ppm2 1.664 CV 1
ASSI { 233}
(( segid " " and resid 91 and name HN ))
( segid " " and resid 91 and name HG2%)
3.700 1.800 1.800 peak 233 spectrum 1 weight 0.11000E+01 volume 0.21594E-02 ppm1 7.670 ppm2 0.856 CV 1
ASSI { 234}
(( segid " " and resid 92 and name HN ))
( segid " " and resid 91 and name HG2%)
3.000 3.000 3.000 peak 234 spectrum 1 weight 0.11000E+01 volume 0.21063E-02 ppm1 9.055 ppm2 0.856 CV 1
ASSI { 4}
(( segid " " and resid 72 and name HN ))
( segid " " and resid 91 and name HD1%)
3.800 1.800 1.800 peak 4 spectrum 1 weight 0.10000E+01 volume 0.51513E-03 ppm1 7.291 ppm2 0.713 CV 1
ASSI { 8}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 40 and name HD2 ))
4.700 2.800 1.300 peak 8 spectrum 1 weight 0.10000E+01 volume 0.33182E-03 ppm1 9.136 ppm2 3.913 CV 1
ASSI { 10}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 84 and name HN ))
2.900 2.900 3.100 peak 10 spectrum 1 weight 0.10000E+01 volume 0.31663E-02 ppm1 8.636 ppm2 8.414 CV 1
ASSI { 12}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 31 and name HD% )
4.100 2.100 1.900 peak 12 spectrum 1 weight 0.10000E+01 volume 0.67660E-03 ppm1 8.251 ppm2 6.577 CV 1
ASSI { 13}
(( segid " " and resid 33 and name HN ))
( segid " " and resid 31 and name HD% )
4.100 2.100 1.900 peak 13 spectrum 1 weight 0.10000E+01 volume 0.51121E-03 ppm1 6.806 ppm2 6.567 CV 1
ASSI { 16}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 18 and name HN ))
3.300 1.400 1.400 peak 16 spectrum 1 weight 0.10000E+01 volume 0.14982E-02 ppm1 8.998 ppm2 9.201 CV 1
ASSI { 17}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 83 and name HN ))
2.400 2.400 3.600 peak 17 spectrum 1 weight 0.10000E+01 volume 0.35743E-02 ppm1 8.452 ppm2 8.079 CV 1
ASSI { 18}
(( segid " " and resid 90 and name HN ))
( segid " " and resid 90 and name HD% )
3.700 1.700 1.700 peak 18 spectrum 1 weight 0.10000E+01 volume 0.10651E-02 ppm1 9.032 ppm2 7.381 CV 1
ASSI { 24}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 13 and name HD% )
3.300 1.300 1.300 peak 24 spectrum 1 weight 0.10000E+01 volume 0.17012E-02 ppm1 9.227 ppm2 7.104 CV 1
ASSI { 25}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 13 and name HD% )
3.600 3.600 2.400 peak 25 spectrum 1 weight 0.10000E+01 volume 0.12077E-02 ppm1 8.751 ppm2 7.100 CV 1
ASSI { 35}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 86 and name HN ))
3.400 1.500 1.500 peak 35 spectrum 1 weight 0.10000E+01 volume 0.20677E-02 ppm1 8.956 ppm2 8.618 CV 1
ASSI { 37}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 20 and name HN ))
3.400 1.400 1.400 peak 37 spectrum 1 weight 0.10000E+01 volume 0.17260E-02 ppm1 7.402 ppm2 9.361 CV 1
ASSI { 47}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 62 and name HN ))
3.500 3.500 2.500 peak 47 spectrum 1 weight 0.10000E+01 volume 0.17904E-02 ppm1 7.979 ppm2 8.283 CV 1
ASSI { 48}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 41 and name HN ))
4.100 2.100 1.900 peak 48 spectrum 1 weight 0.10000E+01 volume 0.49680E-03 ppm1 7.330 ppm2 8.490 CV 1
ASSI { 49}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 27 and name HN ))
3.200 1.300 1.300 peak 49 spectrum 1 weight 0.10000E+01 volume 0.24505E-02 ppm1 7.328 ppm2 8.157 CV 1
ASSI { 50}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 84 and name HN ))
3.200 1.300 1.300 peak 50 spectrum 1 weight 0.10000E+01 volume 0.83016E-03 ppm1 8.063 ppm2 8.443 CV 1
ASSI { 56}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 41 and name HN ))
4.000 2.000 2.000 peak 56 spectrum 1 weight 0.10000E+01 volume 0.12599E-02 ppm1 8.172 ppm2 8.490 CV 1
ASSI { 60}
(( segid " " and resid 28 and name HN ))
( segid " " and resid 28 and name HD% )
3.200 1.300 1.300 peak 60 spectrum 1 weight 0.10000E+01 volume 0.11615E-02 ppm1 8.985 ppm2 7.125 CV 1
ASSI { 79}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 42 and name HN ))
4.300 2.400 1.700 peak 79 spectrum 1 weight 0.10000E+01 volume 0.48014E-03 ppm1 7.681 ppm2 8.761 CV 1
ASSI { 85}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 74 and name HG3 ))
3.900 1.900 1.900 peak 85 spectrum 1 weight 0.10000E+01 volume 0.69547E-03 ppm1 8.633 ppm2 2.298 CV 1
ASSI { 87}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 62 and name HN ))
5.000 3.100 1.000 peak 87 spectrum 1 weight 0.10000E+01 volume 0.37607E-03 ppm1 7.324 ppm2 8.297 CV 1
ASSI { 90}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 49 and name HN ))
4.000 2.000 2.000 peak 90 spectrum 1 weight 0.10000E+01 volume 0.55994E-03 ppm1 8.481 ppm2 7.933 CV 1
ASSI { 91}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HN ))
4.300 2.300 1.700 peak 91 spectrum 1 weight 0.10000E+01 volume 0.72675E-03 ppm1 8.488 ppm2 7.834 CV 1
ASSI { 93}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 51 and name HN ))
4.100 2.100 1.900 peak 93 spectrum 1 weight 0.10000E+01 volume 0.50425E-03 ppm1 8.896 ppm2 8.728 CV 1
ASSI { 96}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 85 and name HA ))
4.700 2.800 1.300 peak 96 spectrum 1 weight 0.10000E+01 volume 0.31771E-03 ppm1 7.832 ppm2 4.282 CV 1
ASSI { 99}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 49 and name HD% )
4.100 2.100 1.900 peak 99 spectrum 1 weight 0.10000E+01 volume 0.88648E-03 ppm1 7.798 ppm2 6.952 CV 1
ASSI { 100}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 95 and name HN ))
3.200 3.200 2.800 peak 100 spectrum 1 weight 0.10000E+01 volume 0.23829E-02 ppm1 7.797 ppm2 8.409 CV 1
ASSI { 101}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 48 and name HD% )
2.700 2.700 3.300 peak 101 spectrum 1 weight 0.10000E+01 volume 0.19375E-02 ppm1 7.799 ppm2 7.311 CV 1
ASSI { 102}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 51 and name HN ))
2.600 2.600 3.400 peak 102 spectrum 1 weight 0.10000E+01 volume 0.45134E-02 ppm1 7.907 ppm2 8.722 CV 1
ASSI { 106}
(( segid " " and resid 49 and name HN ))
( segid " " and resid 49 and name HD% )
2.400 2.400 3.600 peak 106 spectrum 1 weight 0.10000E+01 volume 0.31540E-02 ppm1 7.906 ppm2 6.949 CV 1
ASSI { 110}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 90 and name HN ))
4.400 2.400 1.600 peak 110 spectrum 1 weight 0.10000E+01 volume 0.42729E-03 ppm1 8.427 ppm2 9.013 CV 1
ASSI { 116}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 13 and name HN ))
2.800 1.000 1.000 peak 116 spectrum 1 weight 0.10000E+01 volume 0.22449E-02 ppm1 9.068 ppm2 9.208 CV 1
ASSI { 117}
(( segid " " and resid 72 and name HN ))
( segid " " and resid 48 and name HE% )
3.600 1.600 1.600 peak 117 spectrum 1 weight 0.10000E+01 volume 0.74317E-03 ppm1 7.292 ppm2 7.025 CV 1
ASSI { 121}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 60 and name HD21))
3.800 1.800 1.800 peak 121 spectrum 1 weight 0.10000E+01 volume 0.53209E-03 ppm1 7.189 ppm2 7.702 CV 1
ASSI { 123}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 36 and name HE1 ))
4.000 2.000 2.000 peak 123 spectrum 1 weight 0.10000E+01 volume 0.72681E-03 ppm1 8.998 ppm2 7.851 CV 1
ASSI { 124}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 71 and name HN ))
4.200 2.200 1.800 peak 124 spectrum 1 weight 0.10000E+01 volume 0.41294E-03 ppm1 7.292 ppm2 8.614 CV 1
ASSI { 126}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 60 and name HD22))
4.200 2.200 1.800 peak 126 spectrum 1 weight 0.10000E+01 volume 0.73243E-03 ppm1 7.178 ppm2 6.829 CV 1
ASSI { 129}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 69 and name HE21))
4.200 2.200 1.800 peak 129 spectrum 1 weight 0.10000E+01 volume 0.67783E-03 ppm1 7.144 ppm2 7.576 CV 1
ASSI { 132}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 69 and name HE21))
2.600 0.900 0.900 peak 132 spectrum 1 weight 0.10000E+01 volume 0.23539E-02 ppm1 8.016 ppm2 7.543 CV 1
ASSI { 136}
(( segid " " and resid 69 and name HE21))
(( segid " " and resid 17 and name HB ))
3.900 1.900 1.900 peak 136 spectrum 1 weight 0.10000E+01 volume 0.43187E-03 ppm1 7.546 ppm2 2.366 CV 1
ASSI { 137}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 63 and name HN ))
4.300 2.300 1.700 peak 137 spectrum 1 weight 0.10000E+01 volume 0.38019E-03 ppm1 8.298 ppm2 7.843 CV 1
ASSI { 139}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 61 and name HN ))
4.400 2.400 1.600 peak 139 spectrum 1 weight 0.10000E+01 volume 0.31709E-03 ppm1 8.299 ppm2 9.575 CV 1
ASSI { 140}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 61 and name HN ))
4.000 2.000 2.000 peak 140 spectrum 1 weight 0.10000E+01 volume 0.37282E-03 ppm1 7.833 ppm2 9.578 CV 1
ASSI { 148}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 61 and name HG13))
4.500 2.600 1.500 peak 148 spectrum 1 weight 0.10000E+01 volume 0.30484E-03 ppm1 9.565 ppm2 1.056 CV 1
ASSI { 149}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 61 and name HB ))
2.500 0.800 0.800 peak 149 spectrum 1 weight 0.10000E+01 volume 0.22717E-02 ppm1 9.565 ppm2 1.704 CV 1
ASSI { 150}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 41 and name HB3 ))
4.600 2.600 1.400 peak 150 spectrum 1 weight 0.10000E+01 volume 0.44452E-03 ppm1 9.565 ppm2 1.973 CV 1
ASSI { 152}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 60 and name HB3 ))
4.600 2.600 1.400 peak 152 spectrum 1 weight 0.10000E+01 volume 0.38545E-03 ppm1 9.563 ppm2 2.992 CV 1
ASSI { 156}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 92 and name HA ))
3.000 1.100 1.100 peak 156 spectrum 1 weight 0.10000E+01 volume 0.20567E-02 ppm1 9.044 ppm2 4.589 CV 1
ASSI { 158}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 88 and name HB ))
4.600 2.700 1.400 peak 158 spectrum 1 weight 0.10000E+01 volume 0.35666E-03 ppm1 7.951 ppm2 4.150 CV 1
ASSI { 160}
(( segid " " and resid 95 and name HN ))
(( segid " " and resid 95 and name HA2 ))
3.000 1.100 1.100 peak 160 spectrum 1 weight 0.10000E+01 volume 0.20595E-02 ppm1 8.410 ppm2 4.017 CV 1
OR { 160}
(( segid " " and resid 95 and name HN ))
(( segid " " and resid 95 and name HA1 ))
ASSI { 161}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 92 and name HB2 ))
2.900 1.100 1.100 peak 161 spectrum 1 weight 0.10000E+01 volume 0.27003E-02 ppm1 9.056 ppm2 3.912 CV 1
OR { 161}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 92 and name HB3 ))
ASSI { 164}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 91 and name HB ))
3.400 1.500 1.500 peak 164 spectrum 1 weight 0.10000E+01 volume 0.14120E-02 ppm1 9.051 ppm2 1.908 CV 1
ASSI { 166}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 91 and name HG13))
2.700 0.900 0.900 peak 166 spectrum 1 weight 0.10000E+01 volume 0.29224E-02 ppm1 7.673 ppm2 1.396 CV 1
ASSI { 167}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 91 and name HB ))
2.800 1.000 1.000 peak 167 spectrum 1 weight 0.10000E+01 volume 0.26670E-02 ppm1 7.673 ppm2 1.910 CV 1
ASSI { 171}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 90 and name HB3 ))
2.700 0.900 0.900 peak 171 spectrum 1 weight 0.10000E+01 volume 0.40162E-02 ppm1 9.029 ppm2 3.075 CV 1
OR { 171}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 90 and name HB2 ))
ASSI { 172}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 88 and name HB ))
4.800 2.900 1.200 peak 172 spectrum 1 weight 0.10000E+01 volume 0.30725E-03 ppm1 9.028 ppm2 4.162 CV 1
ASSI { 173}
(( segid " " and resid 89 and name HN ))
( segid " " and resid 39 and name HD1%)
3.600 1.700 1.700 peak 173 spectrum 1 weight 0.10000E+01 volume 0.84391E-03 ppm1 7.952 ppm2 0.585 CV 1
ASSI { 174}
(( segid " " and resid 89 and name HN ))
( segid " " and resid 89 and name HG2%)
3.500 1.500 1.500 peak 174 spectrum 1 weight 0.10000E+01 volume 0.10830E-02 ppm1 7.951 ppm2 0.970 CV 1
ASSI { 175}
(( segid " " and resid 89 and name HN ))
( segid " " and resid 88 and name HG2%)
3.600 1.600 1.600 peak 175 spectrum 1 weight 0.10000E+01 volume 0.79060E-03 ppm1 7.952 ppm2 1.157 CV 1
ASSI { 177}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 43 and name HB2 ))
3.300 3.300 2.700 peak 177 spectrum 1 weight 0.10000E+01 volume 0.72189E-03 ppm1 7.953 ppm2 3.113 CV 1
ASSI { 178}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 38 and name HB3 ))
3.500 3.500 2.500 peak 178 spectrum 1 weight 0.10000E+01 volume 0.31022E-03 ppm1 8.956 ppm2 2.979 CV 1
ASSI { 181}
(( segid " " and resid 88 and name HN ))
( segid " " and resid 87 and name HD2%)
2.900 2.900 3.100 peak 181 spectrum 1 weight 0.10000E+01 volume 0.10921E-02 ppm1 8.432 ppm2 0.187 CV 1
ASSI { 182}
(( segid " " and resid 88 and name HN ))
( segid " " and resid 73 and name HG1%)
3.000 1.200 1.200 peak 182 spectrum 1 weight 0.10000E+01 volume 0.18413E-02 ppm1 8.429 ppm2 0.569 CV 1
ASSI { 183}
(( segid " " and resid 88 and name HN ))
( segid " " and resid 88 and name HG2%)
2.600 0.800 0.800 peak 183 spectrum 1 weight 0.10000E+01 volume 0.42246E-02 ppm1 8.430 ppm2 1.135 CV 1
ASSI { 184}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 87 and name HB2 ))
3.100 1.200 1.200 peak 184 spectrum 1 weight 0.10000E+01 volume 0.14704E-02 ppm1 8.428 ppm2 1.507 CV 1
ASSI { 185}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 73 and name HB ))
2.900 1.100 1.100 peak 185 spectrum 1 weight 0.10000E+01 volume 0.16122E-02 ppm1 8.430 ppm2 1.940 CV 1
ASSI { 186}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 74 and name HG3 ))
4.100 2.100 1.900 peak 186 spectrum 1 weight 0.10000E+01 volume 0.36535E-03 ppm1 8.429 ppm2 2.303 CV 1
ASSI { 188}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 87 and name HB3 ))
3.600 1.700 1.700 peak 188 spectrum 1 weight 0.10000E+01 volume 0.92987E-03 ppm1 8.954 ppm2 1.087 CV 1
ASSI { 189}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 87 and name HG ))
2.600 0.800 0.800 peak 189 spectrum 1 weight 0.10000E+01 volume 0.33738E-02 ppm1 8.954 ppm2 1.503 CV 1
OR { 189}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 87 and name HB2 ))
ASSI { 190}
(( segid " " and resid 87 and name HN ))
( segid " " and resid 86 and name HB% )
3.100 1.200 1.200 peak 190 spectrum 1 weight 0.10000E+01 volume 0.29525E-02 ppm1 8.955 ppm2 1.658 CV 1
ASSI { 191}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 77 and name HB2 ))
3.500 3.500 2.500 peak 191 spectrum 1 weight 0.10000E+01 volume 0.34901E-03 ppm1 8.962 ppm2 1.824 CV 1
ASSI { 192}
(( segid " " and resid 87 and name HN ))
( segid " " and resid 87 and name HD2%)
4.100 2.100 1.900 peak 192 spectrum 1 weight 0.10000E+01 volume 0.62559E-03 ppm1 8.954 ppm2 0.176 CV 1
ASSI { 193}
(( segid " " and resid 86 and name HN ))
( segid " " and resid 75 and name HG2%)
3.400 1.400 1.400 peak 193 spectrum 1 weight 0.10000E+01 volume 0.85890E-03 ppm1 8.634 ppm2 0.845 CV 1
ASSI { 194}
(( segid " " and resid 86 and name HN ))
( segid " " and resid 85 and name HB% )
2.900 1.100 1.100 peak 194 spectrum 1 weight 0.10000E+01 volume 0.53561E-02 ppm1 8.633 ppm2 1.470 CV 1
ASSI { 195}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 77 and name HB2 ))
3.300 1.400 1.400 peak 195 spectrum 1 weight 0.10000E+01 volume 0.96642E-03 ppm1 8.633 ppm2 1.833 CV 1
ASSI { 197}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 77 and name HB3 ))
3.800 1.800 1.800 peak 197 spectrum 1 weight 0.10000E+01 volume 0.71518E-03 ppm1 8.633 ppm2 1.925 CV 1
ASSI { 198}
(( segid " " and resid 82 and name HD21))
(( segid " " and resid 82 and name HB2 ))
3.100 1.200 1.200 peak 198 spectrum 1 weight 0.10000E+01 volume 0.15040E-02 ppm1 7.532 ppm2 2.860 CV 1
OR { 198}
(( segid " " and resid 82 and name HD21))
(( segid " " and resid 82 and name HB3 ))
ASSI { 200}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 83 and name HG2 ))
3.900 1.900 1.900 peak 200 spectrum 1 weight 0.10000E+01 volume 0.95841E-03 ppm1 8.426 ppm2 1.485 CV 1
OR { 200}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 83 and name HG3 ))
ASSI { 202}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 80 and name HB3 ))
3.600 3.600 2.400 peak 202 spectrum 1 weight 0.10000E+01 volume 0.30631E-03 ppm1 8.425 ppm2 1.778 CV 1
ASSI { 203}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 83 and name HB2 ))
3.200 1.300 1.300 peak 203 spectrum 1 weight 0.10000E+01 volume 0.16873E-02 ppm1 8.427 ppm2 1.973 CV 1
ASSI { 204}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 79 and name HG2 ))
3.600 1.600 1.600 peak 204 spectrum 1 weight 0.10000E+01 volume 0.93712E-03 ppm1 8.426 ppm2 2.344 CV 1
OR { 204}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 79 and name HG3 ))
ASSI { 205}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 83 and name HG2 ))
3.600 1.600 1.600 peak 205 spectrum 1 weight 0.10000E+01 volume 0.10223E-02 ppm1 8.061 ppm2 1.493 CV 1
OR { 205}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 83 and name HG3 ))
ASSI { 206}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 80 and name HG2 ))
4.000 2.000 2.000 peak 206 spectrum 1 weight 0.10000E+01 volume 0.37370E-03 ppm1 8.042 ppm2 1.680 CV 1
ASSI { 207}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 83 and name HB3 ))
3.500 1.500 1.500 peak 207 spectrum 1 weight 0.10000E+01 volume 0.13076E-02 ppm1 8.062 ppm2 1.931 CV 1
ASSI { 208}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 82 and name HB2 ))
3.900 1.900 1.900 peak 208 spectrum 1 weight 0.10000E+01 volume 0.51218E-03 ppm1 8.063 ppm2 2.863 CV 1
OR { 208}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 82 and name HB3 ))
ASSI { 210}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 4 and name HB3 ))
4.000 2.000 2.000 peak 210 spectrum 1 weight 0.10000E+01 volume 0.49590E-03 ppm1 8.306 ppm2 2.005 CV 1
ASSI { 212}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 80 and name HG2 ))
3.000 1.100 1.100 peak 212 spectrum 1 weight 0.10000E+01 volume 0.14678E-02 ppm1 8.203 ppm2 1.666 CV 1
ASSI { 214}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 80 and name HB3 ))
3.200 1.300 1.300 peak 214 spectrum 1 weight 0.10000E+01 volume 0.15706E-02 ppm1 8.199 ppm2 1.808 CV 1
ASSI { 215}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 80 and name HB2 ))
3.400 1.400 1.400 peak 215 spectrum 1 weight 0.10000E+01 volume 0.15672E-02 ppm1 8.198 ppm2 1.891 CV 1
ASSI { 216}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 79 and name HB2 ))
3.900 1.900 1.900 peak 216 spectrum 1 weight 0.10000E+01 volume 0.10870E-02 ppm1 8.196 ppm2 2.007 CV 1
ASSI { 221}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 79 and name HA ))
2.900 1.000 1.000 peak 221 spectrum 1 weight 0.10000E+01 volume 0.22652E-02 ppm1 8.696 ppm2 4.102 CV 1
ASSI { 225}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 77 and name HG3 ))
3.500 1.500 1.500 peak 225 spectrum 1 weight 0.10000E+01 volume 0.21405E-02 ppm1 8.635 ppm2 1.477 CV 1
OR { 225}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 77 and name HG2 ))
ASSI { 226}
(( segid " " and resid 78 and name HN ))
( segid " " and resid 86 and name HB% )
3.900 1.900 1.900 peak 226 spectrum 1 weight 0.10000E+01 volume 0.73188E-03 ppm1 8.633 ppm2 1.689 CV 1
ASSI { 227}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 78 and name HB3 ))
2.900 1.100 1.100 peak 227 spectrum 1 weight 0.10000E+01 volume 0.68555E-02 ppm1 8.636 ppm2 2.005 CV 1
ASSI { 228}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 78 and name HB2 ))
2.500 0.800 0.800 peak 228 spectrum 1 weight 0.10000E+01 volume 0.38960E-02 ppm1 8.636 ppm2 2.142 CV 1
ASSI { 229}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 78 and name HG3 ))
2.900 1.000 1.000 peak 229 spectrum 1 weight 0.10000E+01 volume 0.46501E-02 ppm1 8.636 ppm2 2.353 CV 1
OR { 229}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 78 and name HG2 ))
ASSI { 231}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 75 and name HG12))
5.100 3.300 0.900 peak 231 spectrum 1 weight 0.10000E+01 volume 0.31406E-03 ppm1 7.831 ppm2 0.970 CV 1
ASSI { 232}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 77 and name HG2 ))
3.100 1.200 1.200 peak 232 spectrum 1 weight 0.10000E+01 volume 0.21102E-02 ppm1 7.830 ppm2 1.473 CV 1
OR { 232}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 77 and name HG3 ))
ASSI { 237}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 83 and name HA ))
2.600 0.800 0.800 peak 237 spectrum 1 weight 0.10000E+01 volume 0.62014E-02 ppm1 8.427 ppm2 4.421 CV 1
ASSI { 239}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 75 and name HG12))
4.500 2.600 1.500 peak 239 spectrum 1 weight 0.10000E+01 volume 0.67493E-03 ppm1 9.269 ppm2 0.969 CV 1
ASSI { 243}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 76 and name HB2 ))
3.000 1.100 1.100 peak 243 spectrum 1 weight 0.10000E+01 volume 0.17554E-02 ppm1 9.267 ppm2 2.308 CV 1
ASSI { 245}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 76 and name HB3 ))
3.000 1.100 1.100 peak 245 spectrum 1 weight 0.10000E+01 volume 0.16014E-02 ppm1 9.267 ppm2 2.546 CV 1
ASSI { 247}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 62 and name HB2 ))
2.200 0.600 0.600 peak 247 spectrum 1 weight 0.10000E+01 volume 0.11485E-01 ppm1 8.294 ppm2 1.818 CV 1
OR { 247}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 62 and name HB3 ))
ASSI { 248}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 30 and name HB3 ))
3.500 1.500 1.500 peak 248 spectrum 1 weight 0.10000E+01 volume 0.66954E-03 ppm1 8.105 ppm2 2.767 CV 1
ASSI { 249}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 62 and name HG2 ))
2.700 0.900 0.900 peak 249 spectrum 1 weight 0.10000E+01 volume 0.19962E-02 ppm1 8.294 ppm2 1.510 CV 1
ASSI { 251}
(( segid " " and resid 62 and name HN ))
( segid " " and resid 61 and name HG2%)
2.200 0.600 0.600 peak 251 spectrum 1 weight 0.10000E+01 volume 0.70122E-02 ppm1 8.294 ppm2 0.876 CV 1
ASSI { 253}
(( segid " " and resid 62 and name HN ))
( segid " " and resid 20 and name HG2%)
3.600 1.600 1.600 peak 253 spectrum 1 weight 0.10000E+01 volume 0.13842E-02 ppm1 8.294 ppm2 0.714 CV 1
ASSI { 254}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 57 and name HN ))
3.600 1.600 1.600 peak 254 spectrum 1 weight 0.10000E+01 volume 0.11083E-02 ppm1 8.407 ppm2 8.211 CV 1
ASSI { 255}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 72 and name HA ))
2.900 1.100 1.100 peak 255 spectrum 1 weight 0.10000E+01 volume 0.15559E-02 ppm1 7.291 ppm2 4.908 CV 1
ASSI { 257}
(( segid " " and resid 75 and name HN ))
( segid " " and resid 12 and name HD1%)
2.700 2.700 3.300 peak 257 spectrum 1 weight 0.10000E+01 volume 0.16550E-02 ppm1 8.633 ppm2 0.821 CV 1
ASSI { 258}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 75 and name HG12))
2.900 1.000 1.000 peak 258 spectrum 1 weight 0.10000E+01 volume 0.16869E-02 ppm1 8.634 ppm2 0.976 CV 1
ASSI { 259}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 17 and name HA ))
3.900 1.900 1.900 peak 259 spectrum 1 weight 0.10000E+01 volume 0.75960E-03 ppm1 8.974 ppm2 4.273 CV 1
ASSI { 260}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 75 and name HG13))
3.600 1.600 1.600 peak 260 spectrum 1 weight 0.10000E+01 volume 0.15090E-02 ppm1 8.636 ppm2 1.522 CV 1
ASSI { 261}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 21 and name HA ))
3.000 1.100 1.100 peak 261 spectrum 1 weight 0.10000E+01 volume 0.13750E-02 ppm1 8.834 ppm2 5.330 CV 1
ASSI { 265}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 74 and name HG2 ))
4.200 2.200 1.800 peak 265 spectrum 1 weight 0.10000E+01 volume 0.86321E-03 ppm1 8.635 ppm2 2.175 CV 1
ASSI { 266}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 73 and name HG1%)
3.300 1.400 1.400 peak 266 spectrum 1 weight 0.10000E+01 volume 0.25907E-02 ppm1 8.652 ppm2 0.568 CV 1
OR { 266}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 73 and name HG2%)
ASSI { 269}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 87 and name HD2%)
4.600 2.600 1.400 peak 269 spectrum 1 weight 0.10000E+01 volume 0.37863E-03 ppm1 8.653 ppm2 0.172 CV 1
ASSI { 275}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 91 and name HD1%)
3.300 1.400 1.400 peak 275 spectrum 1 weight 0.10000E+01 volume 0.15807E-02 ppm1 9.065 ppm2 0.722 CV 1
ASSI { 276}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 72 and name HG2%)
2.900 1.000 1.000 peak 276 spectrum 1 weight 0.10000E+01 volume 0.41112E-02 ppm1 9.066 ppm2 0.842 CV 1
ASSI { 277}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 72 and name HG12))
4.800 2.800 1.200 peak 277 spectrum 1 weight 0.10000E+01 volume 0.48423E-03 ppm1 9.066 ppm2 1.257 CV 1
ASSI { 279}
(( segid " " and resid 72 and name HN ))
( segid " " and resid 71 and name HG1%)
3.900 1.900 1.900 peak 279 spectrum 1 weight 0.10000E+01 volume 0.14451E-02 ppm1 7.288 ppm2 0.341 CV 1
ASSI { 280}
(( segid " " and resid 72 and name HN ))
( segid " " and resid 73 and name HG1%)
3.500 1.600 1.600 peak 280 spectrum 1 weight 0.10000E+01 volume 0.78184E-03 ppm1 7.288 ppm2 0.562 CV 1
OR { 280}
(( segid " " and resid 72 and name HN ))
( segid " " and resid 73 and name HG2%)
ASSI { 282}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 72 and name HG12))
2.700 0.900 0.900 peak 282 spectrum 1 weight 0.10000E+01 volume 0.14333E-02 ppm1 7.287 ppm2 1.269 CV 1
ASSI { 283}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 71 and name HB ))
2.800 1.000 1.000 peak 283 spectrum 1 weight 0.10000E+01 volume 0.25232E-02 ppm1 7.288 ppm2 1.426 CV 1
ASSI { 285}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 72 and name HB ))
2.700 0.900 0.900 peak 285 spectrum 1 weight 0.10000E+01 volume 0.34259E-02 ppm1 7.289 ppm2 1.901 CV 1
ASSI { 286}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 70 and name HG3 ))
4.100 2.100 1.900 peak 286 spectrum 1 weight 0.10000E+01 volume 0.37794E-03 ppm1 7.284 ppm2 2.129 CV 1
ASSI { 295}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 71 and name HB ))
4.000 2.000 2.000 peak 295 spectrum 1 weight 0.10000E+01 volume 0.62630E-03 ppm1 8.604 ppm2 1.418 CV 1
ASSI { 298}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 70 and name HB3 ))
4.000 2.000 2.000 peak 298 spectrum 1 weight 0.10000E+01 volume 0.15307E-02 ppm1 8.605 ppm2 2.100 CV 1
ASSI { 299}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 70 and name HG2 ))
4.900 3.000 1.100 peak 299 spectrum 1 weight 0.10000E+01 volume 0.39291E-03 ppm1 8.603 ppm2 2.427 CV 1
ASSI { 301}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 70 and name HB3 ))
2.300 0.700 0.700 peak 301 spectrum 1 weight 0.10000E+01 volume 0.64586E-02 ppm1 8.673 ppm2 2.083 CV 1
ASSI { 302}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 69 and name HB2 ))
3.900 1.900 1.900 peak 302 spectrum 1 weight 0.10000E+01 volume 0.14404E-02 ppm1 8.671 ppm2 2.281 CV 1
ASSI { 305}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 68 and name HA1 ))
3.300 1.300 1.300 peak 305 spectrum 1 weight 0.10000E+01 volume 0.16146E-02 ppm1 7.716 ppm2 4.439 CV 1
ASSI { 307}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 67 and name HA ))
3.100 1.200 1.200 peak 307 spectrum 1 weight 0.10000E+01 volume 0.28747E-02 ppm1 7.716 ppm2 3.628 CV 1
ASSI { 309}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 90 and name HB2 ))
3.800 1.800 1.800 peak 309 spectrum 1 weight 0.10000E+01 volume 0.87300E-03 ppm1 7.672 ppm2 3.071 CV 1
OR { 309}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 90 and name HB3 ))
ASSI { 310}
(( segid " " and resid 74 and name HE21))
(( segid " " and resid 74 and name HB2 ))
4.000 2.000 2.000 peak 310 spectrum 1 weight 0.10000E+01 volume 0.36587E-03 ppm1 7.333 ppm2 1.937 CV 1
OR { 310}
(( segid " " and resid 74 and name HE21))
(( segid " " and resid 74 and name HB3 ))
ASSI { 313}
(( segid " " and resid 74 and name HE22))
(( segid " " and resid 74 and name HB2 ))
4.700 2.700 1.300 peak 313 spectrum 1 weight 0.10000E+01 volume 0.36451E-03 ppm1 6.967 ppm2 1.943 CV 1
OR { 313}
(( segid " " and resid 74 and name HE22))
(( segid " " and resid 74 and name HB3 ))
ASSI { 315}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 16 and name HB3 ))
3.200 1.300 1.300 peak 315 spectrum 1 weight 0.10000E+01 volume 0.11535E-02 ppm1 7.716 ppm2 1.677 CV 1
OR { 315}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 16 and name HB2 ))
ASSI { 316}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 69 and name HB3 ))
2.300 0.700 0.700 peak 316 spectrum 1 weight 0.10000E+01 volume 0.58305E-02 ppm1 7.716 ppm2 2.066 CV 1
ASSI { 319}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 11 and name HA ))
3.000 1.100 1.100 peak 319 spectrum 1 weight 0.10000E+01 volume 0.19428E-02 ppm1 8.292 ppm2 4.635 CV 1
ASSI { 323}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 59 and name HB3 ))
3.400 1.500 1.500 peak 323 spectrum 1 weight 0.10000E+01 volume 0.15334E-02 ppm1 8.299 ppm2 1.723 CV 1
ASSI { 324}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HA ))
2.100 0.600 0.600 peak 324 spectrum 1 weight 0.10000E+01 volume 0.69869E-02 ppm1 9.220 ppm2 4.280 CV 1
ASSI { 327}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 20 and name HA ))
2.900 2.900 3.100 peak 327 spectrum 1 weight 0.10000E+01 volume 0.29607E-02 ppm1 7.399 ppm2 4.259 CV 1
ASSI { 329}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 69 and name HB2 ))
2.300 0.600 0.600 peak 329 spectrum 1 weight 0.10000E+01 volume 0.65105E-02 ppm1 7.716 ppm2 2.289 CV 1
ASSI { 330}
(( segid " " and resid 69 and name HN ))
( segid " " and resid 17 and name HD1%)
3.800 1.800 1.800 peak 330 spectrum 1 weight 0.10000E+01 volume 0.91324E-03 ppm1 7.717 ppm2 0.533 CV 1
ASSI { 331}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 66 and name HG2 ))
3.500 1.500 1.500 peak 331 spectrum 1 weight 0.10000E+01 volume 0.10134E-02 ppm1 7.715 ppm2 1.564 CV 1
OR { 331}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 66 and name HG3 ))
ASSI { 332}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 60 and name HD21))
3.900 1.900 1.900 peak 332 spectrum 1 weight 0.10000E+01 volume 0.43613E-03 ppm1 8.293 ppm2 7.700 CV 1
ASSI { 333}
(( segid " " and resid 60 and name HD22))
(( segid " " and resid 60 and name HD21))
1.600 0.300 0.600 peak 333 spectrum 1 weight 0.10000E+01 volume 0.27331E-01 ppm1 6.823 ppm2 7.710 CV 1
ASSI { 335}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 30 and name HA ))
3.300 1.300 1.300 peak 335 spectrum 1 weight 0.10000E+01 volume 0.19899E-02 ppm1 8.246 ppm2 5.061 CV 1
ASSI { 337}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HA ))
3.100 1.200 1.200 peak 337 spectrum 1 weight 0.10000E+01 volume 0.17926E-02 ppm1 6.803 ppm2 4.472 CV 1
ASSI { 340}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 66 and name HN ))
4.400 2.400 1.600 peak 340 spectrum 1 weight 0.10000E+01 volume 0.32529E-03 ppm1 9.041 ppm2 8.013 CV 1
ASSI { 342}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 38 and name HN ))
4.100 2.100 1.900 peak 342 spectrum 1 weight 0.10000E+01 volume 0.41699E-03 ppm1 8.454 ppm2 9.125 CV 1
ASSI { 347}
(( segid " " and resid 60 and name HD21))
(( segid " " and resid 61 and name HN ))
4.100 2.100 1.900 peak 347 spectrum 1 weight 0.10000E+01 volume 0.29300E-03 ppm1 7.718 ppm2 9.568 CV 1
ASSI { 351}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 56 and name HN ))
4.500 2.500 1.500 peak 351 spectrum 1 weight 0.10000E+01 volume 0.22935E-03 ppm1 7.672 ppm2 8.166 CV 1
ASSI { 353}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 54 and name HN ))
5.400 3.700 0.600 peak 353 spectrum 1 weight 0.10000E+01 volume 0.18036E-03 ppm1 7.660 ppm2 8.019 CV 1
ASSI { 354}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 17 and name HA ))
3.800 1.800 1.800 peak 354 spectrum 1 weight 0.10000E+01 volume 0.65133E-03 ppm1 9.227 ppm2 4.287 CV 1
ASSI { 355}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 68 and name HA1 ))
2.400 0.700 0.700 peak 355 spectrum 1 weight 0.10000E+01 volume 0.41454E-02 ppm1 9.229 ppm2 4.445 CV 1
ASSI { 359}
(( segid " " and resid 68 and name HN ))
( segid " " and resid 17 and name HD1%)
4.900 3.000 1.100 peak 359 spectrum 1 weight 0.10000E+01 volume 0.33283E-03 ppm1 9.227 ppm2 0.558 CV 1
ASSI { 361}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 16 and name HG3 ))
4.200 2.200 1.800 peak 361 spectrum 1 weight 0.10000E+01 volume 0.73920E-03 ppm1 9.229 ppm2 1.334 CV 1
ASSI { 362}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 16 and name HB3 ))
3.400 1.400 1.400 peak 362 spectrum 1 weight 0.10000E+01 volume 0.62200E-03 ppm1 9.229 ppm2 1.677 CV 1
OR { 362}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 16 and name HB2 ))
ASSI { 364}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 67 and name HB3 ))
3.100 1.200 1.200 peak 364 spectrum 1 weight 0.10000E+01 volume 0.24814E-02 ppm1 9.229 ppm2 1.977 CV 1
OR { 364}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 67 and name HB2 ))
ASSI { 366}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 17 and name HB ))
2.900 1.000 1.000 peak 366 spectrum 1 weight 0.10000E+01 volume 0.24400E-02 ppm1 9.230 ppm2 2.385 CV 1
ASSI { 368}
(( segid " " and resid 67 and name HN ))
( segid " " and resid 20 and name HD1%)
3.000 1.100 1.100 peak 368 spectrum 1 weight 0.10000E+01 volume 0.24267E-02 ppm1 9.041 ppm2 0.697 CV 1
ASSI { 369}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 66 and name HG2 ))
3.600 1.600 1.600 peak 369 spectrum 1 weight 0.10000E+01 volume 0.11979E-02 ppm1 9.041 ppm2 1.588 CV 1
OR { 369}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 66 and name HG3 ))
ASSI { 370}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 66 and name HB3 ))
3.400 1.400 1.400 peak 370 spectrum 1 weight 0.10000E+01 volume 0.28630E-02 ppm1 9.042 ppm2 1.695 CV 1
ASSI { 373}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 66 and name HB2 ))
2.700 0.900 0.900 peak 373 spectrum 1 weight 0.10000E+01 volume 0.32280E-02 ppm1 9.042 ppm2 1.852 CV 1
ASSI { 374}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HB2 ))
2.500 0.800 0.800 peak 374 spectrum 1 weight 0.10000E+01 volume 0.84022E-02 ppm1 9.041 ppm2 1.984 CV 1
OR { 374}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HB3 ))
ASSI { 376}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HG3 ))
2.200 0.600 0.600 peak 376 spectrum 1 weight 0.10000E+01 volume 0.60627E-02 ppm1 9.041 ppm2 2.261 CV 1
OR { 376}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HG2 ))
ASSI { 377}
(( segid " " and resid 66 and name HN ))
( segid " " and resid 65 and name HD2%)
3.100 1.200 1.200 peak 377 spectrum 1 weight 0.10000E+01 volume 0.25618E-02 ppm1 8.014 ppm2 0.618 CV 1
ASSI { 378}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 65 and name HB3 ))
2.600 0.800 0.800 peak 378 spectrum 1 weight 0.10000E+01 volume 0.26547E-02 ppm1 8.015 ppm2 1.177 CV 1
ASSI { 379}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 65 and name HB2 ))
3.300 1.400 1.400 peak 379 spectrum 1 weight 0.10000E+01 volume 0.22964E-02 ppm1 8.015 ppm2 1.377 CV 1
ASSI { 380}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 66 and name HG2 ))
2.900 1.100 1.100 peak 380 spectrum 1 weight 0.10000E+01 volume 0.20510E-02 ppm1 8.014 ppm2 1.589 CV 1
OR { 380}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 66 and name HG3 ))
ASSI { 381}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 66 and name HB3 ))
2.700 0.900 0.900 peak 381 spectrum 1 weight 0.10000E+01 volume 0.34545E-02 ppm1 8.014 ppm2 1.687 CV 1
ASSI { 382}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 66 and name HB2 ))
3.400 1.400 1.400 peak 382 spectrum 1 weight 0.10000E+01 volume 0.16505E-02 ppm1 8.014 ppm2 1.819 CV 1
ASSI { 384}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 83 and name HA ))
3.400 1.400 1.400 peak 384 spectrum 1 weight 0.10000E+01 volume 0.87738E-03 ppm1 8.061 ppm2 4.424 CV 1
ASSI { 387}
(( segid " " and resid 65 and name HN ))
( segid " " and resid 20 and name HD1%)
3.100 1.200 1.200 peak 387 spectrum 1 weight 0.10000E+01 volume 0.12203E-02 ppm1 7.145 ppm2 0.697 CV 1
ASSI { 388}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 65 and name HB3 ))
3.700 1.700 1.700 peak 388 spectrum 1 weight 0.10000E+01 volume 0.12464E-02 ppm1 7.145 ppm2 1.178 CV 1
ASSI { 389}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 65 and name HB2 ))
2.500 0.800 0.800 peak 389 spectrum 1 weight 0.10000E+01 volume 0.34132E-02 ppm1 7.145 ppm2 1.382 CV 1
OR { 389}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 65 and name HG ))
ASSI { 390}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 64 and name HB ))
2.800 1.000 1.000 peak 390 spectrum 1 weight 0.10000E+01 volume 0.20032E-02 ppm1 7.145 ppm2 1.623 CV 1
ASSI { 392}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 88 and name HA ))
4.500 2.500 1.500 peak 392 spectrum 1 weight 0.10000E+01 volume 0.45791E-03 ppm1 9.036 ppm2 4.945 CV 1
ASSI { 395}
(( segid " " and resid 95 and name HN ))
(( segid " " and resid 94 and name HA ))
2.800 1.000 1.000 peak 395 spectrum 1 weight 0.10000E+01 volume 0.22958E-02 ppm1 8.411 ppm2 4.372 CV 1
ASSI { 397}
(( segid " " and resid 64 and name HN ))
( segid " " and resid 20 and name HG2%)
3.300 1.400 1.400 peak 397 spectrum 1 weight 0.10000E+01 volume 0.10374E-02 ppm1 7.180 ppm2 0.712 CV 1
OR { 397}
(( segid " " and resid 64 and name HN ))
( segid " " and resid 20 and name HD1%)
ASSI { 398}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 65 and name HB2 ))
4.600 2.700 1.400 peak 398 spectrum 1 weight 0.10000E+01 volume 0.50264E-03 ppm1 7.182 ppm2 1.381 CV 1
OR { 398}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 65 and name HG ))
ASSI { 399}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HB ))
2.800 1.000 1.000 peak 399 spectrum 1 weight 0.10000E+01 volume 0.22834E-02 ppm1 7.180 ppm2 1.621 CV 1
ASSI { 400}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 4 and name HB3 ))
4.000 2.000 2.000 peak 400 spectrum 1 weight 0.10000E+01 volume 0.72175E-03 ppm1 8.401 ppm2 2.035 CV 1
ASSI { 401}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 5 and name HB3 ))
2.500 0.800 0.800 peak 401 spectrum 1 weight 0.10000E+01 volume 0.69239E-02 ppm1 8.317 ppm2 1.669 CV 1
OR { 401}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 5 and name HG ))
OR { 401}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 5 and name HB2 ))
ASSI { 402}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 5 and name HB2 ))
3.000 1.100 1.100 peak 402 spectrum 1 weight 0.10000E+01 volume 0.25883E-02 ppm1 8.380 ppm2 1.665 CV 1
OR { 402}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 5 and name HB3 ))
OR { 402}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 5 and name HG ))
ASSI { 404}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 59 and name HB2 ))
3.000 1.100 1.100 peak 404 spectrum 1 weight 0.10000E+01 volume 0.12938E-02 ppm1 8.302 ppm2 2.213 CV 1
ASSI { 408}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 3 and name HA ))
3.900 1.900 1.900 peak 408 spectrum 1 weight 0.10000E+01 volume 0.43198E-03 ppm1 8.402 ppm2 4.183 CV 1
ASSI { 409}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 4 and name HA ))
2.500 0.800 0.800 peak 409 spectrum 1 weight 0.10000E+01 volume 0.68678E-02 ppm1 8.317 ppm2 4.448 CV 1
ASSI { 414}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 7 and name HG3 ))
4.200 2.200 1.800 peak 414 spectrum 1 weight 0.10000E+01 volume 0.35835E-03 ppm1 8.336 ppm2 2.396 CV 1
OR { 414}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 7 and name HG2 ))
ASSI { 418}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 9 and name HB3 ))
2.400 0.700 0.700 peak 418 spectrum 1 weight 0.10000E+01 volume 0.58075E-02 ppm1 8.351 ppm2 1.821 CV 1
ASSI { 420}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 9 and name HB2 ))
3.200 1.300 1.300 peak 420 spectrum 1 weight 0.10000E+01 volume 0.13197E-02 ppm1 8.293 ppm2 1.886 CV 1
ASSI { 421}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 9 and name HB3 ))
3.800 1.800 1.800 peak 421 spectrum 1 weight 0.10000E+01 volume 0.94103E-03 ppm1 8.295 ppm2 1.825 CV 1
ASSI { 422}
(( segid " " and resid 94 and name HN ))
(( segid " " and resid 93 and name HB3 ))
3.900 1.900 1.900 peak 422 spectrum 1 weight 0.10000E+01 volume 0.40641E-03 ppm1 8.267 ppm2 1.631 CV 1
OR { 422}
(( segid " " and resid 94 and name HN ))
(( segid " " and resid 93 and name HB2 ))
ASSI { 423}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 12 and name HB ))
3.900 1.900 1.900 peak 423 spectrum 1 weight 0.10000E+01 volume 0.64673E-03 ppm1 8.294 ppm2 1.523 CV 1
OR { 423}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 12 and name HG13))
ASSI { 425}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 60 and name HB3 ))
3.800 1.800 1.800 peak 425 spectrum 1 weight 0.10000E+01 volume 0.84323E-03 ppm1 8.294 ppm2 3.004 CV 1
ASSI { 432}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 59 and name HG2 ))
4.000 2.000 2.000 peak 432 spectrum 1 weight 0.10000E+01 volume 0.66638E-03 ppm1 8.293 ppm2 1.991 CV 1
ASSI { 433}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 11 and name HB3 ))
3.800 1.800 1.800 peak 433 spectrum 1 weight 0.10000E+01 volume 0.92850E-03 ppm1 7.376 ppm2 2.845 CV 1
ASSI { 434}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 12 and name HB ))
2.400 0.700 0.700 peak 434 spectrum 1 weight 0.10000E+01 volume 0.57216E-02 ppm1 7.378 ppm2 1.531 CV 1
ASSI { 435}
(( segid " " and resid 12 and name HN ))
( segid " " and resid 12 and name HG2%)
3.100 1.200 1.200 peak 435 spectrum 1 weight 0.10000E+01 volume 0.29762E-02 ppm1 7.378 ppm2 0.805 CV 1
OR { 435}
(( segid " " and resid 12 and name HN ))
( segid " " and resid 12 and name HD1%)
ASSI { 436}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 11 and name HB2 ))
3.900 1.900 1.900 peak 436 spectrum 1 weight 0.10000E+01 volume 0.11753E-02 ppm1 7.377 ppm2 2.707 CV 1
ASSI { 437}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HB3 ))
4.300 2.300 1.700 peak 437 spectrum 1 weight 0.10000E+01 volume 0.56681E-03 ppm1 9.225 ppm2 3.283 CV 1
ASSI { 438}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HB ))
3.900 1.900 1.900 peak 438 spectrum 1 weight 0.10000E+01 volume 0.11763E-02 ppm1 9.223 ppm2 1.532 CV 1
ASSI { 439}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HB2 ))
3.100 1.200 1.200 peak 439 spectrum 1 weight 0.10000E+01 volume 0.11836E-02 ppm1 9.227 ppm2 2.437 CV 1
ASSI { 441}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 12 and name HD1%)
3.200 1.300 1.300 peak 441 spectrum 1 weight 0.10000E+01 volume 0.24259E-02 ppm1 9.225 ppm2 0.781 CV 1
OR { 441}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 12 and name HG2%)
ASSI { 442}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 73 and name HG2%)
3.300 1.400 1.400 peak 442 spectrum 1 weight 0.10000E+01 volume 0.13300E-02 ppm1 9.224 ppm2 0.577 CV 1
OR { 442}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 73 and name HG1%)
ASSI { 444}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HB2 ))
3.900 1.900 1.900 peak 444 spectrum 1 weight 0.10000E+01 volume 0.13474E-02 ppm1 8.748 ppm2 2.427 CV 1
ASSI { 445}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HB2 ))
2.600 0.800 0.800 peak 445 spectrum 1 weight 0.10000E+01 volume 0.44720E-02 ppm1 8.747 ppm2 1.890 CV 1
ASSI { 446}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HB3 ))
2.600 0.900 0.900 peak 446 spectrum 1 weight 0.10000E+01 volume 0.43903E-02 ppm1 8.747 ppm2 1.724 CV 1
ASSI { 447}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HG2 ))
3.800 1.800 1.800 peak 447 spectrum 1 weight 0.10000E+01 volume 0.11348E-02 ppm1 8.745 ppm2 1.468 CV 1
ASSI { 448}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HG3 ))
3.800 1.800 1.800 peak 448 spectrum 1 weight 0.10000E+01 volume 0.12318E-02 ppm1 8.748 ppm2 1.405 CV 1
ASSI { 449}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 72 and name HG2%)
3.800 1.800 1.800 peak 449 spectrum 1 weight 0.10000E+01 volume 0.80107E-03 ppm1 8.743 ppm2 0.844 CV 1
ASSI { 450}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HB3 ))
2.800 1.000 1.000 peak 450 spectrum 1 weight 0.10000E+01 volume 0.23251E-02 ppm1 8.748 ppm2 3.303 CV 1
ASSI { 451}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 70 and name HG3 ))
4.600 2.700 1.400 peak 451 spectrum 1 weight 0.10000E+01 volume 0.37919E-03 ppm1 9.046 ppm2 2.130 CV 1
ASSI { 452}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HB2 ))
4.100 2.100 1.900 peak 452 spectrum 1 weight 0.10000E+01 volume 0.11127E-02 ppm1 9.050 ppm2 1.894 CV 1
ASSI { 453}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HG3 ))
3.800 1.800 1.800 peak 453 spectrum 1 weight 0.10000E+01 volume 0.97285E-03 ppm1 9.054 ppm2 1.401 CV 1
ASSI { 456}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HB3 ))
3.600 1.600 1.600 peak 456 spectrum 1 weight 0.10000E+01 volume 0.13525E-02 ppm1 9.049 ppm2 1.720 CV 1
OR { 456}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HD3 ))
OR { 456}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HD2 ))
ASSI { 457}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HG2 ))
3.800 1.800 1.800 peak 457 spectrum 1 weight 0.10000E+01 volume 0.88094E-03 ppm1 9.048 ppm2 1.475 CV 1
ASSI { 458}
(( segid " " and resid 15 and name HN ))
( segid " " and resid 72 and name HG2%)
4.200 2.200 1.800 peak 458 spectrum 1 weight 0.10000E+01 volume 0.85288E-03 ppm1 9.049 ppm2 0.857 CV 1
ASSI { 460}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 30 and name HB2 ))
4.300 2.300 1.700 peak 460 spectrum 1 weight 0.10000E+01 volume 0.58358E-03 ppm1 8.104 ppm2 2.133 CV 1
ASSI { 461}
(( segid " " and resid 16 and name HN ))
( segid " " and resid 18 and name HG2%)
4.400 2.400 1.600 peak 461 spectrum 1 weight 0.10000E+01 volume 0.33345E-03 ppm1 8.108 ppm2 1.019 CV 1
ASSI { 463}
(( segid " " and resid 16 and name HN ))
( segid " " and resid 71 and name HG2%)
4.300 2.300 1.700 peak 463 spectrum 1 weight 0.10000E+01 volume 0.36469E-03 ppm1 8.105 ppm2 0.356 CV 1
ASSI { 464}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 16 and name HB2 ))
2.500 0.800 0.800 peak 464 spectrum 1 weight 0.10000E+01 volume 0.43683E-02 ppm1 8.105 ppm2 1.662 CV 1
OR { 464}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 16 and name HB3 ))
ASSI { 465}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 16 and name HG2 ))
3.900 1.900 1.900 peak 465 spectrum 1 weight 0.10000E+01 volume 0.10483E-02 ppm1 8.105 ppm2 1.346 CV 1
ASSI { 466}
(( segid " " and resid 16 and name HN ))
( segid " " and resid 29 and name HG1%)
2.800 1.000 1.000 peak 466 spectrum 1 weight 0.10000E+01 volume 0.38632E-02 ppm1 8.106 ppm2 0.565 CV 1
OR { 466}
(( segid " " and resid 16 and name HN ))
( segid " " and resid 29 and name HG2%)
ASSI { 467}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HB ))
2.400 0.700 0.700 peak 467 spectrum 1 weight 0.10000E+01 volume 0.33493E-02 ppm1 8.817 ppm2 2.386 CV 1
ASSI { 469}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HG12))
3.300 1.300 1.300 peak 469 spectrum 1 weight 0.10000E+01 volume 0.25856E-02 ppm1 8.818 ppm2 1.535 CV 1
ASSI { 471}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 58 and name HA ))
3.600 1.600 1.600 peak 471 spectrum 1 weight 0.10000E+01 volume 0.58176E-03 ppm1 8.409 ppm2 4.651 CV 1
ASSI { 472}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 71 and name HG1%)
4.000 2.000 2.000 peak 472 spectrum 1 weight 0.10000E+01 volume 0.67375E-03 ppm1 8.814 ppm2 0.343 CV 1
ASSI { 473}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HB3 ))
2.800 1.000 1.000 peak 473 spectrum 1 weight 0.10000E+01 volume 0.20613E-02 ppm1 8.818 ppm2 1.662 CV 1
OR { 473}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HB2 ))
ASSI { 474}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 58 and name HB3 ))
3.500 1.500 1.500 peak 474 spectrum 1 weight 0.10000E+01 volume 0.12021E-02 ppm1 8.404 ppm2 1.772 CV 1
ASSI { 475}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 19 and name HB3 ))
4.900 3.000 1.100 peak 475 spectrum 1 weight 0.10000E+01 volume 0.31252E-03 ppm1 9.204 ppm2 1.889 CV 1
ASSI { 477}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HG13))
4.400 2.400 1.600 peak 477 spectrum 1 weight 0.10000E+01 volume 0.31380E-03 ppm1 9.227 ppm2 1.332 CV 1
ASSI { 479}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 27 and name HB% )
3.900 1.900 1.900 peak 479 spectrum 1 weight 0.10000E+01 volume 0.57186E-03 ppm1 9.225 ppm2 1.133 CV 1
ASSI { 480}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 18 and name HG2%)
2.600 0.800 0.800 peak 480 spectrum 1 weight 0.10000E+01 volume 0.23303E-02 ppm1 9.220 ppm2 1.016 CV 1
ASSI { 481}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 17 and name HG2%)
2.500 0.800 0.800 peak 481 spectrum 1 weight 0.10000E+01 volume 0.32484E-02 ppm1 9.221 ppm2 0.765 CV 1
ASSI { 483}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 19 and name HB2 ))
3.000 1.100 1.100 peak 483 spectrum 1 weight 0.10000E+01 volume 0.23944E-02 ppm1 7.400 ppm2 1.993 CV 1
ASSI { 484}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 19 and name HB3 ))
2.500 0.800 0.800 peak 484 spectrum 1 weight 0.10000E+01 volume 0.27859E-02 ppm1 7.400 ppm2 1.882 CV 1
ASSI { 486}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 19 and name HG3 ))
4.000 2.000 2.000 peak 486 spectrum 1 weight 0.10000E+01 volume 0.10098E-02 ppm1 7.398 ppm2 1.581 CV 1
ASSI { 487}
(( segid " " and resid 19 and name HN ))
( segid " " and resid 27 and name HB% )
3.500 1.500 1.500 peak 487 spectrum 1 weight 0.10000E+01 volume 0.11214E-02 ppm1 7.399 ppm2 1.163 CV 1
ASSI { 488}
(( segid " " and resid 19 and name HN ))
( segid " " and resid 18 and name HG2%)
3.900 1.900 1.900 peak 488 spectrum 1 weight 0.10000E+01 volume 0.13697E-02 ppm1 7.400 ppm2 1.018 CV 1
ASSI { 489}
(( segid " " and resid 19 and name HN ))
( segid " " and resid 17 and name HG2%)
2.400 0.700 0.700 peak 489 spectrum 1 weight 0.10000E+01 volume 0.55495E-02 ppm1 7.400 ppm2 0.766 CV 1
ASSI { 491}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 20 and name HB ))
2.400 0.700 0.700 peak 491 spectrum 1 weight 0.10000E+01 volume 0.57356E-02 ppm1 9.370 ppm2 1.817 CV 1
ASSI { 492}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 19 and name HG2 ))
2.900 1.000 1.000 peak 492 spectrum 1 weight 0.10000E+01 volume 0.17251E-02 ppm1 9.371 ppm2 1.663 CV 1
ASSI { 493}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 19 and name HG3 ))
3.400 1.500 1.500 peak 493 spectrum 1 weight 0.10000E+01 volume 0.15238E-02 ppm1 9.371 ppm2 1.573 CV 1
ASSI { 494}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 20 and name HG12))
3.500 1.500 1.500 peak 494 spectrum 1 weight 0.10000E+01 volume 0.22093E-02 ppm1 9.369 ppm2 1.460 CV 1
ASSI { 495}
(( segid " " and resid 20 and name HN ))
( segid " " and resid 17 and name HG2%)
3.500 1.500 1.500 peak 495 spectrum 1 weight 0.10000E+01 volume 0.14306E-02 ppm1 9.371 ppm2 0.784 CV 1
ASSI { 496}
(( segid " " and resid 20 and name HN ))
( segid " " and resid 20 and name HD1%)
3.300 1.300 1.300 peak 496 spectrum 1 weight 0.10000E+01 volume 0.26295E-02 ppm1 9.370 ppm2 0.707 CV 1
OR { 496}
(( segid " " and resid 20 and name HN ))
( segid " " and resid 20 and name HG2%)
ASSI { 499}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 19 and name HB2 ))
3.800 1.800 1.800 peak 499 spectrum 1 weight 0.10000E+01 volume 0.17595E-02 ppm1 9.369 ppm2 1.994 CV 1
ASSI { 501}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 28 and name HB2 ))
2.600 0.800 0.800 peak 501 spectrum 1 weight 0.10000E+01 volume 0.21982E-02 ppm1 7.399 ppm2 2.950 CV 1
ASSI { 502}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 29 and name HA ))
3.000 1.100 1.100 peak 502 spectrum 1 weight 0.10000E+01 volume 0.20223E-02 ppm1 9.219 ppm2 4.652 CV 1
ASSI { 506}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HA ))
2.900 1.100 1.100 peak 506 spectrum 1 weight 0.10000E+01 volume 0.13831E-02 ppm1 8.816 ppm2 4.277 CV 1
ASSI { 509}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 14 and name HN ))
4.600 2.600 1.400 peak 509 spectrum 1 weight 0.10000E+01 volume 0.34400E-03 ppm1 9.221 ppm2 8.746 CV 1
ASSI { 510}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HB3 ))
2.700 0.900 0.900 peak 510 spectrum 1 weight 0.10000E+01 volume 0.29227E-02 ppm1 8.978 ppm2 2.768 CV 1
ASSI { 512}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HB2 ))
2.900 1.100 1.100 peak 512 spectrum 1 weight 0.10000E+01 volume 0.23543E-02 ppm1 8.978 ppm2 2.128 CV 1
ASSI { 513}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HB ))
3.500 1.500 1.500 peak 513 spectrum 1 weight 0.10000E+01 volume 0.12498E-02 ppm1 8.976 ppm2 1.668 CV 1
ASSI { 517}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 29 and name HG1%)
2.600 0.900 0.900 peak 517 spectrum 1 weight 0.10000E+01 volume 0.40472E-02 ppm1 8.979 ppm2 0.565 CV 1
OR { 517}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 29 and name HG2%)
ASSI { 522}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 36 and name HB3 ))
3.200 1.300 1.300 peak 522 spectrum 1 weight 0.10000E+01 volume 0.11028E-02 ppm1 8.997 ppm2 3.317 CV 1
ASSI { 523}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 36 and name HB2 ))
4.400 2.400 1.600 peak 523 spectrum 1 weight 0.10000E+01 volume 0.76049E-03 ppm1 8.996 ppm2 3.115 CV 1
ASSI { 524}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HB3 ))
2.900 1.000 1.000 peak 524 spectrum 1 weight 0.10000E+01 volume 0.16460E-02 ppm1 8.996 ppm2 2.991 CV 1
ASSI { 526}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HB ))
2.700 0.900 0.900 peak 526 spectrum 1 weight 0.10000E+01 volume 0.25759E-02 ppm1 8.997 ppm2 1.680 CV 1
ASSI { 528}
(( segid " " and resid 29 and name HN ))
( segid " " and resid 29 and name HG2%)
2.700 0.900 0.900 peak 528 spectrum 1 weight 0.10000E+01 volume 0.46797E-02 ppm1 8.997 ppm2 0.568 CV 1
OR { 528}
(( segid " " and resid 29 and name HN ))
( segid " " and resid 29 and name HG1%)
ASSI { 529}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 19 and name HB2 ))
5.100 3.200 0.900 peak 529 spectrum 1 weight 0.10000E+01 volume 0.32017E-03 ppm1 8.990 ppm2 1.984 CV 1
ASSI { 530}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 19 and name HB3 ))
3.600 1.600 1.600 peak 530 spectrum 1 weight 0.10000E+01 volume 0.63336E-03 ppm1 8.984 ppm2 1.857 CV 1
ASSI { 531}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 19 and name HG3 ))
4.900 3.000 1.100 peak 531 spectrum 1 weight 0.10000E+01 volume 0.38366E-03 ppm1 8.971 ppm2 1.589 CV 1
ASSI { 532}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 17 and name HG13))
4.000 2.000 2.000 peak 532 spectrum 1 weight 0.10000E+01 volume 0.37633E-03 ppm1 8.976 ppm2 1.334 CV 1
ASSI { 533}
(( segid " " and resid 28 and name HN ))
( segid " " and resid 17 and name HG2%)
3.300 1.400 1.400 peak 533 spectrum 1 weight 0.10000E+01 volume 0.11040E-02 ppm1 8.982 ppm2 0.762 CV 1
ASSI { 537}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HB2 ))
2.500 0.800 0.800 peak 537 spectrum 1 weight 0.10000E+01 volume 0.24859E-02 ppm1 8.990 ppm2 2.953 CV 1
ASSI { 538}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 40 and name HA ))
3.800 1.800 1.800 peak 538 spectrum 1 weight 0.10000E+01 volume 0.11967E-02 ppm1 8.172 ppm2 4.417 CV 1
ASSI { 540}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 41 and name HB2 ))
4.600 2.700 1.400 peak 540 spectrum 1 weight 0.10000E+01 volume 0.35234E-03 ppm1 8.176 ppm2 1.388 CV 1
ASSI { 541}
(( segid " " and resid 27 and name HN ))
( segid " " and resid 27 and name HB% )
2.500 0.800 0.800 peak 541 spectrum 1 weight 0.10000E+01 volume 0.45178E-02 ppm1 8.173 ppm2 1.158 CV 1
ASSI { 544}
(( segid " " and resid 27 and name HN ))
( segid " " and resid 39 and name HD2%)
3.800 1.900 1.900 peak 544 spectrum 1 weight 0.10000E+01 volume 0.49789E-03 ppm1 8.172 ppm2 0.322 CV 1
ASSI { 545}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HB2 ))
3.500 1.500 1.500 peak 545 spectrum 1 weight 0.10000E+01 volume 0.12322E-02 ppm1 7.325 ppm2 2.325 CV 1
OR { 545}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HG3 ))
ASSI { 546}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HB3 ))
3.700 1.700 1.700 peak 546 spectrum 1 weight 0.10000E+01 volume 0.14489E-02 ppm1 7.326 ppm2 2.211 CV 1
ASSI { 548}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 41 and name HB2 ))
4.100 2.100 1.900 peak 548 spectrum 1 weight 0.10000E+01 volume 0.33560E-03 ppm1 7.327 ppm2 1.389 CV 1
ASSI { 549}
(( segid " " and resid 26 and name HN ))
( segid " " and resid 61 and name HG2%)
2.600 0.900 0.900 peak 549 spectrum 1 weight 0.10000E+01 volume 0.27894E-02 ppm1 7.327 ppm2 0.879 CV 1
ASSI { 550}
(( segid " " and resid 26 and name HN ))
( segid " " and resid 20 and name HG2%)
3.900 1.900 1.900 peak 550 spectrum 1 weight 0.10000E+01 volume 0.73605E-03 ppm1 7.328 ppm2 0.691 CV 1
ASSI { 554}
(( segid " " and resid 26 and name HN ))
( segid " " and resid 24 and name HD1%)
3.300 1.400 1.400 peak 554 spectrum 1 weight 0.10000E+01 volume 0.56601E-03 ppm1 7.328 ppm2 1.102 CV 1
ASSI { 558}
(( segid " " and resid 25 and name HN ))
( segid " " and resid 61 and name HG2%)
3.600 1.600 1.600 peak 558 spectrum 1 weight 0.10000E+01 volume 0.12723E-02 ppm1 7.977 ppm2 0.881 CV 1
ASSI { 559}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 25 and name HG3 ))
2.700 0.900 0.900 peak 559 spectrum 1 weight 0.10000E+01 volume 0.41426E-02 ppm1 7.976 ppm2 2.318 CV 1
OR { 559}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 25 and name HG2 ))
OR { 559}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 25 and name HB2 ))
ASSI { 566}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 22 and name HA ))
4.300 2.300 1.700 peak 566 spectrum 1 weight 0.10000E+01 volume 0.29093E-03 ppm1 7.289 ppm2 4.214 CV 1
ASSI { 567}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 23 and name HB3 ))
3.600 1.600 1.600 peak 567 spectrum 1 weight 0.10000E+01 volume 0.77137E-03 ppm1 7.304 ppm2 4.041 CV 1
OR { 567}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 23 and name HB2 ))
ASSI { 569}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 25 and name HA ))
4.900 3.000 1.100 peak 569 spectrum 1 weight 0.10000E+01 volume 0.54586E-03 ppm1 7.301 ppm2 3.786 CV 1
ASSI { 572}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 24 and name HB3 ))
3.200 1.300 1.300 peak 572 spectrum 1 weight 0.10000E+01 volume 0.19186E-02 ppm1 7.300 ppm2 1.834 CV 1
ASSI { 573}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 24 and name HB2 ))
3.000 1.200 1.200 peak 573 spectrum 1 weight 0.10000E+01 volume 0.34453E-02 ppm1 7.301 ppm2 1.726 CV 1
ASSI { 579}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 21 and name HG3 ))
3.700 1.700 1.700 peak 579 spectrum 1 weight 0.10000E+01 volume 0.14369E-02 ppm1 8.832 ppm2 2.341 CV 1
OR { 579}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 21 and name HG2 ))
ASSI { 580}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 21 and name HB2 ))
2.900 1.000 1.000 peak 580 spectrum 1 weight 0.10000E+01 volume 0.17186E-02 ppm1 8.833 ppm2 2.202 CV 1
ASSI { 581}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 21 and name HB3 ))
2.800 1.000 1.000 peak 581 spectrum 1 weight 0.10000E+01 volume 0.29550E-02 ppm1 8.833 ppm2 1.867 CV 1
ASSI { 582}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HG12))
4.700 2.700 1.300 peak 582 spectrum 1 weight 0.10000E+01 volume 0.43394E-03 ppm1 8.835 ppm2 1.439 CV 1
ASSI { 583}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 24 and name HD1%)
3.200 1.300 1.300 peak 583 spectrum 1 weight 0.10000E+01 volume 0.90400E-03 ppm1 8.834 ppm2 1.131 CV 1
ASSI { 585}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 20 and name HG2%)
2.800 1.000 1.000 peak 585 spectrum 1 weight 0.10000E+01 volume 0.34304E-02 ppm1 8.832 ppm2 0.707 CV 1
ASSI { 587}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HA ))
2.200 0.600 0.600 peak 587 spectrum 1 weight 0.10000E+01 volume 0.64833E-02 ppm1 8.833 ppm2 4.266 CV 1
ASSI { 589}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 22 and name HD2 ))
4.900 3.000 1.100 peak 589 spectrum 1 weight 0.10000E+01 volume 0.36360E-03 ppm1 8.835 ppm2 3.903 CV 1
ASSI { 591}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 18 and name HN ))
3.700 1.800 1.800 peak 591 spectrum 1 weight 0.10000E+01 volume 0.70272E-03 ppm1 8.984 ppm2 9.212 CV 1
ASSI { 593}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 32 and name HA2 ))
4.700 2.700 1.300 peak 593 spectrum 1 weight 0.10000E+01 volume 0.41279E-03 ppm1 9.017 ppm2 3.680 CV 1
ASSI { 594}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 31 and name HB2 ))
4.300 2.300 1.700 peak 594 spectrum 1 weight 0.10000E+01 volume 0.61906E-03 ppm1 9.021 ppm2 3.127 CV 1
ASSI { 596}
(( segid " " and resid 31 and name HN ))
( segid " " and resid 29 and name HG1%)
3.700 1.700 1.700 peak 596 spectrum 1 weight 0.10000E+01 volume 0.75166E-03 ppm1 9.022 ppm2 0.568 CV 1
ASSI { 598}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HB3 ))
4.800 2.900 1.200 peak 598 spectrum 1 weight 0.10000E+01 volume 0.46520E-03 ppm1 8.245 ppm2 2.152 CV 1
ASSI { 599}
(( segid " " and resid 33 and name HN ))
( segid " " and resid 33 and name HB% )
2.600 0.800 0.800 peak 599 spectrum 1 weight 0.10000E+01 volume 0.41341E-02 ppm1 6.803 ppm2 1.110 CV 1
ASSI { 600}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 34 and name HB2 ))
2.800 1.000 1.000 peak 600 spectrum 1 weight 0.10000E+01 volume 0.27787E-02 ppm1 8.706 ppm2 2.031 CV 1
OR { 600}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 34 and name HB3 ))
ASSI { 602}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 63 and name HB3 ))
3.300 1.400 1.400 peak 602 spectrum 1 weight 0.10000E+01 volume 0.17810E-02 ppm1 7.184 ppm2 2.849 CV 1
OR { 602}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 63 and name HB2 ))
ASSI { 603}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 34 and name HG2 ))
4.300 2.300 1.700 peak 603 spectrum 1 weight 0.10000E+01 volume 0.58170E-03 ppm1 8.704 ppm2 2.296 CV 1
ASSI { 604}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 35 and name HB2 ))
4.800 2.900 1.200 peak 604 spectrum 1 weight 0.10000E+01 volume 0.35428E-03 ppm1 8.707 ppm2 1.621 CV 1
ASSI { 606}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 34 and name HG3 ))
4.400 2.400 1.600 peak 606 spectrum 1 weight 0.10000E+01 volume 0.39288E-03 ppm1 7.689 ppm2 2.230 CV 1
ASSI { 607}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 34 and name HB2 ))
2.700 0.900 0.900 peak 607 spectrum 1 weight 0.10000E+01 volume 0.44100E-02 ppm1 7.686 ppm2 2.032 CV 1
OR { 607}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 34 and name HB3 ))
ASSI { 610}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 35 and name HB2 ))
2.500 0.800 0.800 peak 610 spectrum 1 weight 0.10000E+01 volume 0.54790E-02 ppm1 7.683 ppm2 1.604 CV 1
OR { 610}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 35 and name HG2 ))
ASSI { 611}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 35 and name HB2 ))
4.100 2.100 1.900 peak 611 spectrum 1 weight 0.10000E+01 volume 0.34152E-03 ppm1 8.832 ppm2 1.607 CV 1
OR { 611}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 35 and name HG2 ))
ASSI { 612}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 36 and name HB3 ))
3.200 1.300 1.300 peak 612 spectrum 1 weight 0.10000E+01 volume 0.14943E-02 ppm1 9.796 ppm2 3.320 CV 1
ASSI { 613}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 36 and name HB2 ))
3.900 1.900 1.900 peak 613 spectrum 1 weight 0.10000E+01 volume 0.13118E-02 ppm1 9.797 ppm2 3.104 CV 1
ASSI { 614}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 29 and name HB ))
3.500 1.500 1.500 peak 614 spectrum 1 weight 0.10000E+01 volume 0.65288E-03 ppm1 9.793 ppm2 1.679 CV 1
ASSI { 618}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 63 and name HB3 ))
2.400 0.700 0.700 peak 618 spectrum 1 weight 0.10000E+01 volume 0.76596E-02 ppm1 7.833 ppm2 2.842 CV 1
OR { 618}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 63 and name HB2 ))
ASSI { 624}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HB3 ))
2.700 0.900 0.900 peak 624 spectrum 1 weight 0.10000E+01 volume 0.28129E-02 ppm1 8.888 ppm2 1.679 CV 1
ASSI { 625}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 87 and name HG ))
3.900 1.900 1.900 peak 625 spectrum 1 weight 0.10000E+01 volume 0.68339E-03 ppm1 8.885 ppm2 1.503 CV 1
OR { 625}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 87 and name HB2 ))
ASSI { 626}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 27 and name HB% )
3.300 1.300 1.300 peak 626 spectrum 1 weight 0.10000E+01 volume 0.12687E-02 ppm1 8.888 ppm2 1.164 CV 1
ASSI { 628}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 39 and name HD2%)
4.100 2.100 1.900 peak 628 spectrum 1 weight 0.10000E+01 volume 0.55566E-03 ppm1 8.890 ppm2 0.317 CV 1
ASSI { 632}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 60 and name HB3 ))
3.500 1.600 1.600 peak 632 spectrum 1 weight 0.10000E+01 volume 0.13395E-02 ppm1 7.831 ppm2 2.990 CV 1
ASSI { 633}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 37 and name HN ))
4.300 2.300 1.700 peak 633 spectrum 1 weight 0.10000E+01 volume 0.29839E-03 ppm1 9.023 ppm2 9.808 CV 1
ASSI { 636}
(( segid " " and resid 85 and name HN ))
( segid " " and resid 85 and name HB% )
2.400 0.700 0.700 peak 636 spectrum 1 weight 0.10000E+01 volume 0.77698E-02 ppm1 8.451 ppm2 1.473 CV 1
ASSI { 637}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HB3 ))
3.600 1.700 1.700 peak 637 spectrum 1 weight 0.10000E+01 volume 0.10505E-02 ppm1 8.477 ppm2 2.566 CV 1
ASSI { 639}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HB3 ))
2.300 0.700 0.700 peak 639 spectrum 1 weight 0.10000E+01 volume 0.41761E-02 ppm1 8.474 ppm2 1.993 CV 1
ASSI { 640}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HG ))
3.500 1.500 1.500 peak 640 spectrum 1 weight 0.10000E+01 volume 0.19100E-02 ppm1 8.475 ppm2 1.620 CV 1
ASSI { 641}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HB2 ))
2.800 1.000 1.000 peak 641 spectrum 1 weight 0.10000E+01 volume 0.34702E-02 ppm1 8.474 ppm2 1.395 CV 1
ASSI { 642}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 41 and name HD2%)
3.900 1.900 1.900 peak 642 spectrum 1 weight 0.10000E+01 volume 0.15577E-02 ppm1 8.474 ppm2 0.893 CV 1
ASSI { 643}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 41 and name HD1%)
3.900 1.900 1.900 peak 643 spectrum 1 weight 0.10000E+01 volume 0.15624E-02 ppm1 8.473 ppm2 0.800 CV 1
ASSI { 644}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HG ))
3.100 1.200 1.200 peak 644 spectrum 1 weight 0.10000E+01 volume 0.11554E-02 ppm1 8.760 ppm2 1.655 CV 1
ASSI { 645}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 41 and name HD1%)
4.300 2.300 1.700 peak 645 spectrum 1 weight 0.10000E+01 volume 0.43723E-03 ppm1 8.753 ppm2 0.803 CV 1
ASSI { 648}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HB3 ))
2.500 2.500 3.500 peak 648 spectrum 1 weight 0.10000E+01 volume 0.34181E-02 ppm1 8.755 ppm2 1.873 CV 1
ASSI { 649}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HG3 ))
2.600 0.800 0.800 peak 649 spectrum 1 weight 0.10000E+01 volume 0.28324E-02 ppm1 8.754 ppm2 1.552 CV 1
OR { 649}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HG2 ))
ASSI { 650}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HB2 ))
3.500 1.500 1.500 peak 650 spectrum 1 weight 0.10000E+01 volume 0.16119E-02 ppm1 8.755 ppm2 1.388 CV 1
ASSI { 651}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 41 and name HD2%)
4.000 2.000 2.000 peak 651 spectrum 1 weight 0.10000E+01 volume 0.70101E-03 ppm1 8.756 ppm2 0.894 CV 1
ASSI { 653}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HG2 ))
3.000 1.100 1.100 peak 653 spectrum 1 weight 0.10000E+01 volume 0.90441E-03 ppm1 7.885 ppm2 2.915 CV 1
ASSI { 654}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 41 and name HA ))
3.700 1.700 1.700 peak 654 spectrum 1 weight 0.10000E+01 volume 0.47120E-03 ppm1 7.886 ppm2 3.908 CV 1
ASSI { 655}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 44 and name HA ))
4.800 2.900 1.200 peak 655 spectrum 1 weight 0.10000E+01 volume 0.31322E-03 ppm1 7.890 ppm2 3.818 CV 1
ASSI { 656}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HB2 ))
3.400 1.400 1.400 peak 656 spectrum 1 weight 0.10000E+01 volume 0.10900E-02 ppm1 7.887 ppm2 3.127 CV 1
ASSI { 657}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HG3 ))
3.200 1.300 1.300 peak 657 spectrum 1 weight 0.10000E+01 volume 0.27118E-02 ppm1 7.886 ppm2 2.181 CV 1
ASSI { 658}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HB3 ))
3.000 1.100 1.100 peak 658 spectrum 1 weight 0.10000E+01 volume 0.30818E-02 ppm1 7.886 ppm2 1.959 CV 1
ASSI { 659}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 42 and name HG3 ))
3.200 1.200 1.200 peak 659 spectrum 1 weight 0.10000E+01 volume 0.12421E-02 ppm1 7.893 ppm2 1.559 CV 1
OR { 659}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 42 and name HG2 ))
ASSI { 660}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 41 and name HB2 ))
4.400 2.500 1.600 peak 660 spectrum 1 weight 0.10000E+01 volume 0.43849E-03 ppm1 7.881 ppm2 1.397 CV 1
ASSI { 664}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 41 and name HA ))
3.600 1.600 1.600 peak 664 spectrum 1 weight 0.10000E+01 volume 0.57221E-03 ppm1 7.683 ppm2 3.906 CV 1
ASSI { 666}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HB ))
2.400 0.700 0.700 peak 666 spectrum 1 weight 0.10000E+01 volume 0.38433E-02 ppm1 7.685 ppm2 2.114 CV 1
ASSI { 667}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 59 and name HG2 ))
3.600 1.600 1.600 peak 667 spectrum 1 weight 0.10000E+01 volume 0.10609E-02 ppm1 7.679 ppm2 1.994 CV 1
OR { 667}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 59 and name HG3 ))
ASSI { 668}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HG12))
3.000 1.100 1.100 peak 668 spectrum 1 weight 0.10000E+01 volume 0.31081E-02 ppm1 7.681 ppm2 1.849 CV 1
ASSI { 670}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 41 and name HG ))
4.200 2.200 1.800 peak 670 spectrum 1 weight 0.10000E+01 volume 0.40468E-03 ppm1 7.689 ppm2 1.624 CV 1
ASSI { 671}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 42 and name HG2 ))
3.500 1.500 1.500 peak 671 spectrum 1 weight 0.10000E+01 volume 0.36881E-03 ppm1 7.676 ppm2 1.543 CV 1
OR { 671}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 42 and name HG3 ))
ASSI { 672}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 41 and name HB2 ))
4.600 2.600 1.400 peak 672 spectrum 1 weight 0.10000E+01 volume 0.41004E-03 ppm1 7.680 ppm2 1.402 CV 1
ASSI { 673}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 41 and name HD2%)
4.500 2.600 1.500 peak 673 spectrum 1 weight 0.10000E+01 volume 0.60059E-03 ppm1 7.681 ppm2 0.919 CV 1
ASSI { 675}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 44 and name HD1%)
3.400 1.400 1.400 peak 675 spectrum 1 weight 0.10000E+01 volume 0.23930E-02 ppm1 7.680 ppm2 0.570 CV 1
ASSI { 676}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HG13))
3.000 1.100 1.100 peak 676 spectrum 1 weight 0.10000E+01 volume 0.15620E-02 ppm1 7.682 ppm2 0.497 CV 1
ASSI { 677}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HA ))
3.000 1.100 1.100 peak 677 spectrum 1 weight 0.10000E+01 volume 0.19163E-02 ppm1 7.835 ppm2 4.098 CV 1
ASSI { 685}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 46 and name HB2 ))
2.500 0.800 0.800 peak 685 spectrum 1 weight 0.10000E+01 volume 0.45111E-02 ppm1 8.483 ppm2 1.755 CV 1
ASSI { 686}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 46 and name HG3 ))
3.100 1.200 1.200 peak 686 spectrum 1 weight 0.10000E+01 volume 0.35077E-02 ppm1 8.482 ppm2 1.571 CV 1
OR { 686}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 46 and name HG2 ))
ASSI { 687}
(( segid " " and resid 46 and name HN ))
( segid " " and resid 94 and name HB% )
3.500 1.500 1.500 peak 687 spectrum 1 weight 0.10000E+01 volume 0.70697E-03 ppm1 8.478 ppm2 1.427 CV 1
ASSI { 692}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HG2 ))
4.000 2.000 2.000 peak 692 spectrum 1 weight 0.10000E+01 volume 0.16203E-02 ppm1 8.893 ppm2 1.926 CV 1
ASSI { 693}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HB2 ))
2.400 0.700 0.700 peak 693 spectrum 1 weight 0.10000E+01 volume 0.55607E-02 ppm1 8.896 ppm2 1.754 CV 1
OR { 693}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HB3 ))
ASSI { 694}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 46 and name HG2 ))
3.600 1.600 1.600 peak 694 spectrum 1 weight 0.10000E+01 volume 0.93651E-03 ppm1 8.897 ppm2 1.577 CV 1
OR { 694}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 46 and name HG3 ))
ASSI { 695}
(( segid " " and resid 47 and name HN ))
( segid " " and resid 45 and name HB% )
3.000 1.100 1.100 peak 695 spectrum 1 weight 0.10000E+01 volume 0.17003E-02 ppm1 8.901 ppm2 1.150 CV 1
ASSI { 696}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 47 and name HG2 ))
4.300 2.300 1.700 peak 696 spectrum 1 weight 0.10000E+01 volume 0.60496E-03 ppm1 7.801 ppm2 1.921 CV 1
ASSI { 697}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 45 and name HB% )
3.700 1.700 1.700 peak 697 spectrum 1 weight 0.10000E+01 volume 0.69643E-03 ppm1 7.793 ppm2 1.149 CV 1
ASSI { 698}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 44 and name HG2%)
4.000 2.000 2.000 peak 698 spectrum 1 weight 0.10000E+01 volume 0.89640E-03 ppm1 7.801 ppm2 0.829 CV 1
ASSI { 699}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 48 and name HB3 ))
3.700 1.700 1.700 peak 699 spectrum 1 weight 0.10000E+01 volume 0.16745E-02 ppm1 7.798 ppm2 3.065 CV 1
ASSI { 700}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 48 and name HB2 ))
2.400 0.700 0.700 peak 700 spectrum 1 weight 0.10000E+01 volume 0.37124E-02 ppm1 7.797 ppm2 2.717 CV 1
ASSI { 701}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 47 and name HB2 ))
2.900 1.100 1.100 peak 701 spectrum 1 weight 0.10000E+01 volume 0.23786E-02 ppm1 7.795 ppm2 1.757 CV 1
OR { 701}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 47 and name HB3 ))
OR { 701}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 47 and name HG3 ))
ASSI { 703}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 48 and name HB3 ))
3.700 1.700 1.700 peak 703 spectrum 1 weight 0.10000E+01 volume 0.13980E-02 ppm1 7.906 ppm2 3.047 CV 1
ASSI { 705}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 49 and name HB2 ))
3.000 1.100 1.100 peak 705 spectrum 1 weight 0.10000E+01 volume 0.45242E-02 ppm1 7.905 ppm2 2.808 CV 1
ASSI { 708}
(( segid " " and resid 49 and name HN ))
( segid " " and resid 44 and name HG2%)
4.600 2.600 1.400 peak 708 spectrum 1 weight 0.10000E+01 volume 0.38030E-03 ppm1 7.913 ppm2 0.813 CV 1
ASSI { 710}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 37 and name HA1 ))
3.500 1.600 1.600 peak 710 spectrum 1 weight 0.10000E+01 volume 0.71805E-03 ppm1 8.450 ppm2 5.134 CV 1
ASSI { 714}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 51 and name HN ))
4.200 2.200 1.800 peak 714 spectrum 1 weight 0.10000E+01 volume 0.33616E-03 ppm1 7.805 ppm2 8.738 CV 1
ASSI { 718}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 50 and name HB3 ))
4.400 2.400 1.600 peak 718 spectrum 1 weight 0.10000E+01 volume 0.55768E-03 ppm1 8.746 ppm2 2.522 CV 1
ASSI { 719}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 50 and name HB2 ))
4.400 2.400 1.600 peak 719 spectrum 1 weight 0.10000E+01 volume 0.61679E-03 ppm1 8.744 ppm2 2.073 CV 1
ASSI { 721}
(( segid " " and resid 63 and name HN ))
( segid " " and resid 20 and name HG2%)
3.600 1.600 1.600 peak 721 spectrum 1 weight 0.10000E+01 volume 0.43781E-03 ppm1 7.837 ppm2 0.713 CV 1
OR { 721}
(( segid " " and resid 63 and name HN ))
( segid " " and resid 20 and name HD1%)
ASSI { 723}
(( segid " " and resid 63 and name HN ))
( segid " " and resid 61 and name HG2%)
3.200 1.300 1.300 peak 723 spectrum 1 weight 0.10000E+01 volume 0.60383E-03 ppm1 7.830 ppm2 0.875 CV 1
ASSI { 727}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 53 and name HB3 ))
2.300 0.700 0.700 peak 727 spectrum 1 weight 0.10000E+01 volume 0.61737E-02 ppm1 7.764 ppm2 3.205 CV 1
ASSI { 728}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 53 and name HB2 ))
2.500 0.800 0.800 peak 728 spectrum 1 weight 0.10000E+01 volume 0.71059E-02 ppm1 7.764 ppm2 3.025 CV 1
ASSI { 730}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 50 and name HG2 ))
4.400 2.400 1.600 peak 730 spectrum 1 weight 0.10000E+01 volume 0.47001E-03 ppm1 7.769 ppm2 2.207 CV 1
ASSI { 731}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 50 and name HB2 ))
3.400 1.400 1.400 peak 731 spectrum 1 weight 0.10000E+01 volume 0.83187E-03 ppm1 7.765 ppm2 2.070 CV 1
ASSI { 732}
(( segid " " and resid 53 and name HN ))
( segid " " and resid 51 and name HB% )
3.500 1.600 1.600 peak 732 spectrum 1 weight 0.10000E+01 volume 0.31376E-03 ppm1 7.763 ppm2 1.461 CV 1
ASSI { 733}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 54 and name HB2 ))
3.900 1.900 1.900 peak 733 spectrum 1 weight 0.10000E+01 volume 0.36123E-03 ppm1 8.018 ppm2 3.692 CV 1
ASSI { 736}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 54 and name HB3 ))
3.900 1.900 1.900 peak 736 spectrum 1 weight 0.10000E+01 volume 0.37751E-03 ppm1 8.030 ppm2 3.762 CV 1
ASSI { 740}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HG3 ))
3.200 1.200 1.200 peak 740 spectrum 1 weight 0.11000E+01 volume 0.25166E-02 ppm1 8.380 ppm2 2.302 CV 1
OR { 740}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HG2 ))
ASSI { 741}
(( segid " " and resid 7 and name HE21))
(( segid " " and resid 7 and name HG2 ))
3.000 1.200 1.200 peak 741 spectrum 1 weight 0.11000E+01 volume 0.15323E-02 ppm1 7.559 ppm2 2.399 CV 1
OR { 741}
(( segid " " and resid 7 and name HE21))
(( segid " " and resid 7 and name HG3 ))
ASSI { 744}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 11 and name HB2 ))
3.200 1.300 1.300 peak 744 spectrum 1 weight 0.11000E+01 volume 0.10909E-02 ppm1 8.294 ppm2 2.713 CV 1
ASSI { 745}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 11 and name HB3 ))
3.700 1.700 1.700 peak 745 spectrum 1 weight 0.11000E+01 volume 0.12055E-02 ppm1 8.293 ppm2 2.835 CV 1
ASSI { 747}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 75 and name HN ))
4.600 2.600 1.400 peak 747 spectrum 1 weight 0.11000E+01 volume 0.20254E-03 ppm1 8.290 ppm2 8.611 CV 1
ASSI { 750}
(( segid " " and resid 11 and name HD21))
(( segid " " and resid 11 and name HB3 ))
3.300 1.400 1.400 peak 750 spectrum 1 weight 0.11000E+01 volume 0.11720E-02 ppm1 7.498 ppm2 2.836 CV 1
ASSI { 751}
(( segid " " and resid 11 and name HD22))
(( segid " " and resid 11 and name HB3 ))
4.100 2.100 1.900 peak 751 spectrum 1 weight 0.11000E+01 volume 0.97908E-03 ppm1 7.054 ppm2 2.822 CV 1
ASSI { 753}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 11 and name HN ))
3.600 1.600 1.600 peak 753 spectrum 1 weight 0.11000E+01 volume 0.17475E-02 ppm1 7.378 ppm2 8.298 CV 1
ASSI { 755}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HA ))
2.500 0.800 0.800 peak 755 spectrum 1 weight 0.11000E+01 volume 0.43565E-02 ppm1 9.226 ppm2 4.724 CV 1
ASSI { 756}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HN ))
4.300 2.300 1.700 peak 756 spectrum 1 weight 0.11000E+01 volume 0.66110E-03 ppm1 9.223 ppm2 7.388 CV 1
ASSI { 759}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 15 and name HN ))
3.700 1.800 1.800 peak 759 spectrum 1 weight 0.11000E+01 volume 0.12365E-02 ppm1 8.751 ppm2 9.045 CV 1
ASSI { 760}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HA2 ))
2.800 1.000 1.000 peak 760 spectrum 1 weight 0.11000E+01 volume 0.22596E-02 ppm1 9.051 ppm2 3.159 CV 1
ASSI { 761}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HA1 ))
2.900 1.000 1.000 peak 761 spectrum 1 weight 0.11000E+01 volume 0.24907E-02 ppm1 9.054 ppm2 4.991 CV 1
ASSI { 762}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 16 and name HN ))
4.600 2.600 1.400 peak 762 spectrum 1 weight 0.11000E+01 volume 0.42767E-03 ppm1 9.050 ppm2 8.108 CV 1
ASSI { 763}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 71 and name HN ))
2.800 1.000 1.000 peak 763 spectrum 1 weight 0.11000E+01 volume 0.20102E-02 ppm1 9.053 ppm2 8.616 CV 1
ASSI { 764}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HA2 ))
2.900 1.000 1.000 peak 764 spectrum 1 weight 0.11000E+01 volume 0.28461E-02 ppm1 8.105 ppm2 3.154 CV 1
ASSI { 765}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HA1 ))
2.400 0.700 0.700 peak 765 spectrum 1 weight 0.11000E+01 volume 0.53604E-02 ppm1 8.105 ppm2 5.008 CV 1
ASSI { 766}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 16 and name HA ))
2.700 0.900 0.900 peak 766 spectrum 1 weight 0.11000E+01 volume 0.27015E-02 ppm1 8.106 ppm2 5.251 CV 1
ASSI { 767}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 17 and name HN ))
4.100 2.100 1.900 peak 767 spectrum 1 weight 0.11000E+01 volume 0.75255E-03 ppm1 8.107 ppm2 8.812 CV 1
ASSI { 768}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 30 and name HN ))
2.800 1.000 1.000 peak 768 spectrum 1 weight 0.11000E+01 volume 0.23431E-02 ppm1 8.107 ppm2 8.992 CV 1
ASSI { 771}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 17 and name HG2%)
3.600 1.600 1.600 peak 771 spectrum 1 weight 0.11000E+01 volume 0.18843E-02 ppm1 8.817 ppm2 0.765 CV 1
ASSI { 772}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 18 and name HN ))
3.700 1.700 1.700 peak 772 spectrum 1 weight 0.11000E+01 volume 0.13039E-02 ppm1 8.819 ppm2 9.224 CV 1
ASSI { 776}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 70 and name HN ))
3.500 1.600 1.600 peak 776 spectrum 1 weight 0.11000E+01 volume 0.13652E-02 ppm1 8.822 ppm2 8.672 CV 1
ASSI { 780}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HN ))
1.900 0.400 0.400 peak 780 spectrum 1 weight 0.11000E+01 volume 0.11788E-01 ppm1 7.402 ppm2 9.219 CV 1
ASSI { 781}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 28 and name HN ))
2.400 0.700 0.700 peak 781 spectrum 1 weight 0.11000E+01 volume 0.38496E-02 ppm1 7.401 ppm2 8.990 CV 1
ASSI { 783}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 21 and name HN ))
4.300 2.300 1.700 peak 783 spectrum 1 weight 0.11000E+01 volume 0.43352E-03 ppm1 9.369 ppm2 8.831 CV 1
ASSI { 785}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 26 and name HN ))
3.500 1.500 1.500 peak 785 spectrum 1 weight 0.11000E+01 volume 0.10148E-02 ppm1 8.834 ppm2 7.339 CV 1
ASSI { 786}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 27 and name HA ))
3.200 1.300 1.300 peak 786 spectrum 1 weight 0.11000E+01 volume 0.22557E-02 ppm1 8.834 ppm2 5.003 CV 1
ASSI { 787}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 25 and name HN ))
2.200 0.600 0.600 peak 787 spectrum 1 weight 0.11000E+01 volume 0.52936E-02 ppm1 7.305 ppm2 7.981 CV 1
ASSI { 790}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 26 and name HA ))
3.700 1.700 1.700 peak 790 spectrum 1 weight 0.11000E+01 volume 0.14714E-02 ppm1 7.974 ppm2 4.639 CV 1
ASSI { 793}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HN ))
2.500 0.800 0.800 peak 793 spectrum 1 weight 0.11000E+01 volume 0.51704E-02 ppm1 7.329 ppm2 7.982 CV 1
ASSI { 796}
(( segid " " and resid 27 and name HN ))
( segid " " and resid 26 and name HB% )
2.300 0.700 0.700 peak 796 spectrum 1 weight 0.11000E+01 volume 0.88703E-02 ppm1 8.173 ppm2 0.572 CV 1
ASSI { 798}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 27 and name HA ))
3.000 1.100 1.100 peak 798 spectrum 1 weight 0.11000E+01 volume 0.15790E-02 ppm1 8.172 ppm2 4.997 CV 1
ASSI { 805}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 37 and name HN ))
3.000 1.100 1.100 peak 805 spectrum 1 weight 0.11000E+01 volume 0.15890E-02 ppm1 8.997 ppm2 9.806 CV 1
ASSI { 809}
(( segid " " and resid 31 and name HN ))
( segid " " and resid 31 and name HD% )
2.600 0.800 0.800 peak 809 spectrum 1 weight 0.11000E+01 volume 0.29617E-02 ppm1 9.022 ppm2 6.578 CV 1
ASSI { 814}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HN ))
2.500 0.800 0.800 peak 814 spectrum 1 weight 0.11000E+01 volume 0.57044E-02 ppm1 8.250 ppm2 9.029 CV 1
ASSI { 815}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 32 and name HA2 ))
2.600 0.900 0.900 peak 815 spectrum 1 weight 0.11000E+01 volume 0.63273E-02 ppm1 8.247 ppm2 3.685 CV 1
ASSI { 816}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 32 and name HA1 ))
2.500 0.800 0.800 peak 816 spectrum 1 weight 0.11000E+01 volume 0.43770E-02 ppm1 8.247 ppm2 4.199 CV 1
ASSI { 817}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 33 and name HN ))
2.800 1.000 1.000 peak 817 spectrum 1 weight 0.11000E+01 volume 0.30766E-02 ppm1 8.248 ppm2 6.808 CV 1
ASSI { 818}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 31 and name HN ))
3.100 1.200 1.200 peak 818 spectrum 1 weight 0.11000E+01 volume 0.11724E-02 ppm1 6.807 ppm2 9.026 CV 1
ASSI { 819}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 32 and name HA2 ))
3.800 1.800 1.800 peak 819 spectrum 1 weight 0.11000E+01 volume 0.91618E-03 ppm1 6.803 ppm2 3.678 CV 1
ASSI { 820}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 32 and name HA1 ))
3.500 1.500 1.500 peak 820 spectrum 1 weight 0.11000E+01 volume 0.73995E-03 ppm1 6.798 ppm2 4.205 CV 1
ASSI { 827}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 34 and name HN ))
2.900 1.100 1.100 peak 827 spectrum 1 weight 0.11000E+01 volume 0.17399E-02 ppm1 7.686 ppm2 8.713 CV 1
ASSI { 828}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 36 and name HN ))
3.800 1.900 1.900 peak 828 spectrum 1 weight 0.11000E+01 volume 0.37241E-03 ppm1 7.677 ppm2 8.845 CV 1
ASSI { 831}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 31 and name HD% )
3.400 1.400 1.400 peak 831 spectrum 1 weight 0.11000E+01 volume 0.13796E-02 ppm1 9.798 ppm2 6.566 CV 1
ASSI { 832}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 31 and name HE% )
3.000 3.000 3.000 peak 832 spectrum 1 weight 0.11000E+01 volume 0.14180E-02 ppm1 9.798 ppm2 6.384 CV 1
ASSI { 834}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HA2 ))
2.800 1.000 1.000 peak 834 spectrum 1 weight 0.11000E+01 volume 0.16961E-02 ppm1 9.798 ppm2 3.621 CV 1
ASSI { 835}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 38 and name HN ))
4.300 2.300 1.700 peak 835 spectrum 1 weight 0.11000E+01 volume 0.90475E-03 ppm1 9.801 ppm2 9.119 CV 1
ASSI { 836}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HA2 ))
3.200 1.300 1.300 peak 836 spectrum 1 weight 0.11000E+01 volume 0.19653E-02 ppm1 9.132 ppm2 3.614 CV 1
ASSI { 837}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HA1 ))
2.600 0.800 0.800 peak 837 spectrum 1 weight 0.11000E+01 volume 0.31534E-02 ppm1 9.134 ppm2 5.135 CV 1
ASSI { 840}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HB2 ))
2.900 1.100 1.100 peak 840 spectrum 1 weight 0.11000E+01 volume 0.23942E-02 ppm1 9.133 ppm2 2.800 CV 1
ASSI { 841}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HB3 ))
2.800 1.000 1.000 peak 841 spectrum 1 weight 0.11000E+01 volume 0.26371E-02 ppm1 9.134 ppm2 2.971 CV 1
ASSI { 842}
(( segid " " and resid 38 and name HN ))
( segid " " and resid 86 and name HB% )
4.000 2.000 2.000 peak 842 spectrum 1 weight 0.11000E+01 volume 0.93103E-03 ppm1 9.133 ppm2 1.659 CV 1
ASSI { 844}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 27 and name HN ))
2.900 1.000 1.000 peak 844 spectrum 1 weight 0.11000E+01 volume 0.21436E-02 ppm1 8.891 ppm2 8.164 CV 1
ASSI { 846}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 26 and name HB% )
2.900 1.000 1.000 peak 846 spectrum 1 weight 0.11000E+01 volume 0.36689E-02 ppm1 8.475 ppm2 0.572 CV 1
ASSI { 847}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HA ))
2.100 0.600 0.600 peak 847 spectrum 1 weight 0.11000E+01 volume 0.69109E-02 ppm1 8.474 ppm2 4.415 CV 1
ASSI { 848}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 42 and name HN ))
2.700 0.900 0.900 peak 848 spectrum 1 weight 0.11000E+01 volume 0.18935E-02 ppm1 8.476 ppm2 8.759 CV 1
ASSI { 849}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HA ))
3.500 1.500 1.500 peak 849 spectrum 1 weight 0.11000E+01 volume 0.61941E-03 ppm1 8.755 ppm2 3.915 CV 1
ASSI { 852}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 43 and name HN ))
2.700 0.900 0.900 peak 852 spectrum 1 weight 0.11000E+01 volume 0.23522E-02 ppm1 8.758 ppm2 7.892 CV 1
ASSI { 856}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 44 and name HN ))
2.400 0.700 0.700 peak 856 spectrum 1 weight 0.11000E+01 volume 0.37224E-02 ppm1 7.890 ppm2 7.690 CV 1
ASSI { 863}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 47 and name HN ))
2.800 1.000 1.000 peak 863 spectrum 1 weight 0.11000E+01 volume 0.18546E-02 ppm1 8.487 ppm2 8.895 CV 1
ASSI { 867}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 48 and name HN ))
2.400 0.700 0.700 peak 867 spectrum 1 weight 0.11000E+01 volume 0.44462E-02 ppm1 8.899 ppm2 7.793 CV 1
ASSI { 870}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 47 and name HA ))
3.200 1.300 1.300 peak 870 spectrum 1 weight 0.11000E+01 volume 0.12292E-02 ppm1 7.802 ppm2 4.082 CV 1
ASSI { 874}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 47 and name HA ))
3.600 1.600 1.600 peak 874 spectrum 1 weight 0.11000E+01 volume 0.73482E-03 ppm1 7.904 ppm2 4.086 CV 1
ASSI { 875}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 47 and name HN ))
4.100 2.100 1.900 peak 875 spectrum 1 weight 0.11000E+01 volume 0.48788E-03 ppm1 7.902 ppm2 8.895 CV 1
ASSI { 877}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 48 and name HN ))
2.200 0.600 0.600 peak 877 spectrum 1 weight 0.11000E+01 volume 0.84884E-02 ppm1 7.907 ppm2 7.803 CV 1
ASSI { 880}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 52 and name HN ))
3.500 1.500 1.500 peak 880 spectrum 1 weight 0.11000E+01 volume 0.68993E-03 ppm1 8.745 ppm2 8.531 CV 1
ASSI { 883}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 52 and name HB2 ))
3.400 1.400 1.400 peak 883 spectrum 1 weight 0.11000E+01 volume 0.73633E-03 ppm1 8.533 ppm2 2.880 CV 1
ASSI { 885}
(( segid " " and resid 52 and name HD21))
(( segid " " and resid 52 and name HB2 ))
3.000 1.100 1.100 peak 885 spectrum 1 weight 0.11000E+01 volume 0.18758E-02 ppm1 7.609 ppm2 2.881 CV 1
ASSI { 886}
(( segid " " and resid 52 and name HD22))
(( segid " " and resid 52 and name HB2 ))
4.100 2.100 1.900 peak 886 spectrum 1 weight 0.11000E+01 volume 0.10037E-02 ppm1 6.905 ppm2 2.890 CV 1
ASSI { 888}
(( segid " " and resid 53 and name HN ))
( segid " " and resid 49 and name HD% )
4.200 2.200 1.800 peak 888 spectrum 1 weight 0.11000E+01 volume 0.55885E-03 ppm1 7.763 ppm2 6.967 CV 1
ASSI { 891}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 52 and name HN ))
3.000 1.100 1.100 peak 891 spectrum 1 weight 0.11000E+01 volume 0.17322E-02 ppm1 7.766 ppm2 8.533 CV 1
ASSI { 893}
(( segid " " and resid 53 and name HN ))
( segid " " and resid 53 and name HD% )
3.800 1.800 1.800 peak 893 spectrum 1 weight 0.11000E+01 volume 0.20894E-02 ppm1 7.764 ppm2 7.101 CV 1
ASSI { 894}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 54 and name HN ))
3.400 1.400 1.400 peak 894 spectrum 1 weight 0.11000E+01 volume 0.30435E-02 ppm1 7.766 ppm2 8.027 CV 1
ASSI { 896}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 54 and name HA ))
2.900 1.100 1.100 peak 896 spectrum 1 weight 0.11000E+01 volume 0.18181E-02 ppm1 7.673 ppm2 4.326 CV 1
ASSI { 897}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 55 and name HA ))
3.500 1.500 1.500 peak 897 spectrum 1 weight 0.11000E+01 volume 0.84911E-03 ppm1 7.674 ppm2 4.176 CV 1
ASSI { 901}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 60 and name HB2 ))
2.800 1.000 1.000 peak 901 spectrum 1 weight 0.11000E+01 volume 0.37935E-02 ppm1 8.300 ppm2 2.832 CV 1
ASSI { 902}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 60 and name HB3 ))
2.800 1.000 1.000 peak 902 spectrum 1 weight 0.11000E+01 volume 0.30565E-02 ppm1 8.299 ppm2 2.997 CV 1
ASSI { 904}
(( segid " " and resid 60 and name HD21))
(( segid " " and resid 60 and name HB2 ))
2.800 1.000 1.000 peak 904 spectrum 1 weight 0.11000E+01 volume 0.20551E-02 ppm1 7.718 ppm2 2.826 CV 1
ASSI { 905}
(( segid " " and resid 60 and name HD22))
(( segid " " and resid 60 and name HB2 ))
3.800 1.900 1.900 peak 905 spectrum 1 weight 0.11000E+01 volume 0.12285E-02 ppm1 6.824 ppm2 2.821 CV 1
ASSI { 906}
(( segid " " and resid 60 and name HD21))
(( segid " " and resid 60 and name HB3 ))
3.500 1.500 1.500 peak 906 spectrum 1 weight 0.11000E+01 volume 0.91522E-03 ppm1 7.717 ppm2 2.999 CV 1
ASSI { 907}
(( segid " " and resid 60 and name HD22))
(( segid " " and resid 60 and name HB3 ))
4.500 2.500 1.500 peak 907 spectrum 1 weight 0.11000E+01 volume 0.49195E-03 ppm1 6.824 ppm2 3.000 CV 1
ASSI { 912}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 61 and name HN ))
2.700 0.900 0.900 peak 912 spectrum 1 weight 0.11000E+01 volume 0.25141E-02 ppm1 8.296 ppm2 9.569 CV 1
ASSI { 914}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 63 and name HN ))
2.300 0.700 0.700 peak 914 spectrum 1 weight 0.11000E+01 volume 0.63524E-02 ppm1 8.296 ppm2 7.842 CV 1
ASSI { 919}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 64 and name HN ))
2.300 0.700 0.700 peak 919 spectrum 1 weight 0.11000E+01 volume 0.64855E-02 ppm1 7.835 ppm2 7.182 CV 1
ASSI { 921}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 62 and name HN ))
3.600 1.600 1.600 peak 921 spectrum 1 weight 0.11000E+01 volume 0.91981E-03 ppm1 7.182 ppm2 8.291 CV 1
ASSI { 924}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 66 and name HN ))
4.100 4.100 1.900 peak 924 spectrum 1 weight 0.11000E+01 volume 0.12405E-02 ppm1 7.184 ppm2 7.993 CV 1
ASSI { 926}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 63 and name HN ))
4.400 2.400 1.600 peak 926 spectrum 1 weight 0.11000E+01 volume 0.98065E-03 ppm1 7.147 ppm2 7.837 CV 1
ASSI { 928}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 66 and name HN ))
4.000 2.000 2.000 peak 928 spectrum 1 weight 0.11000E+01 volume 0.70957E-03 ppm1 7.149 ppm2 8.017 CV 1
ASSI { 929}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 65 and name HA ))
2.200 0.600 0.600 peak 929 spectrum 1 weight 0.11000E+01 volume 0.70142E-02 ppm1 8.014 ppm2 5.107 CV 1
ASSI { 932}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 17 and name HN ))
3.200 3.200 2.800 peak 932 spectrum 1 weight 0.10000E+01 volume 0.45211E-02 ppm1 9.043 ppm2 8.829 CV 1
ASSI { 935}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 17 and name HN ))
3.200 1.300 1.300 peak 935 spectrum 1 weight 0.11000E+01 volume 0.95341E-03 ppm1 9.232 ppm2 8.817 CV 1
ASSI { 936}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 67 and name HA ))
1.900 0.400 0.400 peak 936 spectrum 1 weight 0.11000E+01 volume 0.13378E-01 ppm1 9.229 ppm2 3.631 CV 1
ASSI { 937}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 67 and name HN ))
3.500 1.500 1.500 peak 937 spectrum 1 weight 0.11000E+01 volume 0.22188E-02 ppm1 9.231 ppm2 9.044 CV 1
ASSI { 938}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 69 and name HN ))
2.400 0.700 0.700 peak 938 spectrum 1 weight 0.11000E+01 volume 0.35653E-02 ppm1 9.231 ppm2 7.716 CV 1
ASSI { 939}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 17 and name HN ))
2.800 1.000 1.000 peak 939 spectrum 1 weight 0.11000E+01 volume 0.17681E-02 ppm1 7.718 ppm2 8.814 CV 1
ASSI { 941}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 70 and name HN ))
3.700 1.700 1.700 peak 941 spectrum 1 weight 0.11000E+01 volume 0.12547E-02 ppm1 7.713 ppm2 8.670 CV 1
ASSI { 948}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 70 and name HA ))
2.800 1.000 1.000 peak 948 spectrum 1 weight 0.11000E+01 volume 0.20297E-02 ppm1 8.673 ppm2 5.231 CV 1
ASSI { 951}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 73 and name HN ))
3.400 1.400 1.400 peak 951 spectrum 1 weight 0.11000E+01 volume 0.19535E-02 ppm1 7.292 ppm2 9.061 CV 1
ASSI { 955}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 74 and name HN ))
4.200 2.200 1.800 peak 955 spectrum 1 weight 0.11000E+01 volume 0.47784E-03 ppm1 9.070 ppm2 8.658 CV 1
ASSI { 960}
(( segid " " and resid 74 and name HE21))
(( segid " " and resid 74 and name HG3 ))
3.500 1.500 1.500 peak 960 spectrum 1 weight 0.11000E+01 volume 0.78300E-03 ppm1 7.332 ppm2 2.301 CV 1
ASSI { 962}
(( segid " " and resid 75 and name HN ))
( segid " " and resid 13 and name HD% )
3.900 1.900 1.900 peak 962 spectrum 1 weight 0.11000E+01 volume 0.35731E-03 ppm1 8.635 ppm2 7.087 CV 1
ASSI { 966}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 76 and name HN ))
4.400 2.500 1.600 peak 966 spectrum 1 weight 0.11000E+01 volume 0.41565E-03 ppm1 8.634 ppm2 9.251 CV 1
ASSI { 970}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 86 and name HN ))
3.900 1.900 1.900 peak 970 spectrum 1 weight 0.11000E+01 volume 0.66946E-03 ppm1 9.272 ppm2 8.631 CV 1
ASSI { 972}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 88 and name HN ))
3.800 1.800 1.800 peak 972 spectrum 1 weight 0.11000E+01 volume 0.75090E-03 ppm1 9.269 ppm2 8.440 CV 1
ASSI { 976}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HB2 ))
3.800 1.800 1.800 peak 976 spectrum 1 weight 0.11000E+01 volume 0.15668E-02 ppm1 7.830 ppm2 2.309 CV 1
ASSI { 977}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HB3 ))
2.900 1.000 1.000 peak 977 spectrum 1 weight 0.11000E+01 volume 0.24761E-02 ppm1 7.830 ppm2 2.543 CV 1
ASSI { 978}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HN ))
2.500 0.800 0.800 peak 978 spectrum 1 weight 0.11000E+01 volume 0.40027E-02 ppm1 7.832 ppm2 9.268 CV 1
ASSI { 980}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 86 and name HN ))
2.900 1.000 1.000 peak 980 spectrum 1 weight 0.11000E+01 volume 0.25035E-02 ppm1 7.831 ppm2 8.636 CV 1
ASSI { 982}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 77 and name HN ))
3.900 1.900 1.900 peak 982 spectrum 1 weight 0.11000E+01 volume 0.82762E-03 ppm1 8.634 ppm2 7.836 CV 1
ASSI { 983}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 78 and name HA ))
2.200 0.600 0.600 peak 983 spectrum 1 weight 0.11000E+01 volume 0.89291E-02 ppm1 8.695 ppm2 4.237 CV 1
ASSI { 985}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 79 and name HN ))
4.000 2.000 2.000 peak 985 spectrum 1 weight 0.11000E+01 volume 0.87389E-03 ppm1 8.200 ppm2 8.705 CV 1
ASSI { 986}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 80 and name HA ))
3.000 1.100 1.100 peak 986 spectrum 1 weight 0.11000E+01 volume 0.16973E-02 ppm1 8.200 ppm2 4.543 CV 1
ASSI { 988}
(( segid " " and resid 82 and name HD22))
(( segid " " and resid 82 and name HB2 ))
4.100 2.100 1.900 peak 988 spectrum 1 weight 0.11000E+01 volume 0.10913E-02 ppm1 6.875 ppm2 2.863 CV 1
OR { 988}
(( segid " " and resid 82 and name HD22))
(( segid " " and resid 82 and name HB3 ))
ASSI { 990}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 84 and name HA2 ))
2.600 0.900 0.900 peak 990 spectrum 1 weight 0.11000E+01 volume 0.43690E-02 ppm1 8.427 ppm2 3.946 CV 1
ASSI { 991}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 84 and name HA1 ))
2.400 0.700 0.700 peak 991 spectrum 1 weight 0.11000E+01 volume 0.54787E-02 ppm1 8.427 ppm2 4.322 CV 1
ASSI { 992}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 84 and name HA2 ))
2.400 0.700 0.700 peak 992 spectrum 1 weight 0.11000E+01 volume 0.62186E-02 ppm1 8.452 ppm2 3.941 CV 1
ASSI { 993}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 84 and name HA1 ))
2.700 0.900 0.900 peak 993 spectrum 1 weight 0.11000E+01 volume 0.47465E-02 ppm1 8.451 ppm2 4.315 CV 1
ASSI { 997}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 86 and name HA ))
3.200 1.300 1.300 peak 997 spectrum 1 weight 0.11000E+01 volume 0.11416E-02 ppm1 8.634 ppm2 4.948 CV 1
ASSI { 1000}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 87 and name HA ))
3.100 1.200 1.200 peak 1000 spectrum 1 weight 0.11000E+01 volume 0.10663E-02 ppm1 8.957 ppm2 5.146 CV 1
ASSI { 1001}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 88 and name HN ))
4.200 2.200 1.800 peak 1001 spectrum 1 weight 0.11000E+01 volume 0.59126E-03 ppm1 8.953 ppm2 8.440 CV 1
ASSI { 1002}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 74 and name HN ))
2.600 0.900 0.900 peak 1002 spectrum 1 weight 0.11000E+01 volume 0.30302E-02 ppm1 8.432 ppm2 8.665 CV 1
ASSI { 1003}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 75 and name HA ))
4.800 2.900 1.200 peak 1003 spectrum 1 weight 0.11000E+01 volume 0.26901E-03 ppm1 8.437 ppm2 3.933 CV 1
ASSI { 1005}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 87 and name HA ))
2.400 0.700 0.700 peak 1005 spectrum 1 weight 0.11000E+01 volume 0.40877E-02 ppm1 8.430 ppm2 5.153 CV 1
ASSI { 1011}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 90 and name HN ))
2.700 0.900 0.900 peak 1011 spectrum 1 weight 0.11000E+01 volume 0.32507E-02 ppm1 7.953 ppm2 9.023 CV 1
ASSI { 1014}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 92 and name HN ))
3.600 1.600 1.600 peak 1014 spectrum 1 weight 0.11000E+01 volume 0.14487E-02 ppm1 7.677 ppm2 9.044 CV 1
ASSI { 1016}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 47 and name HN ))
3.900 3.900 2.100 peak 1016 spectrum 1 weight 0.11000E+01 volume 0.10930E-02 ppm1 8.449 ppm2 8.889 CV 1
ASSI { 1018}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 92 and name HB3 ))
3.300 1.300 1.300 peak 1018 spectrum 1 weight 0.11000E+01 volume 0.16934E-02 ppm1 8.445 ppm2 3.910 CV 1
OR { 1018}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 92 and name HB2 ))
ASSI { 1019}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 92 and name HN ))
3.700 1.700 1.700 peak 1019 spectrum 1 weight 0.11000E+01 volume 0.55184E-03 ppm1 8.452 ppm2 9.049 CV 1
ASSI { 1020}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 93 and name HA ))
3.200 1.300 1.300 peak 1020 spectrum 1 weight 0.11000E+01 volume 0.12630E-02 ppm1 8.445 ppm2 4.465 CV 1
ASSI { 1021}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 93 and name HB2 ))
2.700 0.900 0.900 peak 1021 spectrum 1 weight 0.11000E+01 volume 0.38990E-02 ppm1 8.447 ppm2 1.637 CV 1
OR { 1021}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 93 and name HB3 ))
ASSI { 1022}
(( segid " " and resid 93 and name HN ))
( segid " " and resid 93 and name HD2%)
4.300 2.300 1.700 peak 1022 spectrum 1 weight 0.11000E+01 volume 0.75467E-03 ppm1 8.447 ppm2 0.858 CV 1
ASSI { 1024}
(( segid " " and resid 96 and name HN ))
(( segid " " and resid 95 and name HA2 ))
2.700 0.900 0.900 peak 1024 spectrum 1 weight 0.11000E+01 volume 0.39730E-02 ppm1 7.881 ppm2 4.017 CV 1
OR { 1024}
(( segid " " and resid 96 and name HN ))
(( segid " " and resid 95 and name HA1 ))
ASSI { 1025}
(( segid " " and resid 96 and name HN ))
(( segid " " and resid 95 and name HN ))
3.700 1.700 1.700 peak 1025 spectrum 1 weight 0.11000E+01 volume 0.11586E-02 ppm1 7.880 ppm2 8.398 CV 1
ASSI { 4}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 46 and name HN ))
5.000 3.100 1.000 peak 4 spectrum 1 weight 0.10000E+01 volume 0.25742E-03 ppm1 2.975 ppm2 8.470 CV 1
OR { 4}
(( segid " " and resid 46 and name HD3 ))
(( segid " " and resid 46 and name HN ))
ASSI { 10}
(( segid " " and resid 74 and name HB3 ))
( segid " " and resid 91 and name HD1%)
3.500 1.600 1.600 peak 10 spectrum 1 weight 0.10000E+01 volume 0.11773E-02 ppm1 1.937 ppm2 0.716 CV 1
OR { 10}
(( segid " " and resid 74 and name HB2 ))
( segid " " and resid 91 and name HD1%)
ASSI { 14}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 19 and name HD2 ))
2.700 0.900 0.900 peak 14 spectrum 1 weight 0.10000E+01 volume 0.11989E-02 ppm1 1.876 ppm2 3.236 CV 1
ASSI { 15}
(( segid " " and resid 83 and name HB2 ))
(( segid " " and resid 83 and name HA ))
3.100 1.200 1.200 peak 15 spectrum 1 weight 0.10000E+01 volume 0.18070E-02 ppm1 1.981 ppm2 4.437 CV 1
ASSI { 16}
(( segid " " and resid 83 and name HB3 ))
(( segid " " and resid 83 and name HA ))
3.100 1.200 1.200 peak 16 spectrum 1 weight 0.10000E+01 volume 0.15023E-02 ppm1 1.898 ppm2 4.440 CV 1
ASSI { 19}
( segid " " and resid 91 and name HD1%)
(( segid " " and resid 91 and name HG12))
2.400 0.700 0.700 peak 19 spectrum 1 weight 0.10000E+01 volume 0.62537E-02 ppm1 0.704 ppm2 1.354 CV 1
ASSI { 26}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 60 and name HN ))
4.700 2.800 1.300 peak 26 spectrum 1 weight 0.10000E+01 volume 0.31031E-03 ppm1 0.109 ppm2 8.302 CV 1
ASSI { 28}
(( segid " " and resid 16 and name HB3 ))
( segid " " and resid 20 and name HD1%)
3.900 3.900 2.100 peak 28 spectrum 1 weight 0.10000E+01 volume 0.10955E-02 ppm1 1.682 ppm2 0.703 CV 1
OR { 28}
(( segid " " and resid 16 and name HB2 ))
( segid " " and resid 20 and name HD1%)
ASSI { 31}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 19 and name HN ))
5.500 3.800 0.500 peak 31 spectrum 1 weight 0.10000E+01 volume 0.27297E-03 ppm1 0.528 ppm2 7.397 CV 1
ASSI { 32}
( segid " " and resid 29 and name HG1%)
(( segid " " and resid 71 and name HN ))
4.300 2.400 1.700 peak 32 spectrum 1 weight 0.10000E+01 volume 0.28424E-03 ppm1 0.567 ppm2 8.618 CV 1
ASSI { 37}
(( segid " " and resid 31 and name HA ))
( segid " " and resid 31 and name HD% )
3.800 1.800 1.800 peak 37 spectrum 1 weight 0.10000E+01 volume 0.12656E-02 ppm1 5.275 ppm2 6.576 CV 1
ASSI { 40}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 70 and name HG2 ))
3.700 1.700 1.700 peak 40 spectrum 1 weight 0.10000E+01 volume 0.10930E-02 ppm1 5.230 ppm2 2.422 CV 1
ASSI { 41}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 65 and name HB2 ))
3.000 1.100 1.100 peak 41 spectrum 1 weight 0.10000E+01 volume 0.19293E-02 ppm1 5.117 ppm2 1.386 CV 1
OR { 41}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 65 and name HG ))
ASSI { 42}
( segid " " and resid 85 and name HB% )
(( segid " " and resid 37 and name HA2 ))
4.300 2.300 1.700 peak 42 spectrum 1 weight 0.10000E+01 volume 0.47960E-03 ppm1 1.475 ppm2 3.624 CV 1
ASSI { 43}
(( segid " " and resid 37 and name HA2 ))
( segid " " and resid 75 and name HG2%)
4.800 2.900 1.200 peak 43 spectrum 1 weight 0.10000E+01 volume 0.20779E-03 ppm1 3.618 ppm2 0.867 CV 1
ASSI { 44}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 61 and name HA ))
4.400 4.400 1.600 peak 44 spectrum 1 weight 0.10000E+01 volume 0.29158E-03 ppm1 0.543 ppm2 3.818 CV 1
ASSI { 45}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 75 and name HA ))
4.300 2.300 1.700 peak 45 spectrum 1 weight 0.10000E+01 volume 0.34415E-03 ppm1 0.542 ppm2 3.940 CV 1
ASSI { 49}
( segid " " and resid 86 and name HB% )
(( segid " " and resid 75 and name HA ))
4.200 2.200 1.800 peak 49 spectrum 1 weight 0.10000E+01 volume 0.33853E-03 ppm1 1.663 ppm2 3.933 CV 1
ASSI { 51}
( segid " " and resid 86 and name HB% )
(( segid " " and resid 80 and name HD3 ))
3.800 3.800 2.200 peak 51 spectrum 1 weight 0.10000E+01 volume 0.18617E-03 ppm1 1.660 ppm2 3.254 CV 1
OR { 51}
( segid " " and resid 86 and name HB% )
(( segid " " and resid 80 and name HD2 ))
ASSI { 61}
( segid " " and resid 87 and name HD2%)
( segid " " and resid 13 and name HD% )
3.600 1.600 1.600 peak 61 spectrum 1 weight 0.10000E+01 volume 0.25597E-03 ppm1 0.182 ppm2 7.105 CV 1
ASSI { 62}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 38 and name HZ ))
4.700 2.700 1.300 peak 62 spectrum 1 weight 0.10000E+01 volume 0.37934E-03 ppm1 1.861 ppm2 7.206 CV 1
ASSI { 63}
( segid " " and resid 24 and name HD2%)
(( segid " " and resid 38 and name HZ ))
3.400 1.400 1.400 peak 63 spectrum 1 weight 0.10000E+01 volume 0.10453E-02 ppm1 0.972 ppm2 7.198 CV 1
OR { 63}
( segid " " and resid 24 and name HD2%)
( segid " " and resid 38 and name HE% )
ASSI { 67}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 74 and name HB3 ))
2.700 0.900 0.900 peak 67 spectrum 1 weight 0.10000E+01 volume 0.31489E-02 ppm1 5.128 ppm2 1.946 CV 1
OR { 67}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 74 and name HB2 ))
ASSI { 69}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 39 and name HG ))
4.200 2.200 1.800 peak 69 spectrum 1 weight 0.10000E+01 volume 0.52001E-03 ppm1 5.174 ppm2 1.207 CV 1
ASSI { 70}
(( segid " " and resid 50 and name HD2 ))
(( segid " " and resid 50 and name HD3 ))
2.100 0.500 0.500 peak 70 spectrum 1 weight 0.10000E+01 volume 0.53706E-02 ppm1 3.396 ppm2 4.168 CV 1
ASSI { 72}
(( segid " " and resid 50 and name HD2 ))
(( segid " " and resid 50 and name HA ))
4.300 2.300 1.700 peak 72 spectrum 1 weight 0.10000E+01 volume 0.42387E-03 ppm1 3.402 ppm2 4.572 CV 1
ASSI { 76}
(( segid " " and resid 50 and name HD2 ))
(( segid " " and resid 50 and name HB2 ))
3.600 1.600 1.600 peak 76 spectrum 1 weight 0.10000E+01 volume 0.86787E-03 ppm1 3.396 ppm2 2.079 CV 1
ASSI { 77}
(( segid " " and resid 50 and name HD2 ))
(( segid " " and resid 50 and name HG3 ))
2.700 0.900 0.900 peak 77 spectrum 1 weight 0.10000E+01 volume 0.26346E-02 ppm1 3.395 ppm2 2.202 CV 1
OR { 77}
(( segid " " and resid 50 and name HD2 ))
(( segid " " and resid 50 and name HG2 ))
ASSI { 78}
(( segid " " and resid 50 and name HD2 ))
(( segid " " and resid 50 and name HB3 ))
4.800 2.900 1.200 peak 78 spectrum 1 weight 0.10000E+01 volume 0.42786E-03 ppm1 3.399 ppm2 2.518 CV 1
ASSI { 82}
(( segid " " and resid 50 and name HD2 ))
(( segid " " and resid 53 and name HB2 ))
3.600 1.700 1.700 peak 82 spectrum 1 weight 0.10000E+01 volume 0.56298E-03 ppm1 3.399 ppm2 3.041 CV 1
ASSI { 83}
(( segid " " and resid 48 and name HA ))
( segid " " and resid 48 and name HD% )
2.800 1.000 1.000 peak 83 spectrum 1 weight 0.10000E+01 volume 0.24146E-02 ppm1 4.360 ppm2 7.314 CV 1
ASSI { 85}
(( segid " " and resid 50 and name HD2 ))
(( segid " " and resid 53 and name HB3 ))
3.600 1.600 1.600 peak 85 spectrum 1 weight 0.10000E+01 volume 0.71634E-03 ppm1 3.397 ppm2 3.200 CV 1
ASSI { 86}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 71 and name HA ))
3.600 1.700 1.700 peak 86 spectrum 1 weight 0.10000E+01 volume 0.11263E-02 ppm1 0.375 ppm2 4.682 CV 1
ASSI { 89}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 72 and name HN ))
3.700 1.800 1.800 peak 89 spectrum 1 weight 0.10000E+01 volume 0.84795E-03 ppm1 0.372 ppm2 7.301 CV 1
ASSI { 93}
(( segid " " and resid 50 and name HD2 ))
(( segid " " and resid 64 and name HA ))
3.300 1.400 1.400 peak 93 spectrum 1 weight 0.10000E+01 volume 0.14382E-02 ppm1 3.397 ppm2 3.849 CV 1
ASSI { 96}
(( segid " " and resid 40 and name HD3 ))
(( segid " " and resid 43 and name HG2 ))
4.800 2.900 1.200 peak 96 spectrum 1 weight 0.10000E+01 volume 0.42144E-03 ppm1 3.811 ppm2 2.935 CV 1
ASSI { 97}
(( segid " " and resid 40 and name HD3 ))
(( segid " " and resid 39 and name HA ))
2.500 0.800 0.800 peak 97 spectrum 1 weight 0.10000E+01 volume 0.21648E-02 ppm1 3.813 ppm2 4.989 CV 1
ASSI { 101}
(( segid " " and resid 32 and name HA1 ))
(( segid " " and resid 32 and name HA2 ))
2.000 0.500 0.500 peak 101 spectrum 1 weight 0.10000E+01 volume 0.10056E-01 ppm1 4.210 ppm2 3.694 CV 1
ASSI { 107}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 15 and name HA1 ))
3.000 3.000 3.000 peak 107 spectrum 1 weight 0.10000E+01 volume 0.28350E-02 ppm1 5.276 ppm2 5.016 CV 1
ASSI { 113}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 11 and name HA ))
3.600 1.600 1.600 peak 113 spectrum 1 weight 0.10000E+01 volume 0.15407E-02 ppm1 4.378 ppm2 4.649 CV 1
ASSI { 114}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 29 and name HA ))
2.800 1.000 1.000 peak 114 spectrum 1 weight 0.10000E+01 volume 0.17788E-02 ppm1 4.292 ppm2 4.659 CV 1
ASSI { 116}
(( segid " " and resid 45 and name HA ))
( segid " " and resid 94 and name HB% )
3.500 1.500 1.500 peak 116 spectrum 1 weight 0.10000E+01 volume 0.14319E-02 ppm1 4.104 ppm2 1.415 CV 1
ASSI { 117}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 9 and name HB3 ))
3.200 3.200 2.800 peak 117 spectrum 1 weight 0.10000E+01 volume 0.49754E-03 ppm1 4.378 ppm2 1.828 CV 1
ASSI { 118}
(( segid " " and resid 10 and name HA ))
( segid " " and resid 12 and name HD1%)
4.100 2.100 1.900 peak 118 spectrum 1 weight 0.10000E+01 volume 0.52075E-03 ppm1 4.379 ppm2 0.798 CV 1
OR { 118}
(( segid " " and resid 10 and name HA ))
( segid " " and resid 12 and name HG2%)
ASSI { 120}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 9 and name HB2 ))
3.300 3.300 2.700 peak 120 spectrum 1 weight 0.10000E+01 volume 0.44502E-03 ppm1 4.380 ppm2 1.892 CV 1
ASSI { 121}
(( segid " " and resid 55 and name HA ))
( segid " " and resid 55 and name HB% )
2.300 0.600 0.600 peak 121 spectrum 1 weight 0.10000E+01 volume 0.92795E-02 ppm1 4.184 ppm2 1.291 CV 1
ASSI { 122}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 17 and name HN ))
3.800 1.800 1.800 peak 122 spectrum 1 weight 0.10000E+01 volume 0.77068E-03 ppm1 3.652 ppm2 8.819 CV 1
ASSI { 124}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 22 and name HD2 ))
2.700 0.900 0.900 peak 124 spectrum 1 weight 0.10000E+01 volume 0.38731E-02 ppm1 5.345 ppm2 3.910 CV 1
ASSI { 125}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 22 and name HD3 ))
2.300 0.700 0.700 peak 125 spectrum 1 weight 0.10000E+01 volume 0.39117E-02 ppm1 5.340 ppm2 4.116 CV 1
ASSI { 128}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 59 and name HA ))
3.600 1.600 1.600 peak 128 spectrum 1 weight 0.10000E+01 volume 0.67134E-03 ppm1 4.195 ppm2 4.544 CV 1
ASSI { 149}
(( segid " " and resid 48 and name HA ))
( segid " " and resid 48 and name HE% )
4.100 2.100 1.900 peak 149 spectrum 1 weight 0.10000E+01 volume 0.76836E-03 ppm1 4.359 ppm2 7.039 CV 1
ASSI { 151}
(( segid " " and resid 57 and name HA2 ))
(( segid " " and resid 57 and name HA1 ))
1.600 0.300 0.600 peak 151 spectrum 1 weight 0.10000E+01 volume 0.30286E-01 ppm1 4.033 ppm2 3.923 CV 1
ASSI { 156}
(( segid " " and resid 95 and name HA2 ))
(( segid " " and resid 51 and name HA ))
2.600 2.600 3.400 peak 156 spectrum 1 weight 0.10000E+01 volume 0.19505E-02 ppm1 4.020 ppm2 4.192 CV 1
OR { 156}
(( segid " " and resid 95 and name HA1 ))
(( segid " " and resid 51 and name HA ))
ASSI { 160}
(( segid " " and resid 95 and name HA1 ))
(( segid " " and resid 46 and name HB3 ))
3.800 1.800 1.800 peak 160 spectrum 1 weight 0.10000E+01 volume 0.42599E-03 ppm1 4.013 ppm2 1.673 CV 1
OR { 160}
(( segid " " and resid 95 and name HA2 ))
(( segid " " and resid 46 and name HB3 ))
ASSI { 163}
(( segid " " and resid 88 and name HB ))
(( segid " " and resid 88 and name HA ))
3.200 1.300 1.300 peak 163 spectrum 1 weight 0.10000E+01 volume 0.10171E-02 ppm1 4.157 ppm2 4.925 CV 1
ASSI { 165}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 88 and name HB ))
2.700 0.900 0.900 peak 165 spectrum 1 weight 0.10000E+01 volume 0.31953E-02 ppm1 1.145 ppm2 4.154 CV 1
ASSI { 169}
( segid " " and resid 89 and name HG2%)
(( segid " " and resid 45 and name HN ))
3.700 1.700 1.700 peak 169 spectrum 1 weight 0.10000E+01 volume 0.60521E-03 ppm1 0.970 ppm2 7.835 CV 1
ASSI { 170}
( segid " " and resid 89 and name HG2%)
( segid " " and resid 48 and name HE% )
3.200 1.300 1.300 peak 170 spectrum 1 weight 0.10000E+01 volume 0.12014E-02 ppm1 0.973 ppm2 7.023 CV 1
ASSI { 172}
(( segid " " and resid 15 and name HA1 ))
(( segid " " and resid 16 and name HE2 ))
3.900 1.900 1.900 peak 172 spectrum 1 weight 0.10000E+01 volume 0.51326E-03 ppm1 5.018 ppm2 3.032 CV 1
OR { 172}
(( segid " " and resid 15 and name HA1 ))
(( segid " " and resid 16 and name HE3 ))
ASSI { 178}
(( segid " " and resid 13 and name HB3 ))
( segid " " and resid 31 and name HD% )
3.600 1.700 1.700 peak 178 spectrum 1 weight 0.10000E+01 volume 0.42227E-03 ppm1 3.308 ppm2 6.581 CV 1
ASSI { 180}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 19 and name HN ))
4.600 2.700 1.400 peak 180 spectrum 1 weight 0.10000E+01 volume 0.47961E-03 ppm1 2.996 ppm2 7.399 CV 1
ASSI { 183}
(( segid " " and resid 35 and name HD3 ))
(( segid " " and resid 35 and name HA ))
4.300 2.300 1.700 peak 183 spectrum 1 weight 0.10000E+01 volume 0.52344E-03 ppm1 2.990 ppm2 4.543 CV 1
ASSI { 184}
(( segid " " and resid 48 and name HB2 ))
(( segid " " and resid 49 and name HN ))
3.300 1.400 1.400 peak 184 spectrum 1 weight 0.10000E+01 volume 0.40536E-03 ppm1 2.719 ppm2 7.910 CV 1
ASSI { 186}
(( segid " " and resid 48 and name HB2 ))
( segid " " and resid 48 and name HE% )
4.500 2.500 1.500 peak 186 spectrum 1 weight 0.10000E+01 volume 0.45680E-03 ppm1 2.715 ppm2 7.026 CV 1
ASSI { 190}
(( segid " " and resid 48 and name HB3 ))
( segid " " and resid 48 and name HE% )
4.500 2.500 1.500 peak 190 spectrum 1 weight 0.10000E+01 volume 0.48191E-03 ppm1 3.068 ppm2 7.020 CV 1
ASSI { 195}
(( segid " " and resid 48 and name HB3 ))
(( segid " " and resid 48 and name HA ))
3.000 1.100 1.100 peak 195 spectrum 1 weight 0.10000E+01 volume 0.11974E-02 ppm1 3.074 ppm2 4.359 CV 1
ASSI { 196}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 49 and name HN ))
3.000 1.100 1.100 peak 196 spectrum 1 weight 0.10000E+01 volume 0.16592E-02 ppm1 3.376 ppm2 7.910 CV 1
ASSI { 198}
(( segid " " and resid 35 and name HD2 ))
(( segid " " and resid 35 and name HA ))
4.000 2.000 2.000 peak 198 spectrum 1 weight 0.10000E+01 volume 0.68143E-03 ppm1 3.079 ppm2 4.545 CV 1
ASSI { 202}
(( segid " " and resid 35 and name HD3 ))
(( segid " " and resid 35 and name HD2 ))
1.500 0.300 0.700 peak 202 spectrum 1 weight 0.10000E+01 volume 0.31334E-01 ppm1 2.990 ppm2 3.082 CV 1
ASSI { 204}
(( segid " " and resid 16 and name HE3 ))
(( segid " " and resid 68 and name HA1 ))
3.500 1.500 1.500 peak 204 spectrum 1 weight 0.10000E+01 volume 0.11000E-02 ppm1 3.012 ppm2 4.457 CV 1
OR { 204}
(( segid " " and resid 16 and name HE2 ))
(( segid " " and resid 68 and name HA1 ))
ASSI { 205}
(( segid " " and resid 77 and name HE2 ))
(( segid " " and resid 77 and name HA ))
3.300 3.300 2.700 peak 205 spectrum 1 weight 0.10000E+01 volume 0.41197E-03 ppm1 3.048 ppm2 4.566 CV 1
OR { 205}
(( segid " " and resid 77 and name HE3 ))
(( segid " " and resid 77 and name HA ))
ASSI { 206}
(( segid " " and resid 50 and name HD3 ))
(( segid " " and resid 49 and name HB2 ))
4.100 2.100 1.900 peak 206 spectrum 1 weight 0.10000E+01 volume 0.88326E-03 ppm1 4.168 ppm2 2.821 CV 1
ASSI { 207}
(( segid " " and resid 50 and name HD3 ))
(( segid " " and resid 64 and name HA ))
3.700 3.700 2.300 peak 207 spectrum 1 weight 0.10000E+01 volume 0.10869E-02 ppm1 4.169 ppm2 3.855 CV 1
ASSI { 208}
(( segid " " and resid 62 and name HE2 ))
( segid " " and resid 20 and name HG2%)
3.100 3.100 2.900 peak 208 spectrum 1 weight 0.10000E+01 volume 0.71497E-03 ppm1 3.056 ppm2 0.713 CV 1
OR { 208}
(( segid " " and resid 62 and name HE3 ))
( segid " " and resid 20 and name HG2%)
ASSI { 209}
(( segid " " and resid 14 and name HE2 ))
( segid " " and resid 72 and name HD1%)
2.700 0.900 0.900 peak 209 spectrum 1 weight 0.10000E+01 volume 0.35409E-02 ppm1 2.972 ppm2 0.875 CV 1
OR { 209}
(( segid " " and resid 14 and name HE3 ))
( segid " " and resid 72 and name HD1%)
ASSI { 210}
(( segid " " and resid 16 and name HE3 ))
( segid " " and resid 18 and name HG2%)
3.600 3.600 2.400 peak 210 spectrum 1 weight 0.10000E+01 volume 0.82468E-03 ppm1 3.010 ppm2 1.023 CV 1
OR { 210}
(( segid " " and resid 16 and name HE2 ))
( segid " " and resid 18 and name HG2%)
ASSI { 212}
(( segid " " and resid 16 and name HE2 ))
(( segid " " and resid 16 and name HG2 ))
2.800 1.000 1.000 peak 212 spectrum 1 weight 0.10000E+01 volume 0.48583E-02 ppm1 3.010 ppm2 1.354 CV 1
OR { 212}
(( segid " " and resid 16 and name HE3 ))
(( segid " " and resid 16 and name HG2 ))
ASSI { 215}
(( segid " " and resid 40 and name HD2 ))
(( segid " " and resid 39 and name HA ))
3.000 1.100 1.100 peak 215 spectrum 1 weight 0.10000E+01 volume 0.22682E-02 ppm1 3.884 ppm2 4.981 CV 1
ASSI { 216}
(( segid " " and resid 22 and name HD2 ))
(( segid " " and resid 22 and name HA ))
3.400 1.500 1.500 peak 216 spectrum 1 weight 0.10000E+01 volume 0.13603E-02 ppm1 3.902 ppm2 4.214 CV 1
ASSI { 217}
(( segid " " and resid 14 and name HE3 ))
(( segid " " and resid 14 and name HG3 ))
2.700 0.900 0.900 peak 217 spectrum 1 weight 0.10000E+01 volume 0.38637E-02 ppm1 2.979 ppm2 1.398 CV 1
OR { 217}
(( segid " " and resid 14 and name HE2 ))
(( segid " " and resid 14 and name HG3 ))
ASSI { 220}
(( segid " " and resid 16 and name HE3 ))
(( segid " " and resid 16 and name HD2 ))
2.000 0.500 0.500 peak 220 spectrum 1 weight 0.10000E+01 volume 0.17940E-01 ppm1 3.014 ppm2 1.714 CV 1
OR { 220}
(( segid " " and resid 16 and name HE2 ))
(( segid " " and resid 16 and name HD3 ))
OR { 220}
(( segid " " and resid 16 and name HE2 ))
(( segid " " and resid 16 and name HD2 ))
OR { 220}
(( segid " " and resid 16 and name HE3 ))
(( segid " " and resid 16 and name HD3 ))
ASSI { 223}
(( segid " " and resid 14 and name HE3 ))
(( segid " " and resid 14 and name HD3 ))
2.200 0.600 0.600 peak 223 spectrum 1 weight 0.10000E+01 volume 0.11150E-01 ppm1 2.978 ppm2 1.730 CV 1
OR { 223}
(( segid " " and resid 14 and name HE3 ))
(( segid " " and resid 14 and name HD2 ))
OR { 223}
(( segid " " and resid 14 and name HE2 ))
(( segid " " and resid 14 and name HD3 ))
OR { 223}
(( segid " " and resid 14 and name HE2 ))
(( segid " " and resid 14 and name HD2 ))
ASSI { 224}
(( segid " " and resid 22 and name HD3 ))
( segid " " and resid 20 and name HG2%)
3.200 1.300 1.300 peak 224 spectrum 1 weight 0.10000E+01 volume 0.94650E-03 ppm1 4.108 ppm2 0.716 CV 1
ASSI { 226}
(( segid " " and resid 14 and name HE3 ))
(( segid " " and resid 70 and name HB2 ))
3.200 1.300 1.300 peak 226 spectrum 1 weight 0.10000E+01 volume 0.10314E-02 ppm1 2.978 ppm2 2.048 CV 1
OR { 226}
(( segid " " and resid 14 and name HE2 ))
(( segid " " and resid 70 and name HB2 ))
ASSI { 229}
(( segid " " and resid 40 and name HD2 ))
(( segid " " and resid 39 and name HB3 ))
4.500 2.500 1.500 peak 229 spectrum 1 weight 0.10000E+01 volume 0.40636E-03 ppm1 3.901 ppm2 1.684 CV 1
ASSI { 230}
(( segid " " and resid 22 and name HD2 ))
( segid " " and resid 20 and name HG2%)
3.700 1.700 1.700 peak 230 spectrum 1 weight 0.10000E+01 volume 0.15145E-02 ppm1 3.894 ppm2 0.703 CV 1
ASSI { 235}
(( segid " " and resid 16 and name HE2 ))
(( segid " " and resid 70 and name HG2 ))
4.000 2.000 2.000 peak 235 spectrum 1 weight 0.10000E+01 volume 0.93268E-03 ppm1 3.011 ppm2 2.425 CV 1
OR { 235}
(( segid " " and resid 16 and name HE3 ))
(( segid " " and resid 70 and name HG2 ))
ASSI { 236}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 59 and name HA ))
3.700 1.800 1.800 peak 236 spectrum 1 weight 0.10000E+01 volume 0.90489E-03 ppm1 3.866 ppm2 4.560 CV 1
ASSI { 237}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 42 and name HA ))
3.600 1.600 1.600 peak 237 spectrum 1 weight 0.10000E+01 volume 0.43340E-03 ppm1 3.860 ppm2 4.330 CV 1
ASSI { 239}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 59 and name HD3 ))
1.700 0.400 0.500 peak 239 spectrum 1 weight 0.10000E+01 volume 0.16557E-01 ppm1 3.862 ppm2 3.675 CV 1
ASSI { 246}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 58 and name HB2 ))
3.700 1.700 1.700 peak 246 spectrum 1 weight 0.10000E+01 volume 0.11075E-02 ppm1 3.871 ppm2 1.873 CV 1
ASSI { 247}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 59 and name HG2 ))
2.300 0.700 0.700 peak 247 spectrum 1 weight 0.10000E+01 volume 0.48599E-02 ppm1 3.862 ppm2 2.004 CV 1
OR { 247}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 59 and name HG3 ))
ASSI { 248}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 59 and name HB3 ))
3.600 1.600 1.600 peak 248 spectrum 1 weight 0.10000E+01 volume 0.17056E-02 ppm1 3.863 ppm2 1.736 CV 1
ASSI { 249}
(( segid " " and resid 59 and name HD3 ))
(( segid " " and resid 59 and name HB2 ))
4.000 2.000 2.000 peak 249 spectrum 1 weight 0.10000E+01 volume 0.92925E-03 ppm1 3.675 ppm2 2.213 CV 1
ASSI { 250}
(( segid " " and resid 59 and name HD3 ))
(( segid " " and resid 59 and name HG3 ))
2.300 0.700 0.700 peak 250 spectrum 1 weight 0.10000E+01 volume 0.58285E-02 ppm1 3.672 ppm2 2.004 CV 1
OR { 250}
(( segid " " and resid 59 and name HD3 ))
(( segid " " and resid 59 and name HG2 ))
ASSI { 251}
(( segid " " and resid 59 and name HD3 ))
(( segid " " and resid 58 and name HB2 ))
3.700 1.700 1.700 peak 251 spectrum 1 weight 0.10000E+01 volume 0.22518E-02 ppm1 3.671 ppm2 1.873 CV 1
ASSI { 252}
(( segid " " and resid 59 and name HD3 ))
(( segid " " and resid 59 and name HB3 ))
2.700 0.900 0.900 peak 252 spectrum 1 weight 0.10000E+01 volume 0.26984E-02 ppm1 3.674 ppm2 1.733 CV 1
ASSI { 254}
(( segid " " and resid 59 and name HG2 ))
(( segid " " and resid 60 and name HN ))
4.800 2.900 1.200 peak 254 spectrum 1 weight 0.10000E+01 volume 0.41037E-03 ppm1 2.006 ppm2 8.297 CV 1
OR { 254}
(( segid " " and resid 59 and name HG3 ))
(( segid " " and resid 60 and name HN ))
ASSI { 256}
(( segid " " and resid 59 and name HG3 ))
( segid " " and resid 49 and name HE% )
3.100 3.100 2.900 peak 256 spectrum 1 weight 0.10000E+01 volume 0.94383E-03 ppm1 1.999 ppm2 7.089 CV 1
OR { 256}
(( segid " " and resid 59 and name HG2 ))
( segid " " and resid 49 and name HE% )
ASSI { 261}
(( segid " " and resid 42 and name HE2 ))
(( segid " " and resid 40 and name HG3 ))
3.400 1.500 1.500 peak 261 spectrum 1 weight 0.10000E+01 volume 0.64673E-03 ppm1 3.105 ppm2 2.193 CV 1
OR { 261}
(( segid " " and resid 42 and name HE3 ))
(( segid " " and resid 40 and name HG2 ))
OR { 261}
(( segid " " and resid 42 and name HE2 ))
(( segid " " and resid 40 and name HG2 ))
ASSI { 263}
(( segid " " and resid 59 and name HG2 ))
( segid " " and resid 41 and name HD1%)
3.000 1.200 1.200 peak 263 spectrum 1 weight 0.10000E+01 volume 0.10885E-02 ppm1 2.008 ppm2 0.800 CV 1
OR { 263}
(( segid " " and resid 59 and name HG3 ))
( segid " " and resid 41 and name HD1%)
ASSI { 264}
(( segid " " and resid 59 and name HG2 ))
( segid " " and resid 41 and name HD2%)
3.900 1.900 1.900 peak 264 spectrum 1 weight 0.10000E+01 volume 0.11369E-02 ppm1 1.991 ppm2 0.917 CV 1
OR { 264}
(( segid " " and resid 59 and name HG3 ))
( segid " " and resid 41 and name HD2%)
ASSI { 265}
(( segid " " and resid 59 and name HG2 ))
( segid " " and resid 44 and name HD1%)
4.600 2.700 1.400 peak 265 spectrum 1 weight 0.10000E+01 volume 0.42571E-03 ppm1 1.986 ppm2 0.591 CV 1
OR { 265}
(( segid " " and resid 59 and name HG3 ))
( segid " " and resid 44 and name HD1%)
ASSI { 266}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 53 and name HB3 ))
1.900 1.900 4.100 peak 266 spectrum 1 weight 0.10000E+01 volume 0.26057E-01 ppm1 2.979 ppm2 3.202 CV 1
OR { 266}
(( segid " " and resid 46 and name HD3 ))
(( segid " " and resid 53 and name HB3 ))
ASSI { 267}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 46 and name HA ))
3.400 1.500 1.500 peak 267 spectrum 1 weight 0.10000E+01 volume 0.14856E-02 ppm1 2.975 ppm2 3.363 CV 1
OR { 267}
(( segid " " and resid 46 and name HD3 ))
(( segid " " and resid 46 and name HA ))
ASSI { 272}
( segid " " and resid 44 and name HD1%)
( segid " " and resid 64 and name HG1%)
3.200 1.300 1.300 peak 272 spectrum 1 weight 0.10000E+01 volume 0.12443E-02 ppm1 0.578 ppm2 0.115 CV 1
ASSI { 279}
( segid " " and resid 61 and name HG2%)
(( segid " " and resid 41 and name HA ))
4.300 2.400 1.700 peak 279 spectrum 1 weight 0.10000E+01 volume 0.63983E-03 ppm1 0.881 ppm2 3.902 CV 1
ASSI { 283}
( segid " " and resid 61 and name HG2%)
(( segid " " and resid 61 and name HB ))
2.200 0.600 0.600 peak 283 spectrum 1 weight 0.10000E+01 volume 0.51819E-02 ppm1 0.872 ppm2 1.710 CV 1
ASSI { 285}
( segid " " and resid 61 and name HG2%)
(( segid " " and resid 65 and name HG ))
4.000 2.000 2.000 peak 285 spectrum 1 weight 0.10000E+01 volume 0.97812E-03 ppm1 0.875 ppm2 1.421 CV 1
ASSI { 286}
( segid " " and resid 61 and name HG2%)
(( segid " " and resid 61 and name HG12))
2.600 0.900 0.900 peak 286 spectrum 1 weight 0.10000E+01 volume 0.20519E-02 ppm1 0.872 ppm2 1.255 CV 1
ASSI { 287}
( segid " " and resid 61 and name HG2%)
(( segid " " and resid 61 and name HG13))
2.700 0.900 0.900 peak 287 spectrum 1 weight 0.10000E+01 volume 0.86937E-02 ppm1 0.871 ppm2 1.041 CV 1
ASSI { 288}
( segid " " and resid 61 and name HG2%)
( segid " " and resid 41 and name HD1%)
3.100 1.200 1.200 peak 288 spectrum 1 weight 0.10000E+01 volume 0.56889E-02 ppm1 0.870 ppm2 0.778 CV 1
ASSI { 289}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 46 and name HB2 ))
2.900 1.000 1.000 peak 289 spectrum 1 weight 0.10000E+01 volume 0.22335E-02 ppm1 2.984 ppm2 1.767 CV 1
OR { 289}
(( segid " " and resid 46 and name HD3 ))
(( segid " " and resid 46 and name HB2 ))
ASSI { 292}
(( segid " " and resid 19 and name HD3 ))
(( segid " " and resid 19 and name HG2 ))
2.400 0.700 0.700 peak 292 spectrum 1 weight 0.10000E+01 volume 0.25767E-02 ppm1 3.067 ppm2 1.681 CV 1
ASSI { 293}
(( segid " " and resid 19 and name HD3 ))
(( segid " " and resid 24 and name HG ))
3.300 3.300 2.700 peak 293 spectrum 1 weight 0.10000E+01 volume 0.15751E-02 ppm1 3.068 ppm2 1.771 CV 1
ASSI { 294}
( segid " " and resid 51 and name HB% )
(( segid " " and resid 52 and name HA ))
3.500 1.500 1.500 peak 294 spectrum 1 weight 0.10000E+01 volume 0.11355E-02 ppm1 1.466 ppm2 4.651 CV 1
ASSI { 295}
( segid " " and resid 51 and name HB% )
(( segid " " and resid 50 and name HA ))
4.400 2.500 1.600 peak 295 spectrum 1 weight 0.10000E+01 volume 0.12011E-02 ppm1 1.465 ppm2 4.561 CV 1
ASSI { 296}
(( segid " " and resid 19 and name HD3 ))
(( segid " " and resid 19 and name HB3 ))
3.200 1.300 1.300 peak 296 spectrum 1 weight 0.10000E+01 volume 0.14909E-02 ppm1 3.071 ppm2 1.883 CV 1
ASSI { 297}
( segid " " and resid 51 and name HB% )
(( segid " " and resid 47 and name HA ))
3.400 1.400 1.400 peak 297 spectrum 1 weight 0.10000E+01 volume 0.10906E-02 ppm1 1.463 ppm2 4.106 CV 1
ASSI { 298}
( segid " " and resid 51 and name HB% )
(( segid " " and resid 95 and name HA2 ))
3.800 1.800 1.800 peak 298 spectrum 1 weight 0.10000E+01 volume 0.62234E-03 ppm1 1.465 ppm2 3.994 CV 1
OR { 298}
( segid " " and resid 51 and name HB% )
(( segid " " and resid 95 and name HA1 ))
ASSI { 300}
( segid " " and resid 51 and name HB% )
(( segid " " and resid 52 and name HB2 ))
4.200 2.200 1.800 peak 300 spectrum 1 weight 0.10000E+01 volume 0.50670E-03 ppm1 1.454 ppm2 2.898 CV 1
ASSI { 303}
( segid " " and resid 51 and name HB% )
(( segid " " and resid 47 and name HB3 ))
3.700 1.700 1.700 peak 303 spectrum 1 weight 0.10000E+01 volume 0.86971E-03 ppm1 1.466 ppm2 1.747 CV 1
OR { 303}
( segid " " and resid 51 and name HB% )
(( segid " " and resid 47 and name HB2 ))
ASSI { 304}
( segid " " and resid 51 and name HB% )
(( segid " " and resid 46 and name HG2 ))
2.600 0.900 0.900 peak 304 spectrum 1 weight 0.10000E+01 volume 0.68445E-02 ppm1 1.467 ppm2 1.567 CV 1
OR { 304}
( segid " " and resid 51 and name HB% )
(( segid " " and resid 46 and name HG3 ))
ASSI { 306}
(( segid " " and resid 19 and name HD3 ))
(( segid " " and resid 19 and name HB2 ))
3.900 1.900 1.900 peak 306 spectrum 1 weight 0.10000E+01 volume 0.14044E-02 ppm1 3.067 ppm2 2.010 CV 1
ASSI { 308}
(( segid " " and resid 19 and name HD3 ))
(( segid " " and resid 21 and name HG3 ))
3.700 1.800 1.800 peak 308 spectrum 1 weight 0.10000E+01 volume 0.45425E-03 ppm1 3.074 ppm2 2.354 CV 1
OR { 308}
(( segid " " and resid 19 and name HD3 ))
(( segid " " and resid 21 and name HG2 ))
ASSI { 309}
(( segid " " and resid 12 and name HB ))
(( segid " " and resid 9 and name HB3 ))
2.700 2.700 3.300 peak 309 spectrum 1 weight 0.10000E+01 volume 0.16619E-02 ppm1 1.548 ppm2 1.822 CV 1
ASSI { 310}
(( segid " " and resid 12 and name HB ))
( segid " " and resid 12 and name HG2%)
2.400 0.700 0.700 peak 310 spectrum 1 weight 0.10000E+01 volume 0.64850E-02 ppm1 1.547 ppm2 0.798 CV 1
OR { 310}
(( segid " " and resid 12 and name HB ))
( segid " " and resid 12 and name HD1%)
ASSI { 318}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 63 and name HN ))
3.700 1.700 1.700 peak 318 spectrum 1 weight 0.10000E+01 volume 0.52730E-03 ppm1 2.832 ppm2 7.823 CV 1
ASSI { 323}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 61 and name HN ))
4.100 2.100 1.900 peak 323 spectrum 1 weight 0.10000E+01 volume 0.60020E-03 ppm1 2.837 ppm2 9.558 CV 1
ASSI { 324}
(( segid " " and resid 38 and name HB3 ))
(( segid " " and resid 39 and name HN ))
4.500 2.500 1.500 peak 324 spectrum 1 weight 0.10000E+01 volume 0.42811E-03 ppm1 2.972 ppm2 8.909 CV 1
ASSI { 325}
(( segid " " and resid 38 and name HB3 ))
(( segid " " and resid 29 and name HN ))
4.400 2.500 1.600 peak 325 spectrum 1 weight 0.10000E+01 volume 0.42213E-03 ppm1 2.980 ppm2 9.003 CV 1
ASSI { 327}
( segid " " and resid 45 and name HB% )
( segid " " and resid 94 and name HB% )
1.900 0.400 0.400 peak 327 spectrum 1 weight 0.10000E+01 volume 0.31196E-01 ppm1 1.143 ppm2 1.417 CV 1
ASSI { 329}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 39 and name HN ))
4.700 2.800 1.300 peak 329 spectrum 1 weight 0.10000E+01 volume 0.52404E-03 ppm1 2.807 ppm2 8.889 CV 1
ASSI { 330}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 29 and name HN ))
4.000 2.000 2.000 peak 330 spectrum 1 weight 0.10000E+01 volume 0.45771E-03 ppm1 2.806 ppm2 9.001 CV 1
ASSI { 334}
(( segid " " and resid 66 and name HD3 ))
(( segid " " and resid 66 and name HN ))
3.600 1.600 1.600 peak 334 spectrum 1 weight 0.10000E+01 volume 0.51049E-03 ppm1 3.222 ppm2 8.020 CV 1
OR { 334}
(( segid " " and resid 66 and name HD2 ))
(( segid " " and resid 66 and name HN ))
ASSI { 335}
(( segid " " and resid 66 and name HD3 ))
(( segid " " and resid 67 and name HN ))
4.500 2.500 1.500 peak 335 spectrum 1 weight 0.10000E+01 volume 0.49452E-03 ppm1 3.220 ppm2 9.037 CV 1
OR { 335}
(( segid " " and resid 66 and name HD2 ))
(( segid " " and resid 67 and name HN ))
ASSI { 341}
( segid " " and resid 24 and name HD1%)
( segid " " and resid 38 and name HE% )
3.000 1.100 1.100 peak 341 spectrum 1 weight 0.10000E+01 volume 0.19371E-02 ppm1 1.107 ppm2 7.175 CV 1
ASSI { 343}
( segid " " and resid 26 and name HB% )
(( segid " " and resid 26 and name HN ))
2.700 0.900 0.900 peak 343 spectrum 1 weight 0.10000E+01 volume 0.45434E-02 ppm1 0.573 ppm2 7.305 CV 1
ASSI { 345}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 64 and name HN ))
4.100 2.100 1.900 peak 345 spectrum 1 weight 0.10000E+01 volume 0.49890E-03 ppm1 0.569 ppm2 7.197 CV 1
ASSI { 347}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 41 and name HN ))
3.500 1.500 1.500 peak 347 spectrum 1 weight 0.10000E+01 volume 0.14191E-02 ppm1 0.577 ppm2 8.477 CV 1
ASSI { 355}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 62 and name HN ))
3.900 1.900 1.900 peak 355 spectrum 1 weight 0.10000E+01 volume 0.45817E-03 ppm1 4.202 ppm2 8.304 CV 1
ASSI { 364}
(( segid " " and resid 60 and name HB3 ))
(( segid " " and resid 60 and name HB2 ))
1.800 0.400 0.400 peak 364 spectrum 1 weight 0.10000E+01 volume 0.16493E-01 ppm1 3.004 ppm2 2.839 CV 1
ASSI { 369}
(( segid " " and resid 64 and name HA ))
( segid " " and resid 49 and name HD% )
4.900 3.000 1.100 peak 369 spectrum 1 weight 0.10000E+01 volume 0.29700E-03 ppm1 3.842 ppm2 6.942 CV 1
ASSI { 374}
(( segid " " and resid 60 and name HB3 ))
(( segid " " and resid 60 and name HA ))
3.000 1.100 1.100 peak 374 spectrum 1 weight 0.10000E+01 volume 0.15501E-02 ppm1 3.005 ppm2 4.970 CV 1
ASSI { 376}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 60 and name HA ))
2.900 1.000 1.000 peak 376 spectrum 1 weight 0.10000E+01 volume 0.23405E-02 ppm1 2.835 ppm2 4.971 CV 1
ASSI { 377}
(( segid " " and resid 8 and name HE3 ))
(( segid " " and resid 8 and name HA ))
3.400 1.500 1.500 peak 377 spectrum 1 weight 0.10000E+01 volume 0.10956E-02 ppm1 3.056 ppm2 4.351 CV 1
OR { 377}
(( segid " " and resid 8 and name HE2 ))
(( segid " " and resid 8 and name HA ))
ASSI { 378}
(( segid " " and resid 38 and name HB3 ))
(( segid " " and resid 38 and name HA ))
3.500 1.600 1.600 peak 378 spectrum 1 weight 0.10000E+01 volume 0.96635E-03 ppm1 2.973 ppm2 4.618 CV 1
ASSI { 380}
(( segid " " and resid 83 and name HE3 ))
(( segid " " and resid 83 and name HD2 ))
2.800 0.900 0.900 peak 380 spectrum 1 weight 0.10000E+01 volume 0.28422E-02 ppm1 2.949 ppm2 1.642 CV 1
OR { 380}
(( segid " " and resid 83 and name HE2 ))
(( segid " " and resid 83 and name HD3 ))
OR { 380}
(( segid " " and resid 83 and name HE2 ))
(( segid " " and resid 83 and name HD2 ))
OR { 380}
(( segid " " and resid 83 and name HE3 ))
(( segid " " and resid 83 and name HD3 ))
ASSI { 382}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 55 and name HB% )
3.700 1.700 1.700 peak 382 spectrum 1 weight 0.10000E+01 volume 0.80442E-03 ppm1 4.213 ppm2 1.265 CV 1
ASSI { 383}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 50 and name HB2 ))
4.300 2.300 1.700 peak 383 spectrum 1 weight 0.10000E+01 volume 0.37499E-03 ppm1 4.212 ppm2 2.092 CV 1
ASSI { 384}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 52 and name HA ))
3.900 1.900 1.900 peak 384 spectrum 1 weight 0.10000E+01 volume 0.53455E-03 ppm1 4.211 ppm2 4.650 CV 1
ASSI { 385}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 50 and name HA ))
4.700 2.700 1.300 peak 385 spectrum 1 weight 0.10000E+01 volume 0.46930E-03 ppm1 4.211 ppm2 4.548 CV 1
ASSI { 390}
(( segid " " and resid 38 and name HB3 ))
(( segid " " and resid 38 and name HB2 ))
2.000 0.500 0.500 peak 390 spectrum 1 weight 0.10000E+01 volume 0.74399E-02 ppm1 2.969 ppm2 2.809 CV 1
ASSI { 391}
(( segid " " and resid 53 and name HB3 ))
(( segid " " and resid 50 and name HG2 ))
4.200 2.200 1.800 peak 391 spectrum 1 weight 0.10000E+01 volume 0.44546E-03 ppm1 3.206 ppm2 2.204 CV 1
ASSI { 392}
(( segid " " and resid 53 and name HB3 ))
(( segid " " and resid 50 and name HB2 ))
3.900 1.900 1.900 peak 392 spectrum 1 weight 0.10000E+01 volume 0.49062E-03 ppm1 3.206 ppm2 2.074 CV 1
ASSI { 395}
(( segid " " and resid 53 and name HB3 ))
(( segid " " and resid 53 and name HB2 ))
1.900 0.500 0.500 peak 395 spectrum 1 weight 0.10000E+01 volume 0.82229E-02 ppm1 3.206 ppm2 3.038 CV 1
ASSI { 396}
(( segid " " and resid 53 and name HB3 ))
(( segid " " and resid 52 and name HB2 ))
2.800 2.800 3.200 peak 396 spectrum 1 weight 0.10000E+01 volume 0.11749E-02 ppm1 3.202 ppm2 2.901 CV 1
ASSI { 397}
(( segid " " and resid 53 and name HB3 ))
(( segid " " and resid 49 and name HB2 ))
3.200 1.300 1.300 peak 397 spectrum 1 weight 0.10000E+01 volume 0.73318E-03 ppm1 3.203 ppm2 2.818 CV 1
ASSI { 400}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 52 and name HB2 ))
2.400 2.400 3.600 peak 400 spectrum 1 weight 0.10000E+01 volume 0.31985E-02 ppm1 3.047 ppm2 2.865 CV 1
ASSI { 405}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 58 and name HA ))
2.800 1.000 1.000 peak 405 spectrum 1 weight 0.10000E+01 volume 0.25603E-02 ppm1 1.869 ppm2 4.649 CV 1
ASSI { 406}
(( segid " " and resid 58 and name HB3 ))
(( segid " " and resid 58 and name HA ))
2.700 0.900 0.900 peak 406 spectrum 1 weight 0.10000E+01 volume 0.20246E-02 ppm1 1.775 ppm2 4.643 CV 1
ASSI { 408}
(( segid " " and resid 58 and name HB3 ))
(( segid " " and resid 59 and name HD2 ))
4.200 2.200 1.800 peak 408 spectrum 1 weight 0.10000E+01 volume 0.40086E-03 ppm1 1.796 ppm2 3.863 CV 1
ASSI { 410}
(( segid " " and resid 58 and name HB3 ))
(( segid " " and resid 59 and name HD3 ))
4.600 2.600 1.400 peak 410 spectrum 1 weight 0.10000E+01 volume 0.71757E-03 ppm1 1.782 ppm2 3.674 CV 1
ASSI { 411}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 58 and name HD2 ))
3.200 1.300 1.300 peak 411 spectrum 1 weight 0.10000E+01 volume 0.14754E-02 ppm1 1.867 ppm2 3.266 CV 1
OR { 411}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 58 and name HD3 ))
ASSI { 412}
(( segid " " and resid 58 and name HB3 ))
(( segid " " and resid 58 and name HD2 ))
3.200 1.300 1.300 peak 412 spectrum 1 weight 0.10000E+01 volume 0.13670E-02 ppm1 1.778 ppm2 3.258 CV 1
OR { 412}
(( segid " " and resid 58 and name HB3 ))
(( segid " " and resid 58 and name HD3 ))
ASSI { 416}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HB ))
2.500 0.800 0.800 peak 416 spectrum 1 weight 0.10000E+01 volume 0.29493E-02 ppm1 3.786 ppm2 1.699 CV 1
ASSI { 419}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HG12))
3.000 1.200 1.200 peak 419 spectrum 1 weight 0.10000E+01 volume 0.25222E-02 ppm1 3.790 ppm2 1.260 CV 1
ASSI { 420}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HG13))
2.700 0.900 0.900 peak 420 spectrum 1 weight 0.10000E+01 volume 0.13864E-02 ppm1 3.791 ppm2 1.069 CV 1
ASSI { 422}
(( segid " " and resid 61 and name HA ))
( segid " " and resid 41 and name HD1%)
2.900 1.100 1.100 peak 422 spectrum 1 weight 0.10000E+01 volume 0.18740E-02 ppm1 3.783 ppm2 0.791 CV 1
ASSI { 423}
(( segid " " and resid 61 and name HA ))
( segid " " and resid 20 and name HG2%)
4.000 2.000 2.000 peak 423 spectrum 1 weight 0.10000E+01 volume 0.72312E-03 ppm1 3.781 ppm2 0.704 CV 1
OR { 423}
(( segid " " and resid 61 and name HA ))
( segid " " and resid 20 and name HD1%)
ASSI { 428}
(( segid " " and resid 61 and name HB ))
( segid " " and resid 20 and name HG2%)
4.400 2.500 1.600 peak 428 spectrum 1 weight 0.10000E+01 volume 0.53261E-03 ppm1 1.710 ppm2 0.709 CV 1
ASSI { 431}
(( segid " " and resid 61 and name HB ))
(( segid " " and resid 41 and name HB2 ))
2.700 0.900 0.900 peak 431 spectrum 1 weight 0.10000E+01 volume 0.88963E-03 ppm1 1.712 ppm2 1.383 CV 1
ASSI { 432}
(( segid " " and resid 61 and name HB ))
(( segid " " and resid 61 and name HG12))
3.100 1.200 1.200 peak 432 spectrum 1 weight 0.10000E+01 volume 0.12747E-02 ppm1 1.703 ppm2 1.266 CV 1
ASSI { 433}
(( segid " " and resid 61 and name HB ))
(( segid " " and resid 61 and name HG13))
3.000 1.100 1.100 peak 433 spectrum 1 weight 0.10000E+01 volume 0.75611E-03 ppm1 1.701 ppm2 1.082 CV 1
ASSI { 436}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HB2 ))
2.300 0.700 0.700 peak 436 spectrum 1 weight 0.10000E+01 volume 0.75303E-02 ppm1 4.177 ppm2 1.833 CV 1
OR { 436}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HB3 ))
ASSI { 437}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HD3 ))
3.500 1.600 1.600 peak 437 spectrum 1 weight 0.10000E+01 volume 0.11747E-02 ppm1 4.178 ppm2 1.715 CV 1
OR { 437}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HD2 ))
ASSI { 438}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HG3 ))
3.700 1.700 1.700 peak 438 spectrum 1 weight 0.10000E+01 volume 0.15618E-02 ppm1 4.177 ppm2 1.454 CV 1
ASSI { 439}
(( segid " " and resid 62 and name HA ))
( segid " " and resid 61 and name HG2%)
3.500 1.500 1.500 peak 439 spectrum 1 weight 0.10000E+01 volume 0.83508E-03 ppm1 4.176 ppm2 0.861 CV 1
ASSI { 440}
(( segid " " and resid 62 and name HA ))
( segid " " and resid 20 and name HG2%)
2.600 0.800 0.800 peak 440 spectrum 1 weight 0.10000E+01 volume 0.35550E-02 ppm1 4.177 ppm2 0.709 CV 1
ASSI { 441}
(( segid " " and resid 62 and name HA ))
( segid " " and resid 61 and name HD1%)
4.400 2.500 1.600 peak 441 spectrum 1 weight 0.10000E+01 volume 0.57429E-03 ppm1 4.182 ppm2 0.582 CV 1
ASSI { 444}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 59 and name HB2 ))
4.300 2.300 1.700 peak 444 spectrum 1 weight 0.10000E+01 volume 0.69882E-03 ppm1 3.847 ppm2 2.208 CV 1
ASSI { 445}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 64 and name HB ))
3.100 1.200 1.200 peak 445 spectrum 1 weight 0.10000E+01 volume 0.15316E-02 ppm1 3.844 ppm2 1.631 CV 1
ASSI { 449}
(( segid " " and resid 64 and name HB ))
(( segid " " and resid 65 and name HG ))
3.700 1.700 1.700 peak 449 spectrum 1 weight 0.10000E+01 volume 0.58616E-03 ppm1 1.637 ppm2 1.387 CV 1
OR { 449}
(( segid " " and resid 64 and name HB ))
(( segid " " and resid 65 and name HB2 ))
ASSI { 450}
(( segid " " and resid 64 and name HB ))
( segid " " and resid 20 and name HG2%)
2.800 2.800 3.200 peak 450 spectrum 1 weight 0.10000E+01 volume 0.11355E-02 ppm1 1.628 ppm2 0.737 CV 1
ASSI { 455}
(( segid " " and resid 66 and name HB3 ))
(( segid " " and resid 66 and name HD3 ))
2.900 1.100 1.100 peak 455 spectrum 1 weight 0.10000E+01 volume 0.17110E-02 ppm1 1.694 ppm2 3.225 CV 1
OR { 455}
(( segid " " and resid 66 and name HB3 ))
(( segid " " and resid 66 and name HD2 ))
ASSI { 458}
(( segid " " and resid 62 and name HB2 ))
( segid " " and resid 61 and name HG2%)
3.700 1.700 1.700 peak 458 spectrum 1 weight 0.10000E+01 volume 0.10796E-02 ppm1 1.816 ppm2 0.875 CV 1
OR { 458}
(( segid " " and resid 62 and name HB3 ))
( segid " " and resid 61 and name HG2%)
ASSI { 459}
(( segid " " and resid 62 and name HB2 ))
( segid " " and resid 20 and name HG2%)
3.500 1.500 1.500 peak 459 spectrum 1 weight 0.10000E+01 volume 0.14260E-02 ppm1 1.820 ppm2 0.704 CV 1
OR { 459}
(( segid " " and resid 62 and name HB3 ))
( segid " " and resid 20 and name HG2%)
ASSI { 461}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 20 and name HA ))
2.100 2.100 3.900 peak 461 spectrum 1 weight 0.10000E+01 volume 0.65846E-02 ppm1 4.178 ppm2 4.288 CV 1
ASSI { 471}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 63 and name HN ))
3.200 1.300 1.300 peak 471 spectrum 1 weight 0.10000E+01 volume 0.13405E-02 ppm1 1.827 ppm2 7.839 CV 1
OR { 471}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 63 and name HN ))
ASSI { 474}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 22 and name HG2 ))
4.400 2.400 1.600 peak 474 spectrum 1 weight 0.10000E+01 volume 0.62204E-03 ppm1 1.821 ppm2 2.318 CV 1
OR { 474}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 22 and name HG2 ))
ASSI { 477}
(( segid " " and resid 42 and name HB3 ))
(( segid " " and resid 42 and name HB2 ))
1.800 0.400 0.400 peak 477 spectrum 1 weight 0.10000E+01 volume 0.12230E-01 ppm1 1.886 ppm2 2.075 CV 1
ASSI { 478}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 62 and name HG2 ))
2.400 0.700 0.700 peak 478 spectrum 1 weight 0.10000E+01 volume 0.78868E-02 ppm1 1.825 ppm2 1.532 CV 1
OR { 478}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 62 and name HG2 ))
ASSI { 479}
(( segid " " and resid 80 and name HB2 ))
(( segid " " and resid 80 and name HB3 ))
1.600 0.300 0.600 peak 479 spectrum 1 weight 0.10000E+01 volume 0.29308E-01 ppm1 1.886 ppm2 1.813 CV 1
ASSI { 480}
(( segid " " and resid 80 and name HB3 ))
(( segid " " and resid 80 and name HG2 ))
2.100 0.600 0.600 peak 480 spectrum 1 weight 0.10000E+01 volume 0.11834E-01 ppm1 1.803 ppm2 1.699 CV 1
ASSI { 481}
(( segid " " and resid 66 and name HB3 ))
(( segid " " and resid 66 and name HB2 ))
1.700 0.400 0.500 peak 481 spectrum 1 weight 0.10000E+01 volume 0.16325E-01 ppm1 1.693 ppm2 1.833 CV 1
ASSI { 483}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 66 and name HG2 ))
4.400 2.400 1.600 peak 483 spectrum 1 weight 0.10000E+01 volume 0.70916E-03 ppm1 1.376 ppm2 1.595 CV 1
OR { 483}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 66 and name HG3 ))
ASSI { 485}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 65 and name HB3 ))
2.100 0.500 0.500 peak 485 spectrum 1 weight 0.10000E+01 volume 0.39719E-02 ppm1 1.373 ppm2 1.188 CV 1
ASSI { 486}
(( segid " " and resid 65 and name HB2 ))
( segid " " and resid 65 and name HD2%)
3.500 1.500 1.500 peak 486 spectrum 1 weight 0.10000E+01 volume 0.16239E-02 ppm1 1.373 ppm2 0.639 CV 1
ASSI { 487}
(( segid " " and resid 65 and name HB2 ))
( segid " " and resid 65 and name HD1%)
2.800 1.000 1.000 peak 487 spectrum 1 weight 0.10000E+01 volume 0.23042E-02 ppm1 1.375 ppm2 0.559 CV 1
ASSI { 488}
(( segid " " and resid 65 and name HB3 ))
(( segid " " and resid 66 and name HB3 ))
4.300 2.300 1.700 peak 488 spectrum 1 weight 0.10000E+01 volume 0.39966E-03 ppm1 1.170 ppm2 1.680 CV 1
ASSI { 489}
(( segid " " and resid 65 and name HB3 ))
(( segid " " and resid 66 and name HG2 ))
4.200 2.200 1.800 peak 489 spectrum 1 weight 0.10000E+01 volume 0.70772E-03 ppm1 1.183 ppm2 1.593 CV 1
OR { 489}
(( segid " " and resid 65 and name HB3 ))
(( segid " " and resid 66 and name HG3 ))
ASSI { 502}
(( segid " " and resid 63 and name HB3 ))
( segid " " and resid 64 and name HG2%)
3.800 1.800 1.800 peak 502 spectrum 1 weight 0.10000E+01 volume 0.62535E-03 ppm1 2.849 ppm2 0.370 CV 1
OR { 502}
(( segid " " and resid 63 and name HB2 ))
( segid " " and resid 64 and name HG2%)
ASSI { 503}
(( segid " " and resid 63 and name HB3 ))
( segid " " and resid 64 and name HG1%)
4.300 2.400 1.700 peak 503 spectrum 1 weight 0.10000E+01 volume 0.52289E-03 ppm1 2.848 ppm2 0.115 CV 1
OR { 503}
(( segid " " and resid 63 and name HB2 ))
( segid " " and resid 64 and name HG1%)
ASSI { 504}
(( segid " " and resid 68 and name HA2 ))
(( segid " " and resid 16 and name HD2 ))
3.900 1.900 1.900 peak 504 spectrum 1 weight 0.10000E+01 volume 0.13000E-02 ppm1 3.597 ppm2 1.693 CV 1
OR { 504}
(( segid " " and resid 68 and name HA2 ))
(( segid " " and resid 16 and name HD3 ))
ASSI { 505}
(( segid " " and resid 68 and name HA2 ))
(( segid " " and resid 16 and name HG2 ))
4.300 2.300 1.700 peak 505 spectrum 1 weight 0.10000E+01 volume 0.60952E-03 ppm1 3.595 ppm2 1.358 CV 1
ASSI { 506}
(( segid " " and resid 68 and name HA2 ))
(( segid " " and resid 16 and name HE3 ))
4.800 2.900 1.200 peak 506 spectrum 1 weight 0.10000E+01 volume 0.54611E-03 ppm1 3.596 ppm2 3.018 CV 1
OR { 506}
(( segid " " and resid 68 and name HA2 ))
(( segid " " and resid 16 and name HE2 ))
ASSI { 509}
(( segid " " and resid 68 and name HA2 ))
(( segid " " and resid 68 and name HA1 ))
1.800 0.400 0.400 peak 509 spectrum 1 weight 0.10000E+01 volume 0.14094E-01 ppm1 3.594 ppm2 4.449 CV 1
ASSI { 518}
(( segid " " and resid 68 and name HA1 ))
(( segid " " and resid 16 and name HB3 ))
2.900 1.000 1.000 peak 518 spectrum 1 weight 0.10000E+01 volume 0.14980E-02 ppm1 4.449 ppm2 1.692 CV 1
OR { 518}
(( segid " " and resid 68 and name HA1 ))
(( segid " " and resid 16 and name HD2 ))
OR { 518}
(( segid " " and resid 68 and name HA1 ))
(( segid " " and resid 16 and name HB2 ))
ASSI { 519}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 66 and name HA ))
4.300 2.300 1.700 peak 519 spectrum 1 weight 0.10000E+01 volume 0.44941E-03 ppm1 3.654 ppm2 4.556 CV 1
ASSI { 520}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 68 and name HA1 ))
4.300 2.400 1.700 peak 520 spectrum 1 weight 0.10000E+01 volume 0.82927E-03 ppm1 3.646 ppm2 4.438 CV 1
ASSI { 521}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 17 and name HA ))
3.500 1.500 1.500 peak 521 spectrum 1 weight 0.10000E+01 volume 0.13437E-02 ppm1 3.650 ppm2 4.303 CV 1
ASSI { 522}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 17 and name HB ))
2.700 0.900 0.900 peak 522 spectrum 1 weight 0.10000E+01 volume 0.18144E-02 ppm1 3.660 ppm2 2.378 CV 1
ASSI { 525}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 67 and name HB3 ))
2.400 0.700 0.700 peak 525 spectrum 1 weight 0.10000E+01 volume 0.46870E-02 ppm1 3.649 ppm2 1.983 CV 1
OR { 525}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 67 and name HB2 ))
ASSI { 527}
(( segid " " and resid 43 and name HB3 ))
(( segid " " and resid 43 and name HA ))
3.300 1.400 1.400 peak 527 spectrum 1 weight 0.10000E+01 volume 0.83953E-03 ppm1 1.937 ppm2 4.948 CV 1
ASSI { 528}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 66 and name HA ))
4.800 2.800 1.200 peak 528 spectrum 1 weight 0.10000E+01 volume 0.63047E-03 ppm1 1.974 ppm2 4.560 CV 1
OR { 528}
(( segid " " and resid 67 and name HB3 ))
(( segid " " and resid 66 and name HA ))
ASSI { 529}
(( segid " " and resid 66 and name HB3 ))
(( segid " " and resid 66 and name HA ))
2.700 0.900 0.900 peak 529 spectrum 1 weight 0.10000E+01 volume 0.25115E-02 ppm1 1.694 ppm2 4.575 CV 1
ASSI { 530}
(( segid " " and resid 66 and name HB2 ))
(( segid " " and resid 66 and name HD3 ))
3.600 1.600 1.600 peak 530 spectrum 1 weight 0.10000E+01 volume 0.17290E-02 ppm1 1.826 ppm2 3.222 CV 1
OR { 530}
(( segid " " and resid 66 and name HB2 ))
(( segid " " and resid 66 and name HD2 ))
ASSI { 531}
(( segid " " and resid 66 and name HB2 ))
(( segid " " and resid 66 and name HA ))
2.700 0.900 0.900 peak 531 spectrum 1 weight 0.10000E+01 volume 0.31438E-02 ppm1 1.834 ppm2 4.572 CV 1
ASSI { 533}
(( segid " " and resid 67 and name HA ))
( segid " " and resid 17 and name HD1%)
4.700 2.800 1.300 peak 533 spectrum 1 weight 0.10000E+01 volume 0.44293E-03 ppm1 3.644 ppm2 0.557 CV 1
ASSI { 537}
(( segid " " and resid 69 and name HB2 ))
(( segid " " and resid 69 and name HB3 ))
1.800 0.400 0.400 peak 537 spectrum 1 weight 0.10000E+01 volume 0.93459E-02 ppm1 2.297 ppm2 2.078 CV 1
ASSI { 538}
(( segid " " and resid 69 and name HB2 ))
(( segid " " and resid 66 and name HB2 ))
4.200 2.200 1.800 peak 538 spectrum 1 weight 0.10000E+01 volume 0.53120E-03 ppm1 2.282 ppm2 1.834 CV 1
ASSI { 539}
(( segid " " and resid 69 and name HB2 ))
(( segid " " and resid 17 and name HB ))
3.100 1.200 1.200 peak 539 spectrum 1 weight 0.10000E+01 volume 0.27681E-02 ppm1 2.288 ppm2 2.368 CV 1
ASSI { 541}
(( segid " " and resid 69 and name HB2 ))
(( segid " " and resid 66 and name HG2 ))
3.300 1.300 1.300 peak 541 spectrum 1 weight 0.10000E+01 volume 0.62728E-03 ppm1 2.286 ppm2 1.573 CV 1
OR { 541}
(( segid " " and resid 69 and name HB2 ))
(( segid " " and resid 66 and name HG3 ))
ASSI { 543}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 6 and name HA ))
2.600 0.900 0.900 peak 543 spectrum 1 weight 0.10000E+01 volume 0.44230E-02 ppm1 2.009 ppm2 4.274 CV 1
ASSI { 544}
(( segid " " and resid 78 and name HA ))
(( segid " " and resid 78 and name HG2 ))
2.700 0.900 0.900 peak 544 spectrum 1 weight 0.10000E+01 volume 0.35958E-02 ppm1 4.241 ppm2 2.345 CV 1
OR { 544}
(( segid " " and resid 78 and name HA ))
(( segid " " and resid 78 and name HG3 ))
ASSI { 545}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 69 and name HB2 ))
2.500 0.800 0.800 peak 545 spectrum 1 weight 0.10000E+01 volume 0.36580E-02 ppm1 4.228 ppm2 2.311 CV 1
ASSI { 546}
(( segid " " and resid 78 and name HA ))
( segid " " and resid 75 and name HG2%)
2.900 1.000 1.000 peak 546 spectrum 1 weight 0.10000E+01 volume 0.22887E-02 ppm1 4.248 ppm2 0.852 CV 1
ASSI { 547}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 69 and name HG3 ))
2.700 0.900 0.900 peak 547 spectrum 1 weight 0.10000E+01 volume 0.33458E-02 ppm1 4.220 ppm2 2.482 CV 1
OR { 547}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 69 and name HG2 ))
ASSI { 548}
(( segid " " and resid 78 and name HA ))
(( segid " " and resid 78 and name HB2 ))
2.900 1.000 1.000 peak 548 spectrum 1 weight 0.10000E+01 volume 0.40721E-02 ppm1 4.243 ppm2 2.145 CV 1
ASSI { 549}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 66 and name HG2 ))
4.300 2.300 1.700 peak 549 spectrum 1 weight 0.10000E+01 volume 0.54501E-03 ppm1 4.230 ppm2 1.573 CV 1
OR { 549}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 66 and name HG3 ))
ASSI { 551}
(( segid " " and resid 78 and name HA ))
(( segid " " and resid 79 and name HA ))
3.200 1.300 1.300 peak 551 spectrum 1 weight 0.10000E+01 volume 0.28766E-02 ppm1 4.243 ppm2 4.103 CV 1
ASSI { 554}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 16 and name HB3 ))
4.000 2.000 2.000 peak 554 spectrum 1 weight 0.10000E+01 volume 0.86629E-03 ppm1 5.228 ppm2 1.687 CV 1
OR { 554}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 16 and name HD3 ))
OR { 554}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 16 and name HB2 ))
ASSI { 555}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 16 and name HG2 ))
3.500 1.500 1.500 peak 555 spectrum 1 weight 0.10000E+01 volume 0.71196E-03 ppm1 5.226 ppm2 1.364 CV 1
ASSI { 557}
(( segid " " and resid 70 and name HA ))
( segid " " and resid 71 and name HG2%)
3.900 1.900 1.900 peak 557 spectrum 1 weight 0.10000E+01 volume 0.76117E-03 ppm1 5.233 ppm2 0.390 CV 1
ASSI { 560}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 69 and name HA ))
4.600 2.600 1.400 peak 560 spectrum 1 weight 0.10000E+01 volume 0.34823E-03 ppm1 5.216 ppm2 4.225 CV 1
ASSI { 561}
(( segid " " and resid 70 and name HB3 ))
(( segid " " and resid 70 and name HG2 ))
2.700 0.900 0.900 peak 561 spectrum 1 weight 0.10000E+01 volume 0.25252E-02 ppm1 2.089 ppm2 2.432 CV 1
ASSI { 562}
(( segid " " and resid 70 and name HB2 ))
(( segid " " and resid 70 and name HG2 ))
3.000 1.200 1.200 peak 562 spectrum 1 weight 0.10000E+01 volume 0.28453E-02 ppm1 2.049 ppm2 2.426 CV 1
ASSI { 564}
(( segid " " and resid 70 and name HB2 ))
(( segid " " and resid 71 and name HB ))
4.300 2.300 1.700 peak 564 spectrum 1 weight 0.10000E+01 volume 0.63393E-03 ppm1 2.053 ppm2 1.418 CV 1
ASSI { 567}
(( segid " " and resid 70 and name HB2 ))
(( segid " " and resid 69 and name HA ))
5.300 3.500 0.700 peak 567 spectrum 1 weight 0.10000E+01 volume 0.52628E-03 ppm1 2.036 ppm2 4.239 CV 1
ASSI { 568}
(( segid " " and resid 70 and name HB3 ))
(( segid " " and resid 69 and name HA ))
4.800 2.800 1.200 peak 568 spectrum 1 weight 0.10000E+01 volume 0.46933E-03 ppm1 2.111 ppm2 4.224 CV 1
ASSI { 569}
(( segid " " and resid 70 and name HB3 ))
(( segid " " and resid 69 and name HA ))
4.800 2.900 1.200 peak 569 spectrum 1 weight 0.10000E+01 volume 0.52511E-03 ppm1 2.076 ppm2 4.222 CV 1
OR { 569}
(( segid " " and resid 70 and name HB2 ))
(( segid " " and resid 69 and name HA ))
ASSI { 571}
(( segid " " and resid 71 and name HB ))
(( segid " " and resid 71 and name HA ))
2.800 1.000 1.000 peak 571 spectrum 1 weight 0.10000E+01 volume 0.17819E-02 ppm1 1.429 ppm2 4.672 CV 1
ASSI { 573}
(( segid " " and resid 72 and name HB ))
(( segid " " and resid 72 and name HA ))
3.300 1.400 1.400 peak 573 spectrum 1 weight 0.10000E+01 volume 0.96026E-03 ppm1 1.908 ppm2 4.911 CV 1
ASSI { 574}
(( segid " " and resid 73 and name HB ))
(( segid " " and resid 73 and name HA ))
2.900 1.000 1.000 peak 574 spectrum 1 weight 0.10000E+01 volume 0.15439E-02 ppm1 1.947 ppm2 5.325 CV 1
ASSI { 575}
(( segid " " and resid 73 and name HB ))
(( segid " " and resid 87 and name HA ))
4.300 2.300 1.700 peak 575 spectrum 1 weight 0.10000E+01 volume 0.39036E-03 ppm1 1.951 ppm2 5.171 CV 1
ASSI { 576}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 88 and name HB ))
4.000 2.000 2.000 peak 576 spectrum 1 weight 0.10000E+01 volume 0.85822E-03 ppm1 5.329 ppm2 4.157 CV 1
ASSI { 580}
(( segid " " and resid 73 and name HA ))
( segid " " and resid 89 and name HG2%)
3.700 1.700 1.700 peak 580 spectrum 1 weight 0.10000E+01 volume 0.99010E-03 ppm1 5.326 ppm2 0.972 CV 1
ASSI { 582}
(( segid " " and resid 73 and name HA ))
( segid " " and resid 73 and name HG1%)
2.500 0.800 0.800 peak 582 spectrum 1 weight 0.10000E+01 volume 0.39987E-02 ppm1 5.329 ppm2 0.560 CV 1
ASSI { 584}
(( segid " " and resid 91 and name HB ))
( segid " " and resid 91 and name HG2%)
2.400 0.700 0.700 peak 584 spectrum 1 weight 0.10000E+01 volume 0.64272E-02 ppm1 1.925 ppm2 0.850 CV 1
ASSI { 585}
(( segid " " and resid 72 and name HB ))
(( segid " " and resid 72 and name HG13))
2.900 1.100 1.100 peak 585 spectrum 1 weight 0.10000E+01 volume 0.18927E-02 ppm1 1.910 ppm2 1.640 CV 1
ASSI { 586}
(( segid " " and resid 72 and name HB ))
(( segid " " and resid 72 and name HG12))
2.900 1.000 1.000 peak 586 spectrum 1 weight 0.10000E+01 volume 0.15106E-02 ppm1 1.910 ppm2 1.278 CV 1
ASSI { 588}
(( segid " " and resid 73 and name HB ))
(( segid " " and resid 87 and name HB2 ))
3.400 1.400 1.400 peak 588 spectrum 1 weight 0.10000E+01 volume 0.80579E-03 ppm1 1.947 ppm2 1.526 CV 1
ASSI { 591}
(( segid " " and resid 73 and name HB ))
( segid " " and resid 73 and name HG1%)
2.400 0.700 0.700 peak 591 spectrum 1 weight 0.10000E+01 volume 0.51891E-02 ppm1 1.949 ppm2 0.573 CV 1
OR { 591}
(( segid " " and resid 73 and name HB ))
( segid " " and resid 73 and name HG2%)
ASSI { 593}
(( segid " " and resid 71 and name HB ))
(( segid " " and resid 73 and name HB ))
4.300 2.300 1.700 peak 593 spectrum 1 weight 0.10000E+01 volume 0.66477E-03 ppm1 1.424 ppm2 1.956 CV 1
ASSI { 594}
(( segid " " and resid 71 and name HB ))
(( segid " " and resid 70 and name HG3 ))
3.500 3.500 2.500 peak 594 spectrum 1 weight 0.10000E+01 volume 0.13094E-02 ppm1 1.429 ppm2 2.143 CV 1
ASSI { 597}
(( segid " " and resid 71 and name HB ))
( segid " " and resid 91 and name HD1%)
3.800 1.800 1.800 peak 597 spectrum 1 weight 0.10000E+01 volume 0.56146E-03 ppm1 1.443 ppm2 0.708 CV 1
ASSI { 599}
(( segid " " and resid 71 and name HB ))
( segid " " and resid 71 and name HG1%)
2.600 0.800 0.800 peak 599 spectrum 1 weight 0.10000E+01 volume 0.35813E-02 ppm1 1.430 ppm2 0.346 CV 1
ASSI { 603}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 28 and name HB2 ))
2.700 0.900 0.900 peak 603 spectrum 1 weight 0.10000E+01 volume 0.93897E-03 ppm1 1.878 ppm2 2.935 CV 1
ASSI { 605}
(( segid " " and resid 74 and name HB3 ))
(( segid " " and resid 74 and name HG3 ))
2.800 0.900 0.900 peak 605 spectrum 1 weight 0.10000E+01 volume 0.30261E-02 ppm1 1.950 ppm2 2.316 CV 1
OR { 605}
(( segid " " and resid 74 and name HB2 ))
(( segid " " and resid 74 and name HG3 ))
ASSI { 606}
(( segid " " and resid 74 and name HB2 ))
(( segid " " and resid 74 and name HG2 ))
2.600 0.800 0.800 peak 606 spectrum 1 weight 0.10000E+01 volume 0.39346E-02 ppm1 1.944 ppm2 2.194 CV 1
OR { 606}
(( segid " " and resid 74 and name HB3 ))
(( segid " " and resid 74 and name HG2 ))
ASSI { 608}
(( segid " " and resid 83 and name HB2 ))
(( segid " " and resid 83 and name HB3 ))
1.600 0.300 0.600 peak 608 spectrum 1 weight 0.10000E+01 volume 0.29743E-01 ppm1 1.976 ppm2 1.912 CV 1
ASSI { 609}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 19 and name HG2 ))
2.800 1.000 1.000 peak 609 spectrum 1 weight 0.10000E+01 volume 0.46566E-02 ppm1 2.000 ppm2 1.675 CV 1
ASSI { 610}
(( segid " " and resid 74 and name HB3 ))
( segid " " and resid 88 and name HG2%)
4.200 2.200 1.800 peak 610 spectrum 1 weight 0.10000E+01 volume 0.91420E-03 ppm1 1.943 ppm2 1.152 CV 1
OR { 610}
(( segid " " and resid 74 and name HB2 ))
( segid " " and resid 88 and name HG2%)
ASSI { 612}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 19 and name HA ))
2.900 1.000 1.000 peak 612 spectrum 1 weight 0.10000E+01 volume 0.28841E-02 ppm1 1.878 ppm2 4.755 CV 1
ASSI { 615}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 20 and name HN ))
4.100 2.100 1.900 peak 615 spectrum 1 weight 0.10000E+01 volume 0.67580E-03 ppm1 1.885 ppm2 9.369 CV 1
ASSI { 618}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 19 and name HN ))
3.500 1.600 1.600 peak 618 spectrum 1 weight 0.10000E+01 volume 0.10004E-02 ppm1 2.001 ppm2 7.397 CV 1
OR { 618}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 19 and name HE ))
ASSI { 619}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 19 and name HN ))
3.200 1.300 1.300 peak 619 spectrum 1 weight 0.10000E+01 volume 0.93398E-03 ppm1 1.883 ppm2 7.398 CV 1
OR { 619}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 19 and name HE ))
ASSI { 620}
(( segid " " and resid 19 and name HB2 ))
( segid " " and resid 28 and name HD% )
4.800 2.800 1.200 peak 620 spectrum 1 weight 0.10000E+01 volume 0.57629E-03 ppm1 1.997 ppm2 7.125 CV 1
ASSI { 626}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 75 and name HG12))
3.300 1.300 1.300 peak 626 spectrum 1 weight 0.10000E+01 volume 0.11552E-02 ppm1 3.948 ppm2 0.970 CV 1
ASSI { 628}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 38 and name HA ))
3.000 1.100 1.100 peak 628 spectrum 1 weight 0.10000E+01 volume 0.13718E-02 ppm1 2.805 ppm2 4.619 CV 1
ASSI { 630}
(( segid " " and resid 75 and name HB ))
(( segid " " and resid 75 and name HA ))
3.500 1.500 1.500 peak 630 spectrum 1 weight 0.10000E+01 volume 0.62477E-03 ppm1 1.950 ppm2 3.943 CV 1
ASSI { 631}
(( segid " " and resid 75 and name HB ))
(( segid " " and resid 75 and name HG13))
3.000 1.100 1.100 peak 631 spectrum 1 weight 0.10000E+01 volume 0.17416E-02 ppm1 1.940 ppm2 1.527 CV 1
ASSI { 633}
(( segid " " and resid 75 and name HB ))
(( segid " " and resid 75 and name HG12))
2.900 1.000 1.000 peak 633 spectrum 1 weight 0.10000E+01 volume 0.15939E-02 ppm1 1.947 ppm2 0.981 CV 1
ASSI { 634}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 76 and name HA ))
2.800 1.000 1.000 peak 634 spectrum 1 weight 0.10000E+01 volume 0.25350E-02 ppm1 2.307 ppm2 4.821 CV 1
ASSI { 636}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 76 and name HB3 ))
2.000 0.500 0.500 peak 636 spectrum 1 weight 0.10000E+01 volume 0.81414E-02 ppm1 2.307 ppm2 2.552 CV 1
ASSI { 639}
(( segid " " and resid 76 and name HB2 ))
( segid " " and resid 88 and name HG2%)
3.300 1.400 1.400 peak 639 spectrum 1 weight 0.10000E+01 volume 0.98599E-03 ppm1 2.307 ppm2 1.155 CV 1
ASSI { 641}
(( segid " " and resid 76 and name HB3 ))
(( segid " " and resid 76 and name HA ))
3.300 1.400 1.400 peak 641 spectrum 1 weight 0.10000E+01 volume 0.17867E-02 ppm1 2.549 ppm2 4.819 CV 1
ASSI { 645}
(( segid " " and resid 76 and name HB3 ))
(( segid " " and resid 74 and name HG2 ))
4.500 2.500 1.500 peak 645 spectrum 1 weight 0.10000E+01 volume 0.46526E-03 ppm1 2.542 ppm2 2.188 CV 1
ASSI { 651}
(( segid " " and resid 77 and name HB3 ))
(( segid " " and resid 77 and name HA ))
2.800 1.000 1.000 peak 651 spectrum 1 weight 0.10000E+01 volume 0.20511E-02 ppm1 1.910 ppm2 4.547 CV 1
ASSI { 652}
(( segid " " and resid 77 and name HB2 ))
(( segid " " and resid 77 and name HA ))
3.300 1.300 1.300 peak 652 spectrum 1 weight 0.10000E+01 volume 0.14826E-02 ppm1 1.829 ppm2 4.530 CV 1
ASSI { 656}
(( segid " " and resid 77 and name HB3 ))
(( segid " " and resid 78 and name HB3 ))
3.700 1.700 1.700 peak 656 spectrum 1 weight 0.10000E+01 volume 0.16192E-02 ppm1 1.922 ppm2 2.030 CV 1
ASSI { 658}
(( segid " " and resid 77 and name HB3 ))
(( segid " " and resid 77 and name HB2 ))
1.700 0.300 0.500 peak 658 spectrum 1 weight 0.10000E+01 volume 0.18328E-01 ppm1 1.919 ppm2 1.848 CV 1
ASSI { 660}
(( segid " " and resid 77 and name HB3 ))
(( segid " " and resid 77 and name HG3 ))
2.500 0.800 0.800 peak 660 spectrum 1 weight 0.10000E+01 volume 0.42248E-02 ppm1 1.920 ppm2 1.485 CV 1
OR { 660}
(( segid " " and resid 77 and name HB3 ))
(( segid " " and resid 77 and name HG2 ))
ASSI { 661}
(( segid " " and resid 77 and name HB2 ))
(( segid " " and resid 77 and name HG2 ))
2.700 0.900 0.900 peak 661 spectrum 1 weight 0.10000E+01 volume 0.35747E-02 ppm1 1.835 ppm2 1.483 CV 1
OR { 661}
(( segid " " and resid 77 and name HB2 ))
(( segid " " and resid 77 and name HG3 ))
ASSI { 662}
(( segid " " and resid 77 and name HB3 ))
(( segid " " and resid 78 and name HN ))
3.300 1.400 1.400 peak 662 spectrum 1 weight 0.10000E+01 volume 0.93528E-03 ppm1 1.929 ppm2 8.635 CV 1
ASSI { 664}
(( segid " " and resid 77 and name HB3 ))
(( segid " " and resid 77 and name HN ))
3.800 1.800 1.800 peak 664 spectrum 1 weight 0.10000E+01 volume 0.10009E-02 ppm1 1.917 ppm2 7.833 CV 1
ASSI { 665}
(( segid " " and resid 77 and name HB2 ))
(( segid " " and resid 77 and name HN ))
3.200 1.300 1.300 peak 665 spectrum 1 weight 0.10000E+01 volume 0.78752E-03 ppm1 1.835 ppm2 7.835 CV 1
ASSI { 669}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 80 and name HB3 ))
4.500 2.500 1.500 peak 669 spectrum 1 weight 0.10000E+01 volume 0.42826E-03 ppm1 4.106 ppm2 1.799 CV 1
ASSI { 671}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 80 and name HA ))
4.100 2.100 1.900 peak 671 spectrum 1 weight 0.10000E+01 volume 0.94719E-03 ppm1 4.111 ppm2 4.563 CV 1
ASSI { 673}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 85 and name HA ))
2.900 2.900 3.100 peak 673 spectrum 1 weight 0.10000E+01 volume 0.28305E-02 ppm1 4.114 ppm2 4.276 CV 1
ASSI { 674}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 81 and name HA1 ))
4.100 2.100 1.900 peak 674 spectrum 1 weight 0.10000E+01 volume 0.96286E-03 ppm1 4.109 ppm2 4.004 CV 1
ASSI { 675}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 84 and name HA2 ))
3.700 3.700 2.300 peak 675 spectrum 1 weight 0.10000E+01 volume 0.65324E-03 ppm1 4.102 ppm2 3.923 CV 1
ASSI { 676}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 79 and name HG2 ))
2.900 1.000 1.000 peak 676 spectrum 1 weight 0.10000E+01 volume 0.24825E-02 ppm1 4.111 ppm2 2.343 CV 1
OR { 676}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 79 and name HG3 ))
ASSI { 677}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 79 and name HB2 ))
2.700 0.900 0.900 peak 677 spectrum 1 weight 0.10000E+01 volume 0.31074E-02 ppm1 4.113 ppm2 2.040 CV 1
ASSI { 678}
(( segid " " and resid 79 and name HB3 ))
( segid " " and resid 85 and name HB% )
3.900 1.900 1.900 peak 678 spectrum 1 weight 0.10000E+01 volume 0.79210E-03 ppm1 2.075 ppm2 1.476 CV 1
ASSI { 679}
(( segid " " and resid 79 and name HB3 ))
(( segid " " and resid 79 and name HA ))
3.100 1.200 1.200 peak 679 spectrum 1 weight 0.10000E+01 volume 0.14846E-02 ppm1 2.066 ppm2 4.107 CV 1
ASSI { 681}
(( segid " " and resid 79 and name HB3 ))
(( segid " " and resid 79 and name HN ))
3.300 1.400 1.400 peak 681 spectrum 1 weight 0.10000E+01 volume 0.18001E-02 ppm1 2.064 ppm2 8.671 CV 1
ASSI { 687}
(( segid " " and resid 80 and name HB2 ))
(( segid " " and resid 80 and name HA ))
3.000 1.200 1.200 peak 687 spectrum 1 weight 0.10000E+01 volume 0.18216E-02 ppm1 1.895 ppm2 4.541 CV 1
ASSI { 688}
(( segid " " and resid 80 and name HB3 ))
(( segid " " and resid 80 and name HA ))
3.000 1.200 1.200 peak 688 spectrum 1 weight 0.10000E+01 volume 0.14603E-02 ppm1 1.789 ppm2 4.543 CV 1
ASSI { 689}
(( segid " " and resid 80 and name HB2 ))
(( segid " " and resid 80 and name HD2 ))
3.400 1.400 1.400 peak 689 spectrum 1 weight 0.10000E+01 volume 0.12864E-02 ppm1 1.883 ppm2 3.250 CV 1
OR { 689}
(( segid " " and resid 80 and name HB2 ))
(( segid " " and resid 80 and name HD3 ))
ASSI { 690}
(( segid " " and resid 80 and name HB3 ))
(( segid " " and resid 80 and name HD2 ))
3.200 1.300 1.300 peak 690 spectrum 1 weight 0.10000E+01 volume 0.13045E-02 ppm1 1.797 ppm2 3.235 CV 1
OR { 690}
(( segid " " and resid 80 and name HB3 ))
(( segid " " and resid 80 and name HD3 ))
ASSI { 691}
(( segid " " and resid 80 and name HB2 ))
(( segid " " and resid 80 and name HG2 ))
2.300 0.600 0.600 peak 691 spectrum 1 weight 0.10000E+01 volume 0.13223E-01 ppm1 1.893 ppm2 1.683 CV 1
ASSI { 693}
(( segid " " and resid 81 and name HA2 ))
(( segid " " and resid 81 and name HA1 ))
1.800 0.400 0.400 peak 693 spectrum 1 weight 0.10000E+01 volume 0.14788E-01 ppm1 3.862 ppm2 3.985 CV 1
ASSI { 699}
(( segid " " and resid 82 and name HB3 ))
(( segid " " and resid 82 and name HA ))
2.700 0.900 0.900 peak 699 spectrum 1 weight 0.10000E+01 volume 0.40249E-02 ppm1 2.864 ppm2 4.698 CV 1
OR { 699}
(( segid " " and resid 82 and name HB2 ))
(( segid " " and resid 82 and name HA ))
ASSI { 701}
(( segid " " and resid 84 and name HA1 ))
(( segid " " and resid 85 and name HA ))
3.700 1.800 1.800 peak 701 spectrum 1 weight 0.10000E+01 volume 0.80819E-03 ppm1 4.303 ppm2 4.257 CV 1
ASSI { 702}
(( segid " " and resid 84 and name HA1 ))
(( segid " " and resid 79 and name HA ))
3.300 3.300 2.700 peak 702 spectrum 1 weight 0.10000E+01 volume 0.11175E-02 ppm1 4.331 ppm2 4.087 CV 1
ASSI { 703}
(( segid " " and resid 84 and name HA1 ))
(( segid " " and resid 84 and name HA2 ))
1.900 0.500 0.500 peak 703 spectrum 1 weight 0.10000E+01 volume 0.96991E-02 ppm1 4.333 ppm2 3.955 CV 1
ASSI { 705}
( segid " " and resid 85 and name HB% )
(( segid " " and resid 33 and name HA ))
2.800 2.800 3.200 peak 705 spectrum 1 weight 0.10000E+01 volume 0.12349E-02 ppm1 1.464 ppm2 4.470 CV 1
ASSI { 706}
( segid " " and resid 85 and name HB% )
(( segid " " and resid 85 and name HA ))
2.300 0.700 0.700 peak 706 spectrum 1 weight 0.10000E+01 volume 0.75412E-02 ppm1 1.471 ppm2 4.265 CV 1
ASSI { 707}
( segid " " and resid 85 and name HB% )
(( segid " " and resid 79 and name HA ))
3.100 3.100 2.900 peak 707 spectrum 1 weight 0.10000E+01 volume 0.63454E-03 ppm1 1.471 ppm2 4.115 CV 1
ASSI { 710}
( segid " " and resid 86 and name HB% )
(( segid " " and resid 86 and name HA ))
2.400 0.700 0.700 peak 710 spectrum 1 weight 0.10000E+01 volume 0.56802E-02 ppm1 1.661 ppm2 4.955 CV 1
ASSI { 712}
( segid " " and resid 86 and name HB% )
(( segid " " and resid 84 and name HA1 ))
2.800 2.800 3.200 peak 712 spectrum 1 weight 0.10000E+01 volume 0.10932E-02 ppm1 1.665 ppm2 4.344 CV 1
ASSI { 713}
( segid " " and resid 86 and name HB% )
(( segid " " and resid 85 and name HA ))
3.700 1.800 1.800 peak 713 spectrum 1 weight 0.10000E+01 volume 0.13230E-02 ppm1 1.660 ppm2 4.266 CV 1
ASSI { 715}
( segid " " and resid 86 and name HB% )
(( segid " " and resid 38 and name HB2 ))
3.300 1.400 1.400 peak 715 spectrum 1 weight 0.10000E+01 volume 0.42545E-03 ppm1 1.665 ppm2 2.804 CV 1
ASSI { 716}
( segid " " and resid 86 and name HB% )
(( segid " " and resid 76 and name HB3 ))
3.100 1.200 1.200 peak 716 spectrum 1 weight 0.10000E+01 volume 0.17489E-02 ppm1 1.661 ppm2 2.551 CV 1
ASSI { 717}
( segid " " and resid 86 and name HB% )
(( segid " " and resid 76 and name HB2 ))
3.700 1.700 1.700 peak 717 spectrum 1 weight 0.10000E+01 volume 0.12111E-02 ppm1 1.662 ppm2 2.322 CV 1
ASSI { 718}
( segid " " and resid 86 and name HB% )
(( segid " " and resid 77 and name HB3 ))
3.200 1.300 1.300 peak 718 spectrum 1 weight 0.10000E+01 volume 0.34499E-02 ppm1 1.663 ppm2 1.905 CV 1
ASSI { 719}
( segid " " and resid 86 and name HB% )
(( segid " " and resid 77 and name HB2 ))
2.400 0.700 0.700 peak 719 spectrum 1 weight 0.10000E+01 volume 0.54063E-02 ppm1 1.663 ppm2 1.828 CV 1
ASSI { 721}
( segid " " and resid 86 and name HB% )
(( segid " " and resid 39 and name HG ))
4.000 2.000 2.000 peak 721 spectrum 1 weight 0.10000E+01 volume 0.48501E-03 ppm1 1.662 ppm2 1.208 CV 1
ASSI { 725}
( segid " " and resid 85 and name HB% )
(( segid " " and resid 75 and name HG12))
3.400 1.400 1.400 peak 725 spectrum 1 weight 0.10000E+01 volume 0.19439E-02 ppm1 1.470 ppm2 0.983 CV 1
ASSI { 726}
( segid " " and resid 85 and name HB% )
( segid " " and resid 75 and name HG2%)
2.600 0.800 0.800 peak 726 spectrum 1 weight 0.10000E+01 volume 0.52680E-02 ppm1 1.472 ppm2 0.839 CV 1
ASSI { 744}
( segid " " and resid 86 and name HB% )
( segid " " and resid 38 and name HD% )
3.000 3.000 3.000 peak 744 spectrum 1 weight 0.10000E+01 volume 0.81346E-03 ppm1 1.662 ppm2 6.862 CV 1
ASSI { 751}
(( segid " " and resid 84 and name HA2 ))
(( segid " " and resid 79 and name HG2 ))
3.700 1.700 1.700 peak 751 spectrum 1 weight 0.10000E+01 volume 0.79785E-03 ppm1 3.944 ppm2 2.349 CV 1
OR { 751}
(( segid " " and resid 84 and name HA2 ))
(( segid " " and resid 79 and name HG3 ))
ASSI { 752}
(( segid " " and resid 84 and name HA2 ))
(( segid " " and resid 35 and name HB2 ))
3.300 1.400 1.400 peak 752 spectrum 1 weight 0.10000E+01 volume 0.71840E-03 ppm1 3.924 ppm2 1.607 CV 1
ASSI { 753}
(( segid " " and resid 84 and name HA2 ))
( segid " " and resid 85 and name HB% )
4.400 2.400 1.600 peak 753 spectrum 1 weight 0.10000E+01 volume 0.54484E-03 ppm1 3.943 ppm2 1.476 CV 1
ASSI { 754}
(( segid " " and resid 84 and name HA1 ))
(( segid " " and resid 79 and name HG2 ))
3.700 1.700 1.700 peak 754 spectrum 1 weight 0.10000E+01 volume 0.58608E-03 ppm1 4.342 ppm2 2.347 CV 1
OR { 754}
(( segid " " and resid 84 and name HA1 ))
(( segid " " and resid 79 and name HG3 ))
ASSI { 755}
(( segid " " and resid 84 and name HA1 ))
(( segid " " and resid 35 and name HG2 ))
3.200 3.200 2.800 peak 755 spectrum 1 weight 0.10000E+01 volume 0.56812E-03 ppm1 4.343 ppm2 1.586 CV 1
ASSI { 756}
(( segid " " and resid 84 and name HA1 ))
( segid " " and resid 85 and name HB% )
4.300 2.300 1.700 peak 756 spectrum 1 weight 0.10000E+01 volume 0.51202E-03 ppm1 4.332 ppm2 1.470 CV 1
ASSI { 761}
(( segid " " and resid 90 and name HB3 ))
(( segid " " and resid 90 and name HA ))
3.400 1.400 1.400 peak 761 spectrum 1 weight 0.10000E+01 volume 0.10075E-02 ppm1 3.067 ppm2 4.696 CV 1
OR { 761}
(( segid " " and resid 90 and name HB2 ))
(( segid " " and resid 90 and name HA ))
ASSI { 764}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 92 and name HB2 ))
4.100 2.100 1.900 peak 764 spectrum 1 weight 0.10000E+01 volume 0.88381E-03 ppm1 4.087 ppm2 3.911 CV 1
OR { 764}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 92 and name HB3 ))
ASSI { 765}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 91 and name HB ))
3.000 1.200 1.200 peak 765 spectrum 1 weight 0.10000E+01 volume 0.19141E-02 ppm1 4.093 ppm2 1.922 CV 1
ASSI { 767}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 91 and name HG12))
4.500 2.500 1.500 peak 767 spectrum 1 weight 0.10000E+01 volume 0.30588E-03 ppm1 4.099 ppm2 1.332 CV 1
ASSI { 768}
(( segid " " and resid 91 and name HA ))
( segid " " and resid 91 and name HG2%)
2.600 0.900 0.900 peak 768 spectrum 1 weight 0.10000E+01 volume 0.38336E-02 ppm1 4.091 ppm2 0.855 CV 1
ASSI { 772}
(( segid " " and resid 91 and name HB ))
(( segid " " and resid 91 and name HG12))
3.000 1.100 1.100 peak 772 spectrum 1 weight 0.10000E+01 volume 0.16290E-02 ppm1 1.913 ppm2 1.352 CV 1
ASSI { 778}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 87 and name HB3 ))
2.400 0.700 0.700 peak 778 spectrum 1 weight 0.10000E+01 volume 0.16377E-02 ppm1 1.504 ppm2 1.108 CV 1
ASSI { 780}
(( segid " " and resid 87 and name HB2 ))
( segid " " and resid 87 and name HD2%)
3.800 1.800 1.800 peak 780 spectrum 1 weight 0.10000E+01 volume 0.72811E-03 ppm1 1.504 ppm2 0.194 CV 1
ASSI { 781}
(( segid " " and resid 87 and name HB3 ))
(( segid " " and resid 73 and name HB ))
3.200 1.300 1.300 peak 781 spectrum 1 weight 0.10000E+01 volume 0.52239E-03 ppm1 1.102 ppm2 1.948 CV 1
ASSI { 786}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 87 and name HA ))
3.800 1.800 1.800 peak 786 spectrum 1 weight 0.10000E+01 volume 0.54861E-03 ppm1 1.506 ppm2 5.163 CV 1
ASSI { 796}
(( segid " " and resid 96 and name HB2 ))
(( segid " " and resid 96 and name HA ))
2.600 0.800 0.800 peak 796 spectrum 1 weight 0.10000E+01 volume 0.56173E-02 ppm1 3.906 ppm2 4.331 CV 1
OR { 796}
(( segid " " and resid 96 and name HB3 ))
(( segid " " and resid 96 and name HA ))
ASSI { 797}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 35 and name HA ))
4.200 2.200 1.800 peak 797 spectrum 1 weight 0.10000E+01 volume 0.48925E-03 ppm1 2.034 ppm2 4.532 CV 1
OR { 797}
(( segid " " and resid 34 and name HB3 ))
(( segid " " and resid 35 and name HA ))
ASSI { 801}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 7 and name HG3 ))
2.100 0.600 0.600 peak 801 spectrum 1 weight 0.10000E+01 volume 0.16446E-01 ppm1 2.031 ppm2 2.398 CV 1
OR { 801}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 7 and name HG2 ))
ASSI { 802}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 7 and name HB2 ))
1.400 0.200 0.800 peak 802 spectrum 1 weight 0.10000E+01 volume 0.67760E-01 ppm1 2.031 ppm2 2.141 CV 1
ASSI { 803}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 35 and name HG2 ))
3.100 1.200 1.200 peak 803 spectrum 1 weight 0.10000E+01 volume 0.15958E-02 ppm1 2.033 ppm2 1.585 CV 1
OR { 803}
(( segid " " and resid 34 and name HB3 ))
(( segid " " and resid 35 and name HG2 ))
ASSI { 808}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HG2 ))
2.100 0.500 0.500 peak 808 spectrum 1 weight 0.10000E+01 volume 0.16487E-01 ppm1 2.143 ppm2 2.399 CV 1
OR { 808}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HG3 ))
ASSI { 810}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HG3 ))
2.700 0.900 0.900 peak 810 spectrum 1 weight 0.10000E+01 volume 0.39182E-02 ppm1 4.359 ppm2 2.406 CV 1
OR { 810}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HG2 ))
ASSI { 811}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HB2 ))
2.500 0.800 0.800 peak 811 spectrum 1 weight 0.10000E+01 volume 0.59599E-02 ppm1 4.359 ppm2 2.148 CV 1
ASSI { 812}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HB3 ))
2.700 0.900 0.900 peak 812 spectrum 1 weight 0.10000E+01 volume 0.36989E-02 ppm1 4.359 ppm2 2.032 CV 1
ASSI { 813}
(( segid " " and resid 5 and name HA ))
( segid " " and resid 5 and name HD2%)
2.400 0.700 0.700 peak 813 spectrum 1 weight 0.10000E+01 volume 0.61400E-02 ppm1 4.365 ppm2 0.929 CV 1
ASSI { 815}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HB2 ))
2.400 0.700 0.700 peak 815 spectrum 1 weight 0.10000E+01 volume 0.63729E-02 ppm1 4.365 ppm2 1.662 CV 1
OR { 815}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HB3 ))
ASSI { 821}
(( segid " " and resid 6 and name HA ))
( segid " " and resid 12 and name HD1%)
3.000 3.000 3.000 peak 821 spectrum 1 weight 0.10000E+01 volume 0.76576E-03 ppm1 4.306 ppm2 0.810 CV 1
ASSI { 822}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HB2 ))
2.400 0.700 0.700 peak 822 spectrum 1 weight 0.10000E+01 volume 0.65862E-02 ppm1 4.292 ppm2 2.071 CV 1
ASSI { 823}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 5 and name HB2 ))
3.400 1.400 1.400 peak 823 spectrum 1 weight 0.10000E+01 volume 0.14499E-02 ppm1 4.301 ppm2 1.682 CV 1
OR { 823}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 5 and name HB3 ))
ASSI { 827}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 11 and name HA ))
3.400 3.400 2.600 peak 827 spectrum 1 weight 0.10000E+01 volume 0.11477E-02 ppm1 4.299 ppm2 4.642 CV 1
ASSI { 830}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 3 and name HA ))
2.200 2.200 3.800 peak 830 spectrum 1 weight 0.10000E+01 volume 0.57239E-02 ppm1 4.306 ppm2 4.184 CV 1
ASSI { 837}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 83 and name HG3 ))
2.900 1.000 1.000 peak 837 spectrum 1 weight 0.10000E+01 volume 0.28900E-02 ppm1 4.433 ppm2 1.494 CV 1
OR { 837}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 83 and name HG2 ))
ASSI { 839}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name HE3 ))
4.100 2.100 1.900 peak 839 spectrum 1 weight 0.10000E+01 volume 0.67239E-03 ppm1 1.882 ppm2 3.054 CV 1
OR { 839}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name HE2 ))
ASSI { 840}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 9 and name HE3 ))
4.000 2.000 2.000 peak 840 spectrum 1 weight 0.10000E+01 volume 0.69937E-03 ppm1 1.806 ppm2 3.054 CV 1
OR { 840}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 9 and name HE2 ))
ASSI { 842}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name HA ))
2.400 0.700 0.700 peak 842 spectrum 1 weight 0.10000E+01 volume 0.60599E-02 ppm1 1.877 ppm2 4.342 CV 1
ASSI { 843}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 9 and name HA ))
2.500 0.800 0.800 peak 843 spectrum 1 weight 0.10000E+01 volume 0.57880E-02 ppm1 1.809 ppm2 4.335 CV 1
ASSI { 844}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 42 and name HN ))
3.300 1.400 1.400 peak 844 spectrum 1 weight 0.10000E+01 volume 0.10021E-02 ppm1 1.998 ppm2 8.750 CV 1
ASSI { 845}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 41 and name HN ))
3.800 1.900 1.900 peak 845 spectrum 1 weight 0.10000E+01 volume 0.66167E-03 ppm1 1.988 ppm2 8.478 CV 1
ASSI { 846}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name HN ))
3.100 1.200 1.200 peak 846 spectrum 1 weight 0.10000E+01 volume 0.20744E-02 ppm1 1.884 ppm2 8.329 CV 1
ASSI { 854}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 17 and name HN ))
3.500 1.500 1.500 peak 854 spectrum 1 weight 0.10000E+01 volume 0.13857E-02 ppm1 4.224 ppm2 8.801 CV 1
ASSI { 855}
( segid " " and resid 10 and name HB% )
(( segid " " and resid 11 and name HA ))
3.600 1.700 1.700 peak 855 spectrum 1 weight 0.10000E+01 volume 0.14693E-02 ppm1 1.410 ppm2 4.655 CV 1
ASSI { 866}
(( segid " " and resid 11 and name HB2 ))
( segid " " and resid 12 and name HG2%)
4.400 2.400 1.600 peak 866 spectrum 1 weight 0.10000E+01 volume 0.45109E-03 ppm1 2.713 ppm2 0.804 CV 1
OR { 866}
(( segid " " and resid 11 and name HB2 ))
( segid " " and resid 12 and name HD1%)
ASSI { 872}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HB3 ))
1.800 0.400 0.400 peak 872 spectrum 1 weight 0.10000E+01 volume 0.16794E-01 ppm1 2.710 ppm2 2.838 CV 1
ASSI { 874}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 11 and name HA ))
2.700 0.900 0.900 peak 874 spectrum 1 weight 0.10000E+01 volume 0.33117E-02 ppm1 2.823 ppm2 4.649 CV 1
ASSI { 875}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HA ))
3.000 1.200 1.200 peak 875 spectrum 1 weight 0.10000E+01 volume 0.22265E-02 ppm1 2.702 ppm2 4.638 CV 1
ASSI { 876}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 10 and name HA ))
5.200 3.400 0.800 peak 876 spectrum 1 weight 0.10000E+01 volume 0.36736E-03 ppm1 2.844 ppm2 4.359 CV 1
ASSI { 880}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HD21))
3.300 1.300 1.300 peak 880 spectrum 1 weight 0.10000E+01 volume 0.81599E-03 ppm1 2.707 ppm2 7.499 CV 1
ASSI { 883}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HD22))
4.500 2.500 1.500 peak 883 spectrum 1 weight 0.10000E+01 volume 0.53235E-03 ppm1 2.703 ppm2 7.053 CV 1
ASSI { 884}
(( segid " " and resid 11 and name HB2 ))
( segid " " and resid 13 and name HE% )
3.600 1.700 1.700 peak 884 spectrum 1 weight 0.10000E+01 volume 0.62727E-03 ppm1 2.704 ppm2 6.885 CV 1
ASSI { 887}
(( segid " " and resid 66 and name HD2 ))
(( segid " " and resid 48 and name HA ))
4.000 2.000 2.000 peak 887 spectrum 1 weight 0.10000E+01 volume 0.50911E-03 ppm1 3.237 ppm2 4.382 CV 1
OR { 887}
(( segid " " and resid 66 and name HD3 ))
(( segid " " and resid 48 and name HA ))
ASSI { 892}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 31 and name HB3 ))
4.200 2.200 1.800 peak 892 spectrum 1 weight 0.10000E+01 volume 0.46585E-03 ppm1 2.436 ppm2 2.185 CV 1
ASSI { 893}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 31 and name HB2 ))
3.900 1.900 1.900 peak 893 spectrum 1 weight 0.10000E+01 volume 0.77103E-03 ppm1 2.435 ppm2 3.121 CV 1
ASSI { 896}
(( segid " " and resid 13 and name HB3 ))
(( segid " " and resid 31 and name HB3 ))
3.700 1.700 1.700 peak 896 spectrum 1 weight 0.10000E+01 volume 0.49026E-03 ppm1 3.300 ppm2 2.186 CV 1
ASSI { 897}
(( segid " " and resid 66 and name HD2 ))
(( segid " " and resid 66 and name HG2 ))
2.100 0.600 0.600 peak 897 spectrum 1 weight 0.10000E+01 volume 0.10504E-01 ppm1 3.224 ppm2 1.601 CV 1
OR { 897}
(( segid " " and resid 66 and name HD3 ))
(( segid " " and resid 66 and name HG2 ))
OR { 897}
(( segid " " and resid 66 and name HD2 ))
(( segid " " and resid 66 and name HG3 ))
OR { 897}
(( segid " " and resid 66 and name HD3 ))
(( segid " " and resid 66 and name HG3 ))
ASSI { 899}
(( segid " " and resid 19 and name HD2 ))
(( segid " " and resid 19 and name HB2 ))
2.800 1.000 1.000 peak 899 spectrum 1 weight 0.10000E+01 volume 0.23716E-02 ppm1 3.245 ppm2 2.008 CV 1
ASSI { 902}
(( segid " " and resid 19 and name HD2 ))
(( segid " " and resid 19 and name HD3 ))
1.400 0.200 0.800 peak 902 spectrum 1 weight 0.10000E+01 volume 0.38487E-01 ppm1 3.243 ppm2 3.076 CV 1
ASSI { 903}
(( segid " " and resid 80 and name HD3 ))
(( segid " " and resid 80 and name HG2 ))
2.000 0.500 0.500 peak 903 spectrum 1 weight 0.10000E+01 volume 0.15193E-01 ppm1 3.263 ppm2 1.700 CV 1
OR { 903}
(( segid " " and resid 80 and name HD2 ))
(( segid " " and resid 80 and name HG2 ))
ASSI { 904}
( segid " " and resid 73 and name HG2%)
( segid " " and resid 88 and name HG2%)
4.100 2.100 1.900 peak 904 spectrum 1 weight 0.10000E+01 volume 0.74618E-03 ppm1 0.588 ppm2 1.160 CV 1
ASSI { 905}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 87 and name HB3 ))
3.200 1.200 1.200 peak 905 spectrum 1 weight 0.10000E+01 volume 0.11945E-02 ppm1 0.588 ppm2 1.086 CV 1
ASSI { 907}
( segid " " and resid 73 and name HG2%)
( segid " " and resid 71 and name HG2%)
2.700 0.900 0.900 peak 907 spectrum 1 weight 0.10000E+01 volume 0.27275E-02 ppm1 0.589 ppm2 0.405 CV 1
ASSI { 908}
( segid " " and resid 73 and name HG2%)
( segid " " and resid 87 and name HD2%)
2.700 0.900 0.900 peak 908 spectrum 1 weight 0.10000E+01 volume 0.29211E-02 ppm1 0.589 ppm2 0.195 CV 1
ASSI { 911}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 73 and name HB ))
2.400 0.700 0.700 peak 911 spectrum 1 weight 0.10000E+01 volume 0.47045E-02 ppm1 0.586 ppm2 1.946 CV 1
ASSI { 913}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 87 and name HB2 ))
3.600 1.600 1.600 peak 913 spectrum 1 weight 0.10000E+01 volume 0.10052E-02 ppm1 0.592 ppm2 1.491 CV 1
OR { 913}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 87 and name HG ))
ASSI { 914}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 74 and name HG3 ))
4.300 2.300 1.700 peak 914 spectrum 1 weight 0.10000E+01 volume 0.56651E-03 ppm1 0.592 ppm2 2.292 CV 1
ASSI { 916}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 13 and name HN ))
3.100 1.200 1.200 peak 916 spectrum 1 weight 0.10000E+01 volume 0.17136E-02 ppm1 0.588 ppm2 9.203 CV 1
ASSI { 918}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 87 and name HN ))
5.200 3.300 0.800 peak 918 spectrum 1 weight 0.10000E+01 volume 0.28127E-03 ppm1 0.579 ppm2 8.948 CV 1
ASSI { 919}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 74 and name HN ))
3.600 1.600 1.600 peak 919 spectrum 1 weight 0.10000E+01 volume 0.13020E-02 ppm1 0.589 ppm2 8.651 CV 1
ASSI { 920}
( segid " " and resid 73 and name HG2%)
( segid " " and resid 13 and name HD% )
3.000 3.000 3.000 peak 920 spectrum 1 weight 0.10000E+01 volume 0.24053E-02 ppm1 0.587 ppm2 7.099 CV 1
ASSI { 921}
( segid " " and resid 73 and name HG2%)
( segid " " and resid 31 and name HD% )
3.000 3.000 3.000 peak 921 spectrum 1 weight 0.10000E+01 volume 0.81729E-03 ppm1 0.589 ppm2 6.580 CV 1
ASSI { 922}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 73 and name HA ))
3.400 1.400 1.400 peak 922 spectrum 1 weight 0.10000E+01 volume 0.15953E-02 ppm1 0.587 ppm2 5.322 CV 1
ASSI { 924}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 72 and name HA ))
3.300 1.400 1.400 peak 924 spectrum 1 weight 0.10000E+01 volume 0.22591E-02 ppm1 0.587 ppm2 4.905 CV 1
ASSI { 925}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 14 and name HN ))
3.300 3.300 2.700 peak 925 spectrum 1 weight 0.10000E+01 volume 0.45615E-03 ppm1 0.590 ppm2 8.758 CV 1
ASSI { 927}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 73 and name HB ))
3.200 1.300 1.300 peak 927 spectrum 1 weight 0.10000E+01 volume 0.16966E-02 ppm1 0.184 ppm2 1.952 CV 1
ASSI { 928}
( segid " " and resid 87 and name HD2%)
( segid " " and resid 86 and name HB% )
2.600 2.600 3.400 peak 928 spectrum 1 weight 0.10000E+01 volume 0.17432E-02 ppm1 0.184 ppm2 1.652 CV 1
ASSI { 929}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 87 and name HG ))
2.300 0.700 0.700 peak 929 spectrum 1 weight 0.10000E+01 volume 0.69834E-02 ppm1 0.184 ppm2 1.496 CV 1
OR { 929}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 87 and name HB2 ))
ASSI { 930}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 87 and name HB3 ))
2.500 0.800 0.800 peak 930 spectrum 1 weight 0.10000E+01 volume 0.27889E-02 ppm1 0.182 ppm2 1.093 CV 1
ASSI { 931}
( segid " " and resid 87 and name HD2%)
( segid " " and resid 31 and name HD% )
3.300 1.300 1.300 peak 931 spectrum 1 weight 0.10000E+01 volume 0.46024E-03 ppm1 0.179 ppm2 6.582 CV 1
ASSI { 936}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 75 and name HA ))
3.200 1.200 1.200 peak 936 spectrum 1 weight 0.10000E+01 volume 0.25160E-02 ppm1 0.183 ppm2 3.943 CV 1
ASSI { 942}
(( segid " " and resid 14 and name HB3 ))
(( segid " " and resid 14 and name HE2 ))
3.900 1.900 1.900 peak 942 spectrum 1 weight 0.10000E+01 volume 0.78369E-03 ppm1 1.727 ppm2 2.978 CV 1
OR { 942}
(( segid " " and resid 14 and name HB3 ))
(( segid " " and resid 14 and name HE3 ))
ASSI { 943}
(( segid " " and resid 14 and name HB3 ))
(( segid " " and resid 14 and name HB2 ))
1.700 0.400 0.500 peak 943 spectrum 1 weight 0.10000E+01 volume 0.17195E-01 ppm1 1.731 ppm2 1.889 CV 1
ASSI { 944}
(( segid " " and resid 14 and name HB3 ))
(( segid " " and resid 14 and name HG2 ))
2.700 0.900 0.900 peak 944 spectrum 1 weight 0.10000E+01 volume 0.27180E-02 ppm1 1.734 ppm2 1.465 CV 1
ASSI { 945}
(( segid " " and resid 14 and name HB3 ))
(( segid " " and resid 14 and name HG3 ))
2.800 1.000 1.000 peak 945 spectrum 1 weight 0.10000E+01 volume 0.29345E-02 ppm1 1.731 ppm2 1.387 CV 1
ASSI { 947}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 59 and name HA ))
2.500 0.800 0.800 peak 947 spectrum 1 weight 0.10000E+01 volume 0.32130E-02 ppm1 1.739 ppm2 4.541 CV 1
ASSI { 951}
(( segid " " and resid 59 and name HB3 ))
( segid " " and resid 41 and name HD1%)
4.100 2.100 1.900 peak 951 spectrum 1 weight 0.10000E+01 volume 0.10922E-02 ppm1 1.730 ppm2 0.795 CV 1
ASSI { 955}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 59 and name HB2 ))
1.700 0.400 0.500 peak 955 spectrum 1 weight 0.10000E+01 volume 0.12508E-01 ppm1 1.735 ppm2 2.215 CV 1
ASSI { 956}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 59 and name HG3 ))
2.100 0.500 0.500 peak 956 spectrum 1 weight 0.10000E+01 volume 0.10675E-01 ppm1 1.736 ppm2 1.999 CV 1
OR { 956}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 59 and name HG2 ))
ASSI { 959}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 14 and name HE2 ))
3.600 1.600 1.600 peak 959 spectrum 1 weight 0.10000E+01 volume 0.97860E-03 ppm1 1.889 ppm2 2.973 CV 1
OR { 959}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 14 and name HE3 ))
ASSI { 961}
(( segid " " and resid 14 and name HB3 ))
(( segid " " and resid 15 and name HN ))
4.200 2.200 1.800 peak 961 spectrum 1 weight 0.10000E+01 volume 0.65749E-03 ppm1 1.727 ppm2 9.056 CV 1
ASSI { 967}
(( segid " " and resid 15 and name HA2 ))
( segid " " and resid 29 and name HG1%)
2.600 0.900 0.900 peak 967 spectrum 1 weight 0.10000E+01 volume 0.26625E-02 ppm1 3.162 ppm2 0.573 CV 1
ASSI { 969}
(( segid " " and resid 15 and name HA2 ))
(( segid " " and resid 31 and name HB3 ))
3.300 1.400 1.400 peak 969 spectrum 1 weight 0.10000E+01 volume 0.51407E-03 ppm1 3.165 ppm2 2.158 CV 1
ASSI { 975}
(( segid " " and resid 15 and name HA1 ))
(( segid " " and resid 31 and name HB3 ))
4.100 2.100 1.900 peak 975 spectrum 1 weight 0.10000E+01 volume 0.60834E-03 ppm1 5.015 ppm2 2.160 CV 1
ASSI { 976}
(( segid " " and resid 15 and name HA1 ))
( segid " " and resid 29 and name HG1%)
3.800 1.800 1.800 peak 976 spectrum 1 weight 0.10000E+01 volume 0.22669E-02 ppm1 5.016 ppm2 0.569 CV 1
ASSI { 978}
(( segid " " and resid 15 and name HA1 ))
(( segid " " and resid 14 and name HA ))
4.100 2.100 1.900 peak 978 spectrum 1 weight 0.10000E+01 volume 0.84925E-03 ppm1 5.009 ppm2 4.870 CV 1
ASSI { 980}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 70 and name HG3 ))
4.600 2.600 1.400 peak 980 spectrum 1 weight 0.10000E+01 volume 0.69424E-03 ppm1 5.258 ppm2 2.159 CV 1
ASSI { 981}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 70 and name HB2 ))
4.500 2.600 1.500 peak 981 spectrum 1 weight 0.10000E+01 volume 0.57572E-03 ppm1 5.257 ppm2 2.050 CV 1
ASSI { 982}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HB3 ))
2.500 0.800 0.800 peak 982 spectrum 1 weight 0.10000E+01 volume 0.31840E-02 ppm1 5.259 ppm2 1.673 CV 1
OR { 982}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HB2 ))
ASSI { 983}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 17 and name HG12))
4.600 2.600 1.400 peak 983 spectrum 1 weight 0.10000E+01 volume 0.52162E-03 ppm1 5.263 ppm2 1.542 CV 1
ASSI { 986}
(( segid " " and resid 16 and name HA ))
( segid " " and resid 71 and name HG2%)
3.700 1.700 1.700 peak 986 spectrum 1 weight 0.10000E+01 volume 0.59373E-03 ppm1 5.255 ppm2 0.366 CV 1
ASSI { 988}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HE3 ))
3.200 1.300 1.300 peak 988 spectrum 1 weight 0.10000E+01 volume 0.11192E-02 ppm1 1.658 ppm2 3.015 CV 1
OR { 988}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HE2 ))
OR { 988}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 16 and name HE3 ))
ASSI { 989}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 30 and name HB3 ))
3.400 1.500 1.500 peak 989 spectrum 1 weight 0.10000E+01 volume 0.71039E-03 ppm1 1.656 ppm2 2.777 CV 1
OR { 989}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 30 and name HB3 ))
ASSI { 991}
(( segid " " and resid 47 and name HG3 ))
( segid " " and resid 51 and name HB% )
3.900 3.900 2.100 peak 991 spectrum 1 weight 0.10000E+01 volume 0.68039E-03 ppm1 1.739 ppm2 1.478 CV 1
ASSI { 992}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HG2 ))
2.200 0.600 0.600 peak 992 spectrum 1 weight 0.10000E+01 volume 0.72065E-02 ppm1 1.661 ppm2 1.369 CV 1
OR { 992}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 16 and name HG2 ))
ASSI { 996}
(( segid " " and resid 29 and name HB ))
( segid " " and resid 29 and name HG2%)
2.300 0.700 0.700 peak 996 spectrum 1 weight 0.10000E+01 volume 0.62375E-02 ppm1 1.682 ppm2 0.567 CV 1
OR { 996}
(( segid " " and resid 29 and name HB ))
( segid " " and resid 29 and name HG1%)
ASSI { 997}
(( segid " " and resid 47 and name HG3 ))
(( segid " " and resid 47 and name HA ))
3.100 1.200 1.200 peak 997 spectrum 1 weight 0.10000E+01 volume 0.15856E-02 ppm1 1.759 ppm2 4.079 CV 1
ASSI { 998}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 68 and name HA2 ))
4.200 2.200 1.800 peak 998 spectrum 1 weight 0.10000E+01 volume 0.58257E-03 ppm1 1.657 ppm2 3.598 CV 1
OR { 998}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 68 and name HA2 ))
ASSI { 1000}
(( segid " " and resid 29 and name HB ))
(( segid " " and resid 37 and name HA1 ))
4.600 2.600 1.400 peak 1000 spectrum 1 weight 0.10000E+01 volume 0.41203E-03 ppm1 1.665 ppm2 5.121 CV 1
ASSI { 1001}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 15 and name HA1 ))
4.600 2.600 1.400 peak 1001 spectrum 1 weight 0.10000E+01 volume 0.51874E-03 ppm1 1.654 ppm2 5.016 CV 1
OR { 1001}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 15 and name HA1 ))
ASSI { 1002}
(( segid " " and resid 29 and name HB ))
(( segid " " and resid 29 and name HA ))
3.700 1.700 1.700 peak 1002 spectrum 1 weight 0.10000E+01 volume 0.50582E-03 ppm1 1.676 ppm2 4.652 CV 1
ASSI { 1004}
(( segid " " and resid 17 and name HA ))
( segid " " and resid 20 and name HD1%)
4.800 2.800 1.200 peak 1004 spectrum 1 weight 0.10000E+01 volume 0.62791E-03 ppm1 4.290 ppm2 0.672 CV 1
ASSI { 1006}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HB ))
3.300 1.400 1.400 peak 1006 spectrum 1 weight 0.10000E+01 volume 0.78382E-03 ppm1 4.291 ppm2 2.397 CV 1
ASSI { 1010}
(( segid " " and resid 17 and name HB ))
(( segid " " and resid 69 and name HN ))
3.000 1.100 1.100 peak 1010 spectrum 1 weight 0.10000E+01 volume 0.12516E-02 ppm1 2.386 ppm2 7.717 CV 1
ASSI { 1011}
(( segid " " and resid 17 and name HB ))
(( segid " " and resid 16 and name HA ))
4.900 3.000 1.100 peak 1011 spectrum 1 weight 0.10000E+01 volume 0.40489E-03 ppm1 2.380 ppm2 5.275 CV 1
ASSI { 1017}
(( segid " " and resid 21 and name HG3 ))
(( segid " " and resid 19 and name HG3 ))
2.800 2.800 3.200 peak 1017 spectrum 1 weight 0.10000E+01 volume 0.11860E-02 ppm1 2.358 ppm2 1.575 CV 1
OR { 1017}
(( segid " " and resid 21 and name HG2 ))
(( segid " " and resid 19 and name HG3 ))
ASSI { 1021}
(( segid " " and resid 18 and name HB ))
( segid " " and resid 17 and name HG2%)
4.500 2.500 1.500 peak 1021 spectrum 1 weight 0.10000E+01 volume 0.52151E-03 ppm1 4.222 ppm2 0.799 CV 1
ASSI { 1022}
(( segid " " and resid 18 and name HB ))
(( segid " " and resid 18 and name HA ))
2.400 0.700 0.700 peak 1022 spectrum 1 weight 0.10000E+01 volume 0.60992E-02 ppm1 4.220 ppm2 4.524 CV 1
ASSI { 1024}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 68 and name HA1 ))
2.500 2.500 3.500 peak 1024 spectrum 1 weight 0.10000E+01 volume 0.81421E-02 ppm1 4.521 ppm2 4.438 CV 1
ASSI { 1026}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 29 and name HA ))
3.700 1.700 1.700 peak 1026 spectrum 1 weight 0.10000E+01 volume 0.18665E-02 ppm1 4.514 ppm2 4.632 CV 1
ASSI { 1029}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 20 and name HG12))
3.000 1.100 1.100 peak 1029 spectrum 1 weight 0.10000E+01 volume 0.12211E-02 ppm1 4.271 ppm2 1.458 CV 1
ASSI { 1030}
(( segid " " and resid 20 and name HA ))
( segid " " and resid 27 and name HB% )
3.400 1.400 1.400 peak 1030 spectrum 1 weight 0.10000E+01 volume 0.12309E-02 ppm1 4.272 ppm2 1.165 CV 1
ASSI { 1031}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 20 and name HG13))
2.700 0.900 0.900 peak 1031 spectrum 1 weight 0.10000E+01 volume 0.18604E-02 ppm1 4.272 ppm2 0.826 CV 1
ASSI { 1032}
(( segid " " and resid 20 and name HA ))
( segid " " and resid 20 and name HG2%)
2.700 0.900 0.900 peak 1032 spectrum 1 weight 0.10000E+01 volume 0.35565E-02 ppm1 4.272 ppm2 0.714 CV 1
OR { 1032}
(( segid " " and resid 20 and name HA ))
( segid " " and resid 20 and name HD1%)
ASSI { 1034}
(( segid " " and resid 20 and name HB ))
(( segid " " and resid 67 and name HG3 ))
4.000 2.000 2.000 peak 1034 spectrum 1 weight 0.10000E+01 volume 0.44539E-03 ppm1 1.819 ppm2 2.265 CV 1
OR { 1034}
(( segid " " and resid 20 and name HB ))
(( segid " " and resid 67 and name HG2 ))
ASSI { 1036}
(( segid " " and resid 20 and name HB ))
(( segid " " and resid 20 and name HG13))
2.700 0.900 0.900 peak 1036 spectrum 1 weight 0.10000E+01 volume 0.24304E-02 ppm1 1.831 ppm2 0.821 CV 1
ASSI { 1037}
(( segid " " and resid 20 and name HB ))
( segid " " and resid 20 and name HG2%)
2.300 0.600 0.600 peak 1037 spectrum 1 weight 0.10000E+01 volume 0.71764E-02 ppm1 1.819 ppm2 0.706 CV 1
OR { 1037}
(( segid " " and resid 20 and name HB ))
( segid " " and resid 20 and name HD1%)
ASSI { 1040}
(( segid " " and resid 20 and name HB ))
(( segid " " and resid 17 and name HG13))
4.900 3.000 1.100 peak 1040 spectrum 1 weight 0.10000E+01 volume 0.50796E-03 ppm1 1.814 ppm2 1.329 CV 1
ASSI { 1043}
(( segid " " and resid 20 and name HB ))
(( segid " " and resid 62 and name HA ))
4.200 2.300 1.800 peak 1043 spectrum 1 weight 0.10000E+01 volume 0.49354E-03 ppm1 1.814 ppm2 4.160 CV 1
ASSI { 1047}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HB2 ))
2.900 1.100 1.100 peak 1047 spectrum 1 weight 0.10000E+01 volume 0.16259E-02 ppm1 5.343 ppm2 2.199 CV 1
ASSI { 1057}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 21 and name HA ))
3.000 1.100 1.100 peak 1057 spectrum 1 weight 0.10000E+01 volume 0.14448E-02 ppm1 1.871 ppm2 5.338 CV 1
ASSI { 1059}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 21 and name HB3 ))
1.900 0.400 0.400 peak 1059 spectrum 1 weight 0.10000E+01 volume 0.76247E-02 ppm1 2.202 ppm2 1.878 CV 1
ASSI { 1060}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 24 and name HG ))
3.300 1.400 1.400 peak 1060 spectrum 1 weight 0.10000E+01 volume 0.23803E-02 ppm1 2.200 ppm2 1.748 CV 1
ASSI { 1063}
(( segid " " and resid 21 and name HB2 ))
( segid " " and resid 26 and name HB% )
5.200 3.400 0.800 peak 1063 spectrum 1 weight 0.10000E+01 volume 0.42951E-03 ppm1 2.200 ppm2 0.573 CV 1
ASSI { 1065}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 21 and name HG3 ))
2.400 0.700 0.700 peak 1065 spectrum 1 weight 0.10000E+01 volume 0.58324E-02 ppm1 1.871 ppm2 2.348 CV 1
OR { 1065}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 21 and name HG2 ))
ASSI { 1067}
(( segid " " and resid 21 and name HB3 ))
( segid " " and resid 24 and name HD1%)
3.000 1.100 1.100 peak 1067 spectrum 1 weight 0.10000E+01 volume 0.12757E-02 ppm1 1.873 ppm2 1.114 CV 1
ASSI { 1068}
(( segid " " and resid 21 and name HB3 ))
( segid " " and resid 24 and name HD2%)
3.800 1.800 1.800 peak 1068 spectrum 1 weight 0.10000E+01 volume 0.51802E-03 ppm1 1.861 ppm2 0.982 CV 1
ASSI { 1069}
(( segid " " and resid 21 and name HB3 ))
( segid " " and resid 26 and name HB% )
5.100 3.200 0.900 peak 1069 spectrum 1 weight 0.10000E+01 volume 0.51927E-03 ppm1 1.873 ppm2 0.583 CV 1
ASSI { 1073}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 21 and name HB2 ))
5.000 3.200 1.000 peak 1073 spectrum 1 weight 0.10000E+01 volume 0.47340E-03 ppm1 1.718 ppm2 2.200 CV 1
ASSI { 1074}
(( segid " " and resid 93 and name HB3 ))
(( segid " " and resid 93 and name HA ))
2.700 0.900 0.900 peak 1074 spectrum 1 weight 0.10000E+01 volume 0.32629E-02 ppm1 1.643 ppm2 4.473 CV 1
OR { 1074}
(( segid " " and resid 93 and name HB2 ))
(( segid " " and resid 93 and name HA ))
ASSI { 1078}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 21 and name HB2 ))
5.300 3.500 0.700 peak 1078 spectrum 1 weight 0.10000E+01 volume 0.41928E-03 ppm1 1.852 ppm2 2.210 CV 1
ASSI { 1079}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 24 and name HB2 ))
2.100 0.500 0.500 peak 1079 spectrum 1 weight 0.10000E+01 volume 0.46302E-02 ppm1 1.857 ppm2 1.725 CV 1
ASSI { 1081}
(( segid " " and resid 87 and name HB3 ))
(( segid " " and resid 88 and name HN ))
3.700 1.700 1.700 peak 1081 spectrum 1 weight 0.10000E+01 volume 0.54347E-03 ppm1 1.096 ppm2 8.436 CV 1
ASSI { 1085}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 87 and name HN ))
3.600 1.600 1.600 peak 1085 spectrum 1 weight 0.10000E+01 volume 0.56260E-03 ppm1 1.507 ppm2 8.943 CV 1
ASSI { 1087}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 38 and name HZ ))
3.700 1.700 1.700 peak 1087 spectrum 1 weight 0.10000E+01 volume 0.42162E-03 ppm1 1.708 ppm2 7.197 CV 1
OR { 1087}
(( segid " " and resid 24 and name HB2 ))
( segid " " and resid 38 and name HE% )
ASSI { 1093}
( segid " " and resid 24 and name HD2%)
(( segid " " and resid 23 and name HA ))
3.000 3.000 3.000 peak 1093 spectrum 1 weight 0.10000E+01 volume 0.74789E-03 ppm1 0.969 ppm2 4.380 CV 1
ASSI { 1094}
( segid " " and resid 89 and name HG2%)
(( segid " " and resid 88 and name HA ))
3.900 1.900 1.900 peak 1094 spectrum 1 weight 0.10000E+01 volume 0.57833E-03 ppm1 0.972 ppm2 4.945 CV 1
ASSI { 1095}
( segid " " and resid 89 and name HG2%)
(( segid " " and resid 88 and name HB ))
3.100 3.100 2.900 peak 1095 spectrum 1 weight 0.10000E+01 volume 0.63537E-03 ppm1 0.982 ppm2 4.160 CV 1
ASSI { 1096}
( segid " " and resid 24 and name HD2%)
(( segid " " and resid 23 and name HB3 ))
3.000 3.000 3.000 peak 1096 spectrum 1 weight 0.10000E+01 volume 0.79512E-03 ppm1 0.958 ppm2 4.042 CV 1
OR { 1096}
( segid " " and resid 24 and name HD2%)
(( segid " " and resid 23 and name HB2 ))
ASSI { 1098}
( segid " " and resid 24 and name HD1%)
( segid " " and resid 24 and name HD2%)
1.800 0.400 0.400 peak 1098 spectrum 1 weight 0.10000E+01 volume 0.30017E-01 ppm1 1.112 ppm2 0.983 CV 1
ASSI { 1099}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 20 and name HG13))
3.900 1.900 1.900 peak 1099 spectrum 1 weight 0.10000E+01 volume 0.12867E-02 ppm1 1.110 ppm2 0.845 CV 1
ASSI { 1101}
( segid " " and resid 24 and name HD1%)
( segid " " and resid 26 and name HB% )
3.000 1.100 1.100 peak 1101 spectrum 1 weight 0.10000E+01 volume 0.13884E-02 ppm1 1.111 ppm2 0.582 CV 1
ASSI { 1104}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 24 and name HG ))
2.200 0.600 0.600 peak 1104 spectrum 1 weight 0.10000E+01 volume 0.59865E-02 ppm1 1.110 ppm2 1.738 CV 1
ASSI { 1105}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 21 and name HB2 ))
3.200 1.200 1.200 peak 1105 spectrum 1 weight 0.10000E+01 volume 0.16201E-02 ppm1 1.110 ppm2 2.204 CV 1
ASSI { 1107}
( segid " " and resid 24 and name HD2%)
(( segid " " and resid 21 and name HB2 ))
3.700 1.700 1.700 peak 1107 spectrum 1 weight 0.10000E+01 volume 0.66494E-03 ppm1 0.968 ppm2 2.204 CV 1
ASSI { 1109}
( segid " " and resid 24 and name HD2%)
(( segid " " and resid 24 and name HG ))
2.100 0.600 0.600 peak 1109 spectrum 1 weight 0.10000E+01 volume 0.90249E-02 ppm1 0.971 ppm2 1.750 CV 1
ASSI { 1110}
( segid " " and resid 24 and name HD2%)
(( segid " " and resid 19 and name HG3 ))
3.900 1.900 1.900 peak 1110 spectrum 1 weight 0.10000E+01 volume 0.88580E-03 ppm1 0.971 ppm2 1.567 CV 1
ASSI { 1112}
( segid " " and resid 89 and name HG2%)
( segid " " and resid 87 and name HD2%)
3.000 3.000 3.000 peak 1112 spectrum 1 weight 0.10000E+01 volume 0.88265E-03 ppm1 0.972 ppm2 0.201 CV 1
ASSI { 1114}
( segid " " and resid 24 and name HD2%)
( segid " " and resid 38 and name HE% )
3.400 1.400 1.400 peak 1114 spectrum 1 weight 0.10000E+01 volume 0.10453E-02 ppm1 0.968 ppm2 7.189 CV 1
ASSI { 1115}
(( segid " " and resid 22 and name HA ))
( segid " " and resid 61 and name HG2%)
2.400 0.800 0.800 peak 1115 spectrum 1 weight 0.10000E+01 volume 0.50969E-02 ppm1 4.205 ppm2 0.882 CV 1
ASSI { 1116}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 52 and name HD22))
4.500 2.500 1.500 peak 1116 spectrum 1 weight 0.10000E+01 volume 0.53599E-03 ppm1 2.971 ppm2 6.912 CV 1
ASSI { 1117}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 52 and name HD21))
3.300 1.400 1.400 peak 1117 spectrum 1 weight 0.10000E+01 volume 0.87026E-03 ppm1 2.971 ppm2 7.612 CV 1
ASSI { 1119}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 62 and name HD2 ))
3.800 1.800 1.800 peak 1119 spectrum 1 weight 0.10000E+01 volume 0.57284E-03 ppm1 4.201 ppm2 1.706 CV 1
OR { 1119}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 62 and name HD3 ))
ASSI { 1122}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 23 and name HB3 ))
3.100 3.100 2.900 peak 1122 spectrum 1 weight 0.10000E+01 volume 0.43483E-02 ppm1 4.203 ppm2 4.025 CV 1
OR { 1122}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 23 and name HB2 ))
ASSI { 1123}
(( segid " " and resid 50 and name HB3 ))
(( segid " " and resid 50 and name HA ))
2.500 0.800 0.800 peak 1123 spectrum 1 weight 0.10000E+01 volume 0.32755E-02 ppm1 2.523 ppm2 4.568 CV 1
ASSI { 1125}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 22 and name HD3 ))
3.900 1.900 1.900 peak 1125 spectrum 1 weight 0.10000E+01 volume 0.12259E-02 ppm1 2.550 ppm2 4.083 CV 1
ASSI { 1128}
(( segid " " and resid 50 and name HB3 ))
(( segid " " and resid 53 and name HA ))
4.400 2.400 1.600 peak 1128 spectrum 1 weight 0.10000E+01 volume 0.87409E-03 ppm1 2.530 ppm2 4.443 CV 1
ASSI { 1130}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 22 and name HG2 ))
2.300 0.700 0.700 peak 1130 spectrum 1 weight 0.10000E+01 volume 0.53625E-02 ppm1 2.546 ppm2 2.331 CV 1
ASSI { 1132}
(( segid " " and resid 50 and name HB3 ))
(( segid " " and resid 50 and name HB2 ))
1.800 0.400 0.400 peak 1132 spectrum 1 weight 0.10000E+01 volume 0.11537E-01 ppm1 2.522 ppm2 2.078 CV 1
ASSI { 1134}
(( segid " " and resid 50 and name HB3 ))
( segid " " and resid 51 and name HB% )
4.500 2.500 1.500 peak 1134 spectrum 1 weight 0.10000E+01 volume 0.68030E-03 ppm1 2.540 ppm2 1.489 CV 1
ASSI { 1135}
(( segid " " and resid 22 and name HB2 ))
( segid " " and resid 61 and name HG2%)
3.900 1.900 1.900 peak 1135 spectrum 1 weight 0.10000E+01 volume 0.11886E-02 ppm1 2.552 ppm2 0.883 CV 1
ASSI { 1139}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 22 and name HG2 ))
2.700 0.900 0.900 peak 1139 spectrum 1 weight 0.10000E+01 volume 0.53491E-02 ppm1 2.194 ppm2 2.337 CV 1
ASSI { 1140}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 59 and name HG2 ))
2.000 0.500 0.500 peak 1140 spectrum 1 weight 0.10000E+01 volume 0.10305E-01 ppm1 2.209 ppm2 2.002 CV 1
OR { 1140}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 59 and name HG3 ))
ASSI { 1141}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 22 and name HG3 ))
2.200 0.600 0.600 peak 1141 spectrum 1 weight 0.10000E+01 volume 0.54427E-02 ppm1 2.200 ppm2 1.883 CV 1
ASSI { 1143}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 62 and name HG2 ))
4.000 2.000 2.000 peak 1143 spectrum 1 weight 0.10000E+01 volume 0.41858E-03 ppm1 2.181 ppm2 1.512 CV 1
ASSI { 1146}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 58 and name HA ))
4.900 3.000 1.100 peak 1146 spectrum 1 weight 0.10000E+01 volume 0.52509E-03 ppm1 2.207 ppm2 4.654 CV 1
ASSI { 1147}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 59 and name HA ))
2.800 1.000 1.000 peak 1147 spectrum 1 weight 0.10000E+01 volume 0.35344E-02 ppm1 2.211 ppm2 4.542 CV 1
ASSI { 1151}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 22 and name HD3 ))
3.600 1.700 1.700 peak 1151 spectrum 1 weight 0.10000E+01 volume 0.11496E-02 ppm1 2.185 ppm2 4.080 CV 1
ASSI { 1154}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 26 and name HA ))
2.800 1.000 1.000 peak 1154 spectrum 1 weight 0.10000E+01 volume 0.30228E-02 ppm1 4.427 ppm2 4.648 CV 1
ASSI { 1158}
(( segid " " and resid 59 and name HB2 ))
( segid " " and resid 49 and name HE% )
4.100 2.100 1.900 peak 1158 spectrum 1 weight 0.10000E+01 volume 0.58663E-03 ppm1 2.214 ppm2 7.089 CV 1
ASSI { 1162}
(( segid " " and resid 40 and name HD3 ))
(( segid " " and resid 40 and name HG3 ))
2.700 0.900 0.900 peak 1162 spectrum 1 weight 0.10000E+01 volume 0.26216E-02 ppm1 3.812 ppm2 2.188 CV 1
OR { 1162}
(( segid " " and resid 40 and name HD3 ))
(( segid " " and resid 40 and name HG2 ))
ASSI { 1163}
(( segid " " and resid 40 and name HD3 ))
(( segid " " and resid 40 and name HB2 ))
3.900 1.900 1.900 peak 1163 spectrum 1 weight 0.10000E+01 volume 0.10937E-02 ppm1 3.816 ppm2 2.028 CV 1
ASSI { 1164}
(( segid " " and resid 22 and name HG2 ))
(( segid " " and resid 21 and name HA ))
5.000 3.100 1.000 peak 1164 spectrum 1 weight 0.10000E+01 volume 0.62655E-03 ppm1 2.335 ppm2 5.338 CV 1
ASSI { 1167}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HA ))
3.300 1.300 1.300 peak 1167 spectrum 1 weight 0.10000E+01 volume 0.14035E-02 ppm1 2.315 ppm2 3.801 CV 1
ASSI { 1172}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 41 and name HB3 ))
2.500 2.500 3.500 peak 1172 spectrum 1 weight 0.10000E+01 volume 0.28137E-02 ppm1 2.331 ppm2 2.005 CV 1
ASSI { 1177}
(( segid " " and resid 22 and name HG3 ))
(( segid " " and resid 21 and name HA ))
4.800 2.900 1.200 peak 1177 spectrum 1 weight 0.10000E+01 volume 0.60698E-03 ppm1 1.887 ppm2 5.340 CV 1
ASSI { 1179}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 52 and name HB3 ))
1.700 0.300 0.500 peak 1179 spectrum 1 weight 0.10000E+01 volume 0.25966E-01 ppm1 2.894 ppm2 2.967 CV 1
ASSI { 1181}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 53 and name HB2 ))
3.200 3.200 2.800 peak 1181 spectrum 1 weight 0.10000E+01 volume 0.23576E-02 ppm1 2.968 ppm2 3.056 CV 1
ASSI { 1184}
(( segid " " and resid 22 and name HG3 ))
( segid " " and resid 61 and name HG2%)
3.700 1.700 1.700 peak 1184 spectrum 1 weight 0.10000E+01 volume 0.71983E-03 ppm1 1.887 ppm2 0.886 CV 1
ASSI { 1185}
(( segid " " and resid 22 and name HG3 ))
( segid " " and resid 20 and name HG2%)
3.400 1.500 1.500 peak 1185 spectrum 1 weight 0.10000E+01 volume 0.10011E-02 ppm1 1.885 ppm2 0.716 CV 1
ASSI { 1187}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 25 and name HA ))
3.100 1.200 1.200 peak 1187 spectrum 1 weight 0.10000E+01 volume 0.13009E-02 ppm1 4.204 ppm2 3.792 CV 1
ASSI { 1189}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HB2 ))
2.800 1.000 1.000 peak 1189 spectrum 1 weight 0.10000E+01 volume 0.37266E-02 ppm1 3.791 ppm2 2.318 CV 1
OR { 1189}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HG3 ))
OR { 1189}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HG2 ))
ASSI { 1190}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HB3 ))
2.600 0.900 0.900 peak 1190 spectrum 1 weight 0.10000E+01 volume 0.22199E-02 ppm1 3.791 ppm2 2.212 CV 1
ASSI { 1191}
(( segid " " and resid 25 and name HA ))
( segid " " and resid 61 and name HG2%)
2.800 1.000 1.000 peak 1191 spectrum 1 weight 0.10000E+01 volume 0.18768E-02 ppm1 3.791 ppm2 0.882 CV 1
ASSI { 1196}
( segid " " and resid 26 and name HB% )
(( segid " " and resid 25 and name HB2 ))
3.500 1.500 1.500 peak 1196 spectrum 1 weight 0.10000E+01 volume 0.73263E-03 ppm1 0.573 ppm2 2.350 CV 1
OR { 1196}
( segid " " and resid 26 and name HB% )
(( segid " " and resid 25 and name HG3 ))
ASSI { 1199}
( segid " " and resid 26 and name HB% )
(( segid " " and resid 24 and name HB3 ))
3.700 1.700 1.700 peak 1199 spectrum 1 weight 0.10000E+01 volume 0.20098E-02 ppm1 0.572 ppm2 1.862 CV 1
ASSI { 1200}
( segid " " and resid 26 and name HB% )
(( segid " " and resid 24 and name HB2 ))
2.900 1.000 1.000 peak 1200 spectrum 1 weight 0.10000E+01 volume 0.21913E-02 ppm1 0.573 ppm2 1.702 CV 1
ASSI { 1201}
( segid " " and resid 26 and name HB% )
(( segid " " and resid 41 and name HB2 ))
2.900 2.900 3.100 peak 1201 spectrum 1 weight 0.10000E+01 volume 0.71696E-02 ppm1 0.574 ppm2 1.392 CV 1
ASSI { 1202}
( segid " " and resid 26 and name HB% )
(( segid " " and resid 61 and name HG12))
4.600 2.700 1.400 peak 1202 spectrum 1 weight 0.10000E+01 volume 0.54192E-03 ppm1 0.571 ppm2 1.265 CV 1
ASSI { 1207}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 52 and name HA ))
2.700 0.900 0.900 peak 1207 spectrum 1 weight 0.10000E+01 volume 0.37402E-02 ppm1 2.970 ppm2 4.659 CV 1
ASSI { 1216}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 44 and name HG12))
4.600 2.700 1.400 peak 1216 spectrum 1 weight 0.10000E+01 volume 0.41172E-03 ppm1 1.389 ppm2 1.875 CV 1
ASSI { 1218}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 41 and name HG ))
2.700 0.900 0.900 peak 1218 spectrum 1 weight 0.10000E+01 volume 0.31301E-02 ppm1 1.384 ppm2 1.646 CV 1
ASSI { 1220}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 61 and name HG12))
4.200 2.300 1.800 peak 1220 spectrum 1 weight 0.10000E+01 volume 0.62446E-03 ppm1 1.389 ppm2 1.249 CV 1
ASSI { 1226}
( segid " " and resid 27 and name HB% )
(( segid " " and resid 26 and name HA ))
4.000 2.000 2.000 peak 1226 spectrum 1 weight 0.10000E+01 volume 0.85151E-03 ppm1 1.141 ppm2 4.663 CV 1
ASSI { 1227}
( segid " " and resid 27 and name HB% )
(( segid " " and resid 27 and name HA ))
2.400 0.700 0.700 peak 1227 spectrum 1 weight 0.10000E+01 volume 0.44067E-02 ppm1 1.152 ppm2 5.010 CV 1
ASSI { 1235}
( segid " " and resid 27 and name HB% )
(( segid " " and resid 61 and name HG13))
2.800 0.900 0.900 peak 1235 spectrum 1 weight 0.10000E+01 volume 0.65095E-02 ppm1 1.156 ppm2 1.042 CV 1
ASSI { 1236}
( segid " " and resid 27 and name HB% )
( segid " " and resid 61 and name HG2%)
3.200 1.300 1.300 peak 1236 spectrum 1 weight 0.10000E+01 volume 0.44073E-02 ppm1 1.152 ppm2 0.857 CV 1
ASSI { 1238}
( segid " " and resid 27 and name HB% )
(( segid " " and resid 20 and name HB ))
4.500 2.500 1.500 peak 1238 spectrum 1 weight 0.10000E+01 volume 0.58142E-03 ppm1 1.149 ppm2 1.827 CV 1
ASSI { 1239}
( segid " " and resid 27 and name HB% )
(( segid " " and resid 17 and name HG12))
3.500 1.600 1.600 peak 1239 spectrum 1 weight 0.10000E+01 volume 0.10700E-02 ppm1 1.148 ppm2 1.525 CV 1
ASSI { 1240}
( segid " " and resid 27 and name HB% )
(( segid " " and resid 20 and name HG12))
2.700 0.900 0.900 peak 1240 spectrum 1 weight 0.10000E+01 volume 0.16286E-02 ppm1 1.150 ppm2 1.441 CV 1
ASSI { 1241}
( segid " " and resid 27 and name HB% )
(( segid " " and resid 17 and name HG13))
2.100 2.100 3.900 peak 1241 spectrum 1 weight 0.10000E+01 volume 0.83084E-02 ppm1 1.150 ppm2 1.314 CV 1
ASSI { 1242}
( segid " " and resid 27 and name HB% )
( segid " " and resid 17 and name HG2%)
2.400 0.700 0.700 peak 1242 spectrum 1 weight 0.10000E+01 volume 0.69520E-02 ppm1 1.149 ppm2 0.778 CV 1
ASSI { 1244}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 36 and name HB2 ))
5.000 3.200 1.000 peak 1244 spectrum 1 weight 0.10000E+01 volume 0.40060E-03 ppm1 5.620 ppm2 3.114 CV 1
ASSI { 1245}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HB3 ))
2.900 1.100 1.100 peak 1245 spectrum 1 weight 0.10000E+01 volume 0.14837E-02 ppm1 5.601 ppm2 2.977 CV 1
ASSI { 1248}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 19 and name HD2 ))
4.800 2.800 1.200 peak 1248 spectrum 1 weight 0.10000E+01 volume 0.41519E-03 ppm1 3.016 ppm2 3.242 CV 1
ASSI { 1251}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 36 and name HB3 ))
4.700 2.700 1.300 peak 1251 spectrum 1 weight 0.10000E+01 volume 0.49973E-03 ppm1 2.955 ppm2 3.326 CV 1
ASSI { 1253}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 19 and name HB3 ))
4.400 2.500 1.600 peak 1253 spectrum 1 weight 0.10000E+01 volume 0.63849E-03 ppm1 2.999 ppm2 1.883 CV 1
ASSI { 1260}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name HB3 ))
2.100 0.500 0.500 peak 1260 spectrum 1 weight 0.10000E+01 volume 0.46702E-02 ppm1 2.812 ppm2 3.382 CV 1
ASSI { 1274}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 31 and name HB2 ))
2.300 0.700 0.700 peak 1274 spectrum 1 weight 0.10000E+01 volume 0.30111E-02 ppm1 2.168 ppm2 3.137 CV 1
ASSI { 1276}
(( segid " " and resid 70 and name HG3 ))
(( segid " " and resid 14 and name HE3 ))
3.700 1.700 1.700 peak 1276 spectrum 1 weight 0.10000E+01 volume 0.54926E-03 ppm1 2.147 ppm2 3.003 CV 1
OR { 1276}
(( segid " " and resid 70 and name HG3 ))
(( segid " " and resid 14 and name HE2 ))
ASSI { 1277}
(( segid " " and resid 48 and name HB3 ))
(( segid " " and resid 48 and name HB2 ))
2.000 0.500 0.500 peak 1277 spectrum 1 weight 0.10000E+01 volume 0.40667E-02 ppm1 3.075 ppm2 2.722 CV 1
ASSI { 1281}
(( segid " " and resid 31 and name HB2 ))
( segid " " and resid 29 and name HG1%)
4.200 2.200 1.800 peak 1281 spectrum 1 weight 0.10000E+01 volume 0.13364E-02 ppm1 3.118 ppm2 0.581 CV 1
ASSI { 1283}
(( segid " " and resid 70 and name HG3 ))
(( segid " " and resid 70 and name HG2 ))
1.800 0.400 0.400 peak 1283 spectrum 1 weight 0.10000E+01 volume 0.14790E-01 ppm1 2.145 ppm2 2.433 CV 1
ASSI { 1288}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 87 and name HB3 ))
3.100 1.200 1.200 peak 1288 spectrum 1 weight 0.10000E+01 volume 0.66354E-03 ppm1 5.167 ppm2 1.112 CV 1
ASSI { 1298}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HG3 ))
3.000 1.100 1.100 peak 1298 spectrum 1 weight 0.10000E+01 volume 0.22945E-02 ppm1 3.934 ppm2 2.263 CV 1
ASSI { 1299}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 53 and name HB2 ))
4.500 2.500 1.500 peak 1299 spectrum 1 weight 0.10000E+01 volume 0.87882E-03 ppm1 3.377 ppm2 3.043 CV 1
ASSI { 1301}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name HG3 ))
2.100 0.500 0.500 peak 1301 spectrum 1 weight 0.10000E+01 volume 0.17652E-01 ppm1 2.033 ppm2 2.262 CV 1
OR { 1301}
(( segid " " and resid 34 and name HB3 ))
(( segid " " and resid 34 and name HG3 ))
ASSI { 1302}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 35 and name HA ))
3.500 1.500 1.500 peak 1302 spectrum 1 weight 0.10000E+01 volume 0.11721E-02 ppm1 1.621 ppm2 4.535 CV 1
ASSI { 1303}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 35 and name HN ))
3.300 1.300 1.300 peak 1303 spectrum 1 weight 0.10000E+01 volume 0.85212E-03 ppm1 1.619 ppm2 7.679 CV 1
ASSI { 1305}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 53 and name HB3 ))
4.600 2.600 1.400 peak 1305 spectrum 1 weight 0.10000E+01 volume 0.53483E-03 ppm1 3.376 ppm2 3.222 CV 1
ASSI { 1306}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HB2 ))
2.900 1.100 1.100 peak 1306 spectrum 1 weight 0.10000E+01 volume 0.22858E-02 ppm1 5.092 ppm2 3.118 CV 1
ASSI { 1307}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 28 and name HB3 ))
3.800 1.800 1.800 peak 1307 spectrum 1 weight 0.10000E+01 volume 0.52392E-03 ppm1 5.093 ppm2 3.017 CV 1
ASSI { 1308}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 29 and name HA ))
3.100 3.100 2.900 peak 1308 spectrum 1 weight 0.10000E+01 volume 0.62468E-03 ppm1 5.093 ppm2 4.660 CV 1
ASSI { 1309}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 50 and name HD3 ))
4.800 2.900 1.200 peak 1309 spectrum 1 weight 0.10000E+01 volume 0.45754E-03 ppm1 3.377 ppm2 4.169 CV 1
ASSI { 1310}
(( segid " " and resid 36 and name HB3 ))
(( segid " " and resid 19 and name HD2 ))
2.800 2.800 3.200 peak 1310 spectrum 1 weight 0.10000E+01 volume 0.11783E-02 ppm1 3.326 ppm2 3.242 CV 1
ASSI { 1317}
(( segid " " and resid 36 and name HB2 ))
( segid " " and resid 28 and name HD% )
4.400 2.400 1.600 peak 1317 spectrum 1 weight 0.10000E+01 volume 0.44632E-03 ppm1 3.108 ppm2 7.125 CV 1
ASSI { 1324}
(( segid " " and resid 37 and name HA1 ))
( segid " " and resid 87 and name HD2%)
4.500 2.500 1.500 peak 1324 spectrum 1 weight 0.10000E+01 volume 0.40928E-03 ppm1 5.141 ppm2 0.174 CV 1
ASSI { 1325}
(( segid " " and resid 37 and name HA1 ))
( segid " " and resid 31 and name HE% )
4.100 2.100 1.900 peak 1325 spectrum 1 weight 0.10000E+01 volume 0.68019E-03 ppm1 5.145 ppm2 6.395 CV 1
ASSI { 1327}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 39 and name HB3 ))
2.400 0.700 0.700 peak 1327 spectrum 1 weight 0.10000E+01 volume 0.20547E-02 ppm1 0.646 ppm2 1.693 CV 1
ASSI { 1328}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 87 and name HB2 ))
3.700 1.700 1.700 peak 1328 spectrum 1 weight 0.10000E+01 volume 0.63537E-03 ppm1 0.645 ppm2 1.541 CV 1
OR { 1328}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 87 and name HG ))
ASSI { 1329}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 39 and name HG ))
3.300 1.300 1.300 peak 1329 spectrum 1 weight 0.10000E+01 volume 0.72011E-03 ppm1 0.637 ppm2 1.182 CV 1
ASSI { 1330}
(( segid " " and resid 39 and name HB2 ))
( segid " " and resid 39 and name HD1%)
2.800 1.000 1.000 peak 1330 spectrum 1 weight 0.10000E+01 volume 0.27339E-02 ppm1 0.632 ppm2 0.605 CV 1
ASSI { 1331}
(( segid " " and resid 39 and name HB2 ))
( segid " " and resid 39 and name HD2%)
3.800 1.800 1.800 peak 1331 spectrum 1 weight 0.10000E+01 volume 0.84371E-03 ppm1 0.642 ppm2 0.319 CV 1
ASSI { 1332}
(( segid " " and resid 39 and name HB3 ))
(( segid " " and resid 87 and name HB2 ))
3.800 1.800 1.800 peak 1332 spectrum 1 weight 0.10000E+01 volume 0.84508E-03 ppm1 1.689 ppm2 1.532 CV 1
OR { 1332}
(( segid " " and resid 39 and name HB3 ))
(( segid " " and resid 87 and name HG ))
ASSI { 1333}
(( segid " " and resid 39 and name HB3 ))
(( segid " " and resid 39 and name HG ))
3.300 1.300 1.300 peak 1333 spectrum 1 weight 0.10000E+01 volume 0.12216E-02 ppm1 1.687 ppm2 1.177 CV 1
ASSI { 1334}
(( segid " " and resid 39 and name HB3 ))
( segid " " and resid 39 and name HD1%)
2.800 0.900 0.900 peak 1334 spectrum 1 weight 0.10000E+01 volume 0.31816E-02 ppm1 1.689 ppm2 0.621 CV 1
ASSI { 1338}
(( segid " " and resid 48 and name HB2 ))
(( segid " " and resid 48 and name HA ))
3.400 1.500 1.500 peak 1338 spectrum 1 weight 0.10000E+01 volume 0.10908E-02 ppm1 2.717 ppm2 4.361 CV 1
ASSI { 1339}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 39 and name HN ))
3.500 1.500 1.500 peak 1339 spectrum 1 weight 0.10000E+01 volume 0.73352E-03 ppm1 0.642 ppm2 8.890 CV 1
ASSI { 1341}
( segid " " and resid 39 and name HD2%)
(( segid " " and resid 44 and name HG12))
3.400 1.500 1.500 peak 1341 spectrum 1 weight 0.10000E+01 volume 0.74591E-03 ppm1 0.314 ppm2 1.838 CV 1
ASSI { 1345}
( segid " " and resid 39 and name HD2%)
(( segid " " and resid 39 and name HG ))
2.600 0.800 0.800 peak 1345 spectrum 1 weight 0.10000E+01 volume 0.37295E-02 ppm1 0.315 ppm2 1.190 CV 1
ASSI { 1348}
( segid " " and resid 39 and name HD2%)
( segid " " and resid 39 and name HD1%)
2.200 0.600 0.600 peak 1348 spectrum 1 weight 0.10000E+01 volume 0.15577E-01 ppm1 0.316 ppm2 0.629 CV 1
OR { 1348}
( segid " " and resid 39 and name HD2%)
(( segid " " and resid 39 and name HB2 ))
ASSI { 1349}
( segid " " and resid 71 and name HG1%)
(( segid " " and resid 69 and name HG2 ))
2.900 1.100 1.100 peak 1349 spectrum 1 weight 0.10000E+01 volume 0.12459E-02 ppm1 0.316 ppm2 2.470 CV 1
ASSI { 1350}
( segid " " and resid 71 and name HG1%)
(( segid " " and resid 69 and name HB3 ))
3.000 1.100 1.100 peak 1350 spectrum 1 weight 0.10000E+01 volume 0.11109E-02 ppm1 0.315 ppm2 2.077 CV 1
ASSI { 1352}
( segid " " and resid 71 and name HG1%)
(( segid " " and resid 17 and name HG12))
3.600 1.600 1.600 peak 1352 spectrum 1 weight 0.10000E+01 volume 0.11524E-02 ppm1 0.316 ppm2 1.544 CV 1
ASSI { 1361}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 40 and name HG2 ))
2.500 0.800 0.800 peak 1361 spectrum 1 weight 0.10000E+01 volume 0.43468E-02 ppm1 2.569 ppm2 2.189 CV 1
OR { 1361}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 40 and name HG3 ))
ASSI { 1362}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 40 and name HB2 ))
1.800 0.400 0.400 peak 1362 spectrum 1 weight 0.10000E+01 volume 0.91830E-02 ppm1 2.570 ppm2 2.004 CV 1
ASSI { 1363}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 42 and name HB3 ))
3.900 1.900 1.900 peak 1363 spectrum 1 weight 0.10000E+01 volume 0.10437E-02 ppm1 2.568 ppm2 1.898 CV 1
ASSI { 1364}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 42 and name HG3 ))
3.800 1.800 1.800 peak 1364 spectrum 1 weight 0.10000E+01 volume 0.73434E-03 ppm1 2.569 ppm2 1.559 CV 1
OR { 1364}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 42 and name HG2 ))
ASSI { 1365}
(( segid " " and resid 40 and name HB3 ))
( segid " " and resid 26 and name HB% )
3.900 1.900 1.900 peak 1365 spectrum 1 weight 0.10000E+01 volume 0.10128E-02 ppm1 2.570 ppm2 0.584 CV 1
ASSI { 1366}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 26 and name HA ))
4.700 2.800 1.300 peak 1366 spectrum 1 weight 0.10000E+01 volume 0.45448E-03 ppm1 2.565 ppm2 4.646 CV 1
ASSI { 1367}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 40 and name HA ))
2.400 0.700 0.700 peak 1367 spectrum 1 weight 0.10000E+01 volume 0.32973E-02 ppm1 2.569 ppm2 4.427 CV 1
ASSI { 1368}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 40 and name HD2 ))
4.200 2.300 1.800 peak 1368 spectrum 1 weight 0.10000E+01 volume 0.71525E-03 ppm1 2.571 ppm2 3.884 CV 1
ASSI { 1369}
(( segid " " and resid 40 and name HB2 ))
( segid " " and resid 26 and name HB% )
4.500 2.500 1.500 peak 1369 spectrum 1 weight 0.10000E+01 volume 0.76884E-03 ppm1 2.014 ppm2 0.581 CV 1
ASSI { 1370}
(( segid " " and resid 4 and name HB3 ))
(( segid " " and resid 4 and name HB2 ))
1.400 0.200 0.800 peak 1370 spectrum 1 weight 0.10000E+01 volume 0.65322E-01 ppm1 2.014 ppm2 2.092 CV 1
ASSI { 1371}
(( segid " " and resid 4 and name HB2 ))
( segid " " and resid 5 and name HD2%)
3.600 1.700 1.700 peak 1371 spectrum 1 weight 0.10000E+01 volume 0.10998E-02 ppm1 2.068 ppm2 0.946 CV 1
OR { 1371}
(( segid " " and resid 4 and name HB2 ))
( segid " " and resid 5 and name HD1%)
ASSI { 1373}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 40 and name HD2 ))
3.400 1.400 1.400 peak 1373 spectrum 1 weight 0.10000E+01 volume 0.74160E-03 ppm1 2.006 ppm2 3.873 CV 1
ASSI { 1374}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 42 and name HN ))
4.000 2.000 2.000 peak 1374 spectrum 1 weight 0.10000E+01 volume 0.52951E-03 ppm1 2.566 ppm2 8.748 CV 1
ASSI { 1377}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 43 and name HN ))
3.500 1.500 1.500 peak 1377 spectrum 1 weight 0.10000E+01 volume 0.75296E-03 ppm1 2.000 ppm2 7.892 CV 1
ASSI { 1379}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 25 and name HB3 ))
3.700 1.700 1.700 peak 1379 spectrum 1 weight 0.10000E+01 volume 0.48502E-03 ppm1 1.995 ppm2 2.234 CV 1
ASSI { 1380}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 61 and name HG12))
5.100 3.200 0.900 peak 1380 spectrum 1 weight 0.10000E+01 volume 0.54835E-03 ppm1 1.999 ppm2 1.249 CV 1
ASSI { 1382}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 42 and name HB2 ))
4.100 2.100 1.900 peak 1382 spectrum 1 weight 0.10000E+01 volume 0.11328E-02 ppm1 1.992 ppm2 2.059 CV 1
ASSI { 1383}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 41 and name HG ))
2.400 0.700 0.700 peak 1383 spectrum 1 weight 0.10000E+01 volume 0.35341E-02 ppm1 1.984 ppm2 1.648 CV 1
ASSI { 1384}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 41 and name HB2 ))
2.100 0.500 0.500 peak 1384 spectrum 1 weight 0.10000E+01 volume 0.27980E-02 ppm1 1.992 ppm2 1.392 CV 1
ASSI { 1386}
(( segid " " and resid 41 and name HB3 ))
( segid " " and resid 41 and name HD1%)
3.800 1.800 1.800 peak 1386 spectrum 1 weight 0.10000E+01 volume 0.99954E-03 ppm1 2.000 ppm2 0.788 CV 1
ASSI { 1389}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HB2 ))
2.500 0.800 0.800 peak 1389 spectrum 1 weight 0.10000E+01 volume 0.42050E-02 ppm1 4.316 ppm2 2.084 CV 1
ASSI { 1391}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HG3 ))
3.600 1.600 1.600 peak 1391 spectrum 1 weight 0.10000E+01 volume 0.14834E-02 ppm1 4.315 ppm2 1.564 CV 1
OR { 1391}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HG2 ))
ASSI { 1392}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 41 and name HB2 ))
4.400 2.500 1.600 peak 1392 spectrum 1 weight 0.10000E+01 volume 0.45308E-03 ppm1 4.307 ppm2 1.373 CV 1
ASSI { 1393}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HB3 ))
2.600 0.800 0.800 peak 1393 spectrum 1 weight 0.10000E+01 volume 0.42597E-02 ppm1 4.315 ppm2 1.875 CV 1
ASSI { 1400}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 42 and name HG3 ))
2.600 0.800 0.800 peak 1400 spectrum 1 weight 0.10000E+01 volume 0.33235E-02 ppm1 2.075 ppm2 1.563 CV 1
OR { 1400}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 42 and name HG2 ))
ASSI { 1403}
(( segid " " and resid 67 and name HB3 ))
(( segid " " and resid 17 and name HN ))
4.500 2.500 1.500 peak 1403 spectrum 1 weight 0.10000E+01 volume 0.62346E-03 ppm1 1.991 ppm2 8.823 CV 1
OR { 1403}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 17 and name HN ))
ASSI { 1409}
(( segid " " and resid 43 and name HB2 ))
(( segid " " and resid 43 and name HA ))
3.800 1.800 1.800 peak 1409 spectrum 1 weight 0.10000E+01 volume 0.68664E-03 ppm1 3.134 ppm2 4.946 CV 1
ASSI { 1410}
(( segid " " and resid 43 and name HB3 ))
(( segid " " and resid 43 and name HB2 ))
2.800 1.000 1.000 peak 1410 spectrum 1 weight 0.10000E+01 volume 0.89052E-03 ppm1 1.933 ppm2 3.133 CV 1
ASSI { 1413}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 44 and name HB ))
3.800 1.800 1.800 peak 1413 spectrum 1 weight 0.10000E+01 volume 0.56034E-03 ppm1 3.936 ppm2 2.112 CV 1
ASSI { 1414}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HB3 ))
3.400 1.400 1.400 peak 1414 spectrum 1 weight 0.10000E+01 volume 0.11496E-02 ppm1 3.919 ppm2 1.995 CV 1
ASSI { 1415}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 44 and name HG12))
3.900 1.900 1.900 peak 1415 spectrum 1 weight 0.10000E+01 volume 0.89613E-03 ppm1 3.925 ppm2 1.857 CV 1
ASSI { 1416}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HG ))
3.400 1.400 1.400 peak 1416 spectrum 1 weight 0.10000E+01 volume 0.10038E-02 ppm1 3.922 ppm2 1.634 CV 1
ASSI { 1417}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HB2 ))
2.600 0.800 0.800 peak 1417 spectrum 1 weight 0.10000E+01 volume 0.16346E-02 ppm1 3.924 ppm2 1.391 CV 1
ASSI { 1421}
(( segid " " and resid 41 and name HA ))
( segid " " and resid 41 and name HD2%)
4.000 2.000 2.000 peak 1421 spectrum 1 weight 0.10000E+01 volume 0.12127E-02 ppm1 3.924 ppm2 0.922 CV 1
ASSI { 1422}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 42 and name HA ))
3.400 1.400 1.400 peak 1422 spectrum 1 weight 0.10000E+01 volume 0.13207E-02 ppm1 3.925 ppm2 4.294 CV 1
ASSI { 1428}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 42 and name HN ))
3.300 1.300 1.300 peak 1428 spectrum 1 weight 0.10000E+01 volume 0.72743E-03 ppm1 1.996 ppm2 8.754 CV 1
ASSI { 1430}
( segid " " and resid 45 and name HB% )
(( segid " " and resid 48 and name HA ))
4.400 2.400 1.600 peak 1430 spectrum 1 weight 0.10000E+01 volume 0.56911E-03 ppm1 1.149 ppm2 4.329 CV 1
ASSI { 1434}
(( segid " " and resid 44 and name HA ))
( segid " " and resid 44 and name HG2%)
3.000 1.100 1.100 peak 1434 spectrum 1 weight 0.10000E+01 volume 0.16184E-02 ppm1 3.803 ppm2 0.833 CV 1
ASSI { 1435}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HG13))
3.800 1.800 1.800 peak 1435 spectrum 1 weight 0.10000E+01 volume 0.51852E-03 ppm1 3.802 ppm2 0.527 CV 1
ASSI { 1437}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 46 and name HG3 ))
4.600 2.700 1.400 peak 1437 spectrum 1 weight 0.10000E+01 volume 0.50858E-03 ppm1 4.097 ppm2 1.578 CV 1
OR { 1437}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 46 and name HG2 ))
ASSI { 1438}
(( segid " " and resid 45 and name HA ))
( segid " " and resid 45 and name HB% )
2.400 0.700 0.700 peak 1438 spectrum 1 weight 0.10000E+01 volume 0.52999E-02 ppm1 4.101 ppm2 1.153 CV 1
ASSI { 1439}
(( segid " " and resid 45 and name HA ))
( segid " " and resid 44 and name HG2%)
3.900 1.900 1.900 peak 1439 spectrum 1 weight 0.10000E+01 volume 0.43654E-03 ppm1 4.101 ppm2 0.834 CV 1
ASSI { 1443}
( segid " " and resid 45 and name HB% )
(( segid " " and resid 93 and name HB2 ))
3.400 1.500 1.500 peak 1443 spectrum 1 weight 0.10000E+01 volume 0.76918E-03 ppm1 1.144 ppm2 1.637 CV 1
OR { 1443}
( segid " " and resid 45 and name HB% )
(( segid " " and resid 93 and name HB3 ))
ASSI { 1444}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HB2 ))
2.600 0.900 0.900 peak 1444 spectrum 1 weight 0.10000E+01 volume 0.30937E-02 ppm1 3.381 ppm2 1.780 CV 1
ASSI { 1445}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HG3 ))
2.800 1.000 1.000 peak 1445 spectrum 1 weight 0.10000E+01 volume 0.27789E-02 ppm1 3.378 ppm2 1.570 CV 1
OR { 1445}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HG2 ))
ASSI { 1446}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 51 and name HA ))
3.500 1.500 1.500 peak 1446 spectrum 1 weight 0.10000E+01 volume 0.14011E-02 ppm1 3.379 ppm2 4.223 CV 1
ASSI { 1450}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 59 and name HD3 ))
3.100 3.100 2.900 peak 1450 spectrum 1 weight 0.10000E+01 volume 0.29921E-02 ppm1 3.380 ppm2 3.672 CV 1
ASSI { 1452}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 53 and name HB3 ))
3.800 3.800 2.200 peak 1452 spectrum 1 weight 0.10000E+01 volume 0.57065E-03 ppm1 3.370 ppm2 3.187 CV 1
ASSI { 1454}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 94 and name HA ))
3.800 3.800 2.200 peak 1454 spectrum 1 weight 0.10000E+01 volume 0.13538E-02 ppm1 4.101 ppm2 4.348 CV 1
ASSI { 1457}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 46 and name HA ))
4.200 2.200 1.800 peak 1457 spectrum 1 weight 0.10000E+01 volume 0.50321E-03 ppm1 4.102 ppm2 3.392 CV 1
ASSI { 1459}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 45 and name HA ))
3.800 1.800 1.800 peak 1459 spectrum 1 weight 0.10000E+01 volume 0.10990E-02 ppm1 3.805 ppm2 4.109 CV 1
ASSI { 1460}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 17 and name HN ))
4.700 2.700 1.300 peak 1460 spectrum 1 weight 0.10000E+01 volume 0.45205E-03 ppm1 1.699 ppm2 8.804 CV 1
OR { 1460}
(( segid " " and resid 16 and name HD3 ))
(( segid " " and resid 17 and name HN ))
ASSI { 1461}
(( segid " " and resid 42 and name HD3 ))
(( segid " " and resid 42 and name HN ))
4.700 2.800 1.300 peak 1461 spectrum 1 weight 0.10000E+01 volume 0.41483E-03 ppm1 1.786 ppm2 8.774 CV 1
ASSI { 1463}
(( segid " " and resid 46 and name HB3 ))
(( segid " " and resid 46 and name HN ))
3.000 1.100 1.100 peak 1463 spectrum 1 weight 0.10000E+01 volume 0.15733E-02 ppm1 1.691 ppm2 8.486 CV 1
ASSI { 1465}
(( segid " " and resid 42 and name HD2 ))
(( segid " " and resid 42 and name HN ))
4.800 2.900 1.200 peak 1465 spectrum 1 weight 0.10000E+01 volume 0.38722E-03 ppm1 1.812 ppm2 8.748 CV 1
OR { 1465}
(( segid " " and resid 42 and name HD3 ))
(( segid " " and resid 42 and name HN ))
ASSI { 1466}
(( segid " " and resid 14 and name HD2 ))
(( segid " " and resid 14 and name HN ))
4.600 2.600 1.400 peak 1466 spectrum 1 weight 0.10000E+01 volume 0.40498E-03 ppm1 1.730 ppm2 8.737 CV 1
OR { 1466}
(( segid " " and resid 14 and name HD3 ))
(( segid " " and resid 14 and name HN ))
ASSI { 1470}
(( segid " " and resid 46 and name HB3 ))
(( segid " " and resid 46 and name HA ))
3.300 1.300 1.300 peak 1470 spectrum 1 weight 0.10000E+01 volume 0.13962E-02 ppm1 1.688 ppm2 3.370 CV 1
ASSI { 1476}
(( segid " " and resid 62 and name HD2 ))
(( segid " " and resid 22 and name HG2 ))
3.900 1.900 1.900 peak 1476 spectrum 1 weight 0.10000E+01 volume 0.73318E-03 ppm1 1.717 ppm2 2.350 CV 1
OR { 1476}
(( segid " " and resid 62 and name HD3 ))
(( segid " " and resid 22 and name HG2 ))
ASSI { 1478}
(( segid " " and resid 42 and name HD3 ))
(( segid " " and resid 42 and name HB2 ))
2.900 1.000 1.000 peak 1478 spectrum 1 weight 0.10000E+01 volume 0.34274E-02 ppm1 1.779 ppm2 2.054 CV 1
ASSI { 1485}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 93 and name HA ))
3.500 3.500 2.500 peak 1485 spectrum 1 weight 0.10000E+01 volume 0.27488E-02 ppm1 4.079 ppm2 4.488 CV 1
ASSI { 1486}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 51 and name HA ))
2.900 2.900 3.100 peak 1486 spectrum 1 weight 0.10000E+01 volume 0.29827E-02 ppm1 4.078 ppm2 4.223 CV 1
ASSI { 1490}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 50 and name HB2 ))
4.400 2.400 1.600 peak 1490 spectrum 1 weight 0.10000E+01 volume 0.42556E-03 ppm1 4.075 ppm2 2.073 CV 1
ASSI { 1491}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HB3 ))
2.300 0.700 0.700 peak 1491 spectrum 1 weight 0.10000E+01 volume 0.84391E-02 ppm1 4.078 ppm2 1.758 CV 1
OR { 1491}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HB2 ))
OR { 1491}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HG3 ))
ASSI { 1492}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 93 and name HB3 ))
4.500 2.500 1.500 peak 1492 spectrum 1 weight 0.10000E+01 volume 0.57300E-03 ppm1 4.081 ppm2 1.637 CV 1
OR { 1492}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 93 and name HB2 ))
ASSI { 1493}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 46 and name HG2 ))
3.800 1.800 1.800 peak 1493 spectrum 1 weight 0.10000E+01 volume 0.57826E-03 ppm1 4.080 ppm2 1.553 CV 1
OR { 1493}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 46 and name HG3 ))
ASSI { 1496}
(( segid " " and resid 47 and name HB3 ))
(( segid " " and resid 47 and name HA ))
2.700 0.900 0.900 peak 1496 spectrum 1 weight 0.10000E+01 volume 0.34268E-02 ppm1 1.755 ppm2 4.080 CV 1
OR { 1496}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 47 and name HA ))
ASSI { 1499}
(( segid " " and resid 47 and name HB2 ))
( segid " " and resid 45 and name HB% )
3.900 1.900 1.900 peak 1499 spectrum 1 weight 0.10000E+01 volume 0.53673E-03 ppm1 1.765 ppm2 1.163 CV 1
OR { 1499}
(( segid " " and resid 47 and name HB3 ))
( segid " " and resid 45 and name HB% )
ASSI { 1501}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 48 and name HN ))
3.300 1.400 1.400 peak 1501 spectrum 1 weight 0.10000E+01 volume 0.93158E-03 ppm1 1.756 ppm2 7.799 CV 1
OR { 1501}
(( segid " " and resid 47 and name HB3 ))
(( segid " " and resid 48 and name HN ))
ASSI { 1502}
( segid " " and resid 91 and name HD1%)
(( segid " " and resid 91 and name HB ))
2.400 0.700 0.700 peak 1502 spectrum 1 weight 0.10000E+01 volume 0.67417E-02 ppm1 0.704 ppm2 1.930 CV 1
ASSI { 1504}
( segid " " and resid 91 and name HD1%)
(( segid " " and resid 91 and name HG13))
2.400 0.700 0.700 peak 1504 spectrum 1 weight 0.10000E+01 volume 0.62885E-02 ppm1 0.704 ppm2 1.385 CV 1
ASSI { 1505}
( segid " " and resid 91 and name HD1%)
(( segid " " and resid 39 and name HG ))
2.500 2.500 3.500 peak 1505 spectrum 1 weight 0.10000E+01 volume 0.25703E-02 ppm1 0.704 ppm2 1.198 CV 1
ASSI { 1507}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 12 and name HG13))
2.200 0.600 0.600 peak 1507 spectrum 1 weight 0.10000E+01 volume 0.93288E-02 ppm1 0.802 ppm2 1.503 CV 1
ASSI { 1509}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 87 and name HB3 ))
3.400 3.400 2.600 peak 1509 spectrum 1 weight 0.10000E+01 volume 0.12320E-02 ppm1 0.803 ppm2 1.097 CV 1
ASSI { 1510}
( segid " " and resid 91 and name HD1%)
(( segid " " and resid 74 and name HG3 ))
2.900 1.100 1.100 peak 1510 spectrum 1 weight 0.10000E+01 volume 0.91865E-03 ppm1 0.704 ppm2 2.311 CV 1
ASSI { 1511}
( segid " " and resid 91 and name HD1%)
(( segid " " and resid 74 and name HG2 ))
3.000 1.100 1.100 peak 1511 spectrum 1 weight 0.10000E+01 volume 0.13215E-02 ppm1 0.704 ppm2 2.188 CV 1
ASSI { 1512}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 74 and name HG2 ))
3.700 1.700 1.700 peak 1512 spectrum 1 weight 0.10000E+01 volume 0.53881E-03 ppm1 0.802 ppm2 2.181 CV 1
ASSI { 1513}
( segid " " and resid 91 and name HD1%)
( segid " " and resid 89 and name HG2%)
2.500 2.500 3.500 peak 1513 spectrum 1 weight 0.10000E+01 volume 0.23272E-02 ppm1 0.704 ppm2 0.994 CV 1
ASSI { 1515}
( segid " " and resid 91 and name HD1%)
( segid " " and resid 71 and name HG2%)
3.100 3.100 2.900 peak 1515 spectrum 1 weight 0.10000E+01 volume 0.66071E-03 ppm1 0.703 ppm2 0.401 CV 1
ASSI { 1517}
( segid " " and resid 12 and name HD1%)
( segid " " and resid 73 and name HG2%)
3.100 1.200 1.200 peak 1517 spectrum 1 weight 0.10000E+01 volume 0.25470E-02 ppm1 0.801 ppm2 0.602 CV 1
ASSI { 1520}
( segid " " and resid 91 and name HD1%)
(( segid " " and resid 91 and name HA ))
3.100 1.200 1.200 peak 1520 spectrum 1 weight 0.10000E+01 volume 0.39750E-02 ppm1 0.704 ppm2 4.097 CV 1
ASSI { 1522}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 12 and name HA ))
3.100 1.200 1.200 peak 1522 spectrum 1 weight 0.10000E+01 volume 0.12197E-02 ppm1 0.803 ppm2 4.734 CV 1
ASSI { 1526}
( segid " " and resid 91 and name HD1%)
(( segid " " and resid 91 and name HN ))
3.100 1.200 1.200 peak 1526 spectrum 1 weight 0.10000E+01 volume 0.15738E-02 ppm1 0.704 ppm2 7.672 CV 1
ASSI { 1528}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 73 and name HN ))
3.800 1.800 1.800 peak 1528 spectrum 1 weight 0.10000E+01 volume 0.49228E-03 ppm1 0.800 ppm2 9.062 CV 1
ASSI { 1531}
( segid " " and resid 72 and name HD1%)
(( segid " " and resid 14 and name HN ))
3.300 3.300 2.700 peak 1531 spectrum 1 weight 0.10000E+01 volume 0.43917E-03 ppm1 0.884 ppm2 8.744 CV 1
ASSI { 1532}
( segid " " and resid 72 and name HD1%)
(( segid " " and resid 72 and name HN ))
3.400 1.400 1.400 peak 1532 spectrum 1 weight 0.10000E+01 volume 0.11318E-02 ppm1 0.886 ppm2 7.293 CV 1
ASSI { 1534}
( segid " " and resid 72 and name HD1%)
(( segid " " and resid 72 and name HA ))
2.500 0.800 0.800 peak 1534 spectrum 1 weight 0.10000E+01 volume 0.43535E-02 ppm1 0.885 ppm2 4.901 CV 1
ASSI { 1535}
( segid " " and resid 72 and name HD1%)
(( segid " " and resid 71 and name HA ))
3.900 1.900 1.900 peak 1535 spectrum 1 weight 0.10000E+01 volume 0.52436E-03 ppm1 0.886 ppm2 4.662 CV 1
ASSI { 1538}
( segid " " and resid 72 and name HD1%)
(( segid " " and resid 70 and name HG3 ))
3.400 1.400 1.400 peak 1538 spectrum 1 weight 0.10000E+01 volume 0.61700E-03 ppm1 0.886 ppm2 2.138 CV 1
ASSI { 1539}
( segid " " and resid 72 and name HD1%)
(( segid " " and resid 70 and name HB2 ))
3.400 1.400 1.400 peak 1539 spectrum 1 weight 0.10000E+01 volume 0.62218E-03 ppm1 0.886 ppm2 2.049 CV 1
ASSI { 1540}
( segid " " and resid 72 and name HD1%)
(( segid " " and resid 72 and name HB ))
2.900 1.100 1.100 peak 1540 spectrum 1 weight 0.10000E+01 volume 0.44403E-02 ppm1 0.886 ppm2 1.907 CV 1
ASSI { 1541}
( segid " " and resid 72 and name HD1%)
(( segid " " and resid 14 and name HD3 ))
2.700 0.900 0.900 peak 1541 spectrum 1 weight 0.10000E+01 volume 0.37952E-02 ppm1 0.885 ppm2 1.728 CV 1
OR { 1541}
( segid " " and resid 72 and name HD1%)
(( segid " " and resid 14 and name HD2 ))
ASSI { 1542}
( segid " " and resid 72 and name HD1%)
(( segid " " and resid 72 and name HG13))
2.300 0.700 0.700 peak 1542 spectrum 1 weight 0.10000E+01 volume 0.65869E-02 ppm1 0.886 ppm2 1.632 CV 1
ASSI { 1543}
( segid " " and resid 72 and name HD1%)
(( segid " " and resid 14 and name HG2 ))
2.800 1.000 1.000 peak 1543 spectrum 1 weight 0.10000E+01 volume 0.26389E-02 ppm1 0.886 ppm2 1.491 CV 1
ASSI { 1544}
( segid " " and resid 72 and name HD1%)
(( segid " " and resid 14 and name HG3 ))
2.800 2.800 3.200 peak 1544 spectrum 1 weight 0.10000E+01 volume 0.30790E-02 ppm1 0.885 ppm2 1.403 CV 1
ASSI { 1545}
( segid " " and resid 72 and name HD1%)
(( segid " " and resid 72 and name HG12))
2.300 0.600 0.600 peak 1545 spectrum 1 weight 0.10000E+01 volume 0.70847E-02 ppm1 0.886 ppm2 1.272 CV 1
ASSI { 1548}
( segid " " and resid 72 and name HD1%)
( segid " " and resid 12 and name HG2%)
1.600 1.600 4.400 peak 1548 spectrum 1 weight 0.10000E+01 volume 0.36708E-01 ppm1 0.886 ppm2 0.763 CV 1
ASSI { 1549}
( segid " " and resid 72 and name HD1%)
( segid " " and resid 71 and name HG2%)
3.300 1.400 1.400 peak 1549 spectrum 1 weight 0.10000E+01 volume 0.42743E-03 ppm1 0.891 ppm2 0.355 CV 1
ASSI { 1550}
( segid " " and resid 41 and name HD2%)
(( segid " " and resid 61 and name HN ))
3.300 3.300 2.700 peak 1550 spectrum 1 weight 0.10000E+01 volume 0.64419E-03 ppm1 0.908 ppm2 9.556 CV 1
ASSI { 1553}
( segid " " and resid 41 and name HD2%)
(( segid " " and resid 60 and name HA ))
3.700 1.700 1.700 peak 1553 spectrum 1 weight 0.10000E+01 volume 0.62644E-03 ppm1 0.908 ppm2 4.977 CV 1
ASSI { 1556}
( segid " " and resid 41 and name HD2%)
(( segid " " and resid 25 and name HB2 ))
3.400 1.400 1.400 peak 1556 spectrum 1 weight 0.10000E+01 volume 0.11155E-02 ppm1 0.909 ppm2 2.332 CV 1
ASSI { 1557}
( segid " " and resid 41 and name HD2%)
(( segid " " and resid 25 and name HB3 ))
3.100 1.200 1.200 peak 1557 spectrum 1 weight 0.10000E+01 volume 0.12339E-02 ppm1 0.908 ppm2 2.215 CV 1
ASSI { 1558}
( segid " " and resid 41 and name HD2%)
(( segid " " and resid 41 and name HB3 ))
2.500 0.800 0.800 peak 1558 spectrum 1 weight 0.10000E+01 volume 0.33967E-02 ppm1 0.908 ppm2 2.001 CV 1
ASSI { 1561}
( segid " " and resid 41 and name HD2%)
(( segid " " and resid 62 and name HG2 ))
3.400 3.400 2.600 peak 1561 spectrum 1 weight 0.10000E+01 volume 0.13671E-02 ppm1 0.910 ppm2 1.509 CV 1
ASSI { 1562}
( segid " " and resid 41 and name HD2%)
(( segid " " and resid 41 and name HB2 ))
2.700 0.900 0.900 peak 1562 spectrum 1 weight 0.10000E+01 volume 0.31038E-02 ppm1 0.909 ppm2 1.395 CV 1
ASSI { 1565}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 66 and name HN ))
4.100 2.100 1.900 peak 1565 spectrum 1 weight 0.10000E+01 volume 0.46024E-03 ppm1 0.530 ppm2 8.017 CV 1
ASSI { 1575}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 17 and name HA ))
2.700 0.900 0.900 peak 1575 spectrum 1 weight 0.10000E+01 volume 0.30700E-02 ppm1 0.529 ppm2 4.290 CV 1
ASSI { 1576}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 17 and name HB ))
2.900 1.100 1.100 peak 1576 spectrum 1 weight 0.10000E+01 volume 0.18311E-02 ppm1 0.530 ppm2 2.387 CV 1
ASSI { 1577}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 69 and name HB2 ))
4.100 2.100 1.900 peak 1577 spectrum 1 weight 0.10000E+01 volume 0.11073E-02 ppm1 0.530 ppm2 2.283 CV 1
ASSI { 1579}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 69 and name HB3 ))
2.900 1.000 1.000 peak 1579 spectrum 1 weight 0.10000E+01 volume 0.13166E-02 ppm1 0.530 ppm2 2.067 CV 1
ASSI { 1580}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 17 and name HG12))
2.400 0.700 0.700 peak 1580 spectrum 1 weight 0.10000E+01 volume 0.39395E-02 ppm1 0.529 ppm2 1.536 CV 1
ASSI { 1581}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 17 and name HG13))
2.400 0.700 0.700 peak 1581 spectrum 1 weight 0.10000E+01 volume 0.44332E-02 ppm1 0.529 ppm2 1.344 CV 1
ASSI { 1584}
( segid " " and resid 17 and name HD1%)
( segid " " and resid 18 and name HG2%)
3.800 1.800 1.800 peak 1584 spectrum 1 weight 0.10000E+01 volume 0.16325E-02 ppm1 0.529 ppm2 1.006 CV 1
ASSI { 1586}
( segid " " and resid 17 and name HD1%)
( segid " " and resid 17 and name HG2%)
2.300 2.300 3.700 peak 1586 spectrum 1 weight 0.10000E+01 volume 0.27339E-01 ppm1 0.529 ppm2 0.756 CV 1
ASSI { 1587}
( segid " " and resid 17 and name HD1%)
( segid " " and resid 71 and name HG1%)
2.300 0.700 0.700 peak 1587 spectrum 1 weight 0.10000E+01 volume 0.70115E-02 ppm1 0.528 ppm2 0.333 CV 1
ASSI { 1590}
( segid " " and resid 41 and name HD2%)
( segid " " and resid 64 and name HG2%)
3.600 1.600 1.600 peak 1590 spectrum 1 weight 0.10000E+01 volume 0.13764E-02 ppm1 0.909 ppm2 0.382 CV 1
ASSI { 1593}
( segid " " and resid 75 and name HD1%)
(( segid " " and resid 75 and name HB ))
3.000 1.100 1.100 peak 1593 spectrum 1 weight 0.10000E+01 volume 0.31996E-02 ppm1 0.786 ppm2 1.955 CV 1
ASSI { 1595}
( segid " " and resid 75 and name HD1%)
(( segid " " and resid 75 and name HG13))
2.300 0.700 0.700 peak 1595 spectrum 1 weight 0.10000E+01 volume 0.67622E-02 ppm1 0.783 ppm2 1.512 CV 1
ASSI { 1596}
( segid " " and resid 75 and name HD1%)
(( segid " " and resid 87 and name HB3 ))
3.100 1.200 1.200 peak 1596 spectrum 1 weight 0.10000E+01 volume 0.95848E-03 ppm1 0.785 ppm2 1.114 CV 1
ASSI { 1597}
( segid " " and resid 75 and name HD1%)
(( segid " " and resid 75 and name HG12))
2.100 0.600 0.600 peak 1597 spectrum 1 weight 0.10000E+01 volume 0.11918E-01 ppm1 0.786 ppm2 0.981 CV 1
ASSI { 1600}
( segid " " and resid 75 and name HD1%)
( segid " " and resid 39 and name HD2%)
3.800 3.800 2.200 peak 1600 spectrum 1 weight 0.10000E+01 volume 0.76514E-03 ppm1 0.784 ppm2 0.314 CV 1
ASSI { 1601}
( segid " " and resid 75 and name HD1%)
( segid " " and resid 87 and name HD2%)
2.600 0.800 0.800 peak 1601 spectrum 1 weight 0.10000E+01 volume 0.34594E-02 ppm1 0.787 ppm2 0.199 CV 1
ASSI { 1603}
( segid " " and resid 75 and name HD1%)
(( segid " " and resid 85 and name HA ))
4.000 2.000 2.000 peak 1603 spectrum 1 weight 0.10000E+01 volume 0.55475E-03 ppm1 0.780 ppm2 4.266 CV 1
ASSI { 1604}
( segid " " and resid 75 and name HD1%)
(( segid " " and resid 75 and name HA ))
2.900 1.100 1.100 peak 1604 spectrum 1 weight 0.10000E+01 volume 0.14946E-02 ppm1 0.786 ppm2 3.948 CV 1
ASSI { 1605}
( segid " " and resid 75 and name HD1%)
(( segid " " and resid 76 and name HN ))
4.800 2.800 1.200 peak 1605 spectrum 1 weight 0.10000E+01 volume 0.51164E-03 ppm1 0.788 ppm2 9.254 CV 1
ASSI { 1608}
( segid " " and resid 75 and name HD1%)
( segid " " and resid 13 and name HE% )
2.400 2.400 3.600 peak 1608 spectrum 1 weight 0.10000E+01 volume 0.26902E-02 ppm1 0.786 ppm2 6.883 CV 1
ASSI { 1610}
( segid " " and resid 75 and name HD1%)
( segid " " and resid 31 and name HE% )
3.000 1.100 1.100 peak 1610 spectrum 1 weight 0.10000E+01 volume 0.19740E-02 ppm1 0.786 ppm2 6.392 CV 1
ASSI { 1612}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 67 and name HG3 ))
3.000 1.100 1.100 peak 1612 spectrum 1 weight 0.10000E+01 volume 0.30041E-02 ppm1 0.685 ppm2 2.264 CV 1
OR { 1612}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 67 and name HG2 ))
ASSI { 1614}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 67 and name HB3 ))
4.300 2.300 1.700 peak 1614 spectrum 1 weight 0.10000E+01 volume 0.10370E-02 ppm1 0.686 ppm2 1.965 CV 1
OR { 1614}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 67 and name HB2 ))
ASSI { 1615}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 20 and name HB ))
2.300 0.700 0.700 peak 1615 spectrum 1 weight 0.10000E+01 volume 0.62786E-02 ppm1 0.685 ppm2 1.828 CV 1
ASSI { 1618}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 20 and name HG12))
2.100 0.500 0.500 peak 1618 spectrum 1 weight 0.10000E+01 volume 0.92836E-02 ppm1 0.685 ppm2 1.449 CV 1
ASSI { 1620}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 61 and name HG13))
3.600 1.600 1.600 peak 1620 spectrum 1 weight 0.10000E+01 volume 0.11177E-02 ppm1 0.685 ppm2 1.055 CV 1
ASSI { 1621}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 20 and name HG13))
1.800 0.400 0.400 peak 1621 spectrum 1 weight 0.10000E+01 volume 0.25306E-01 ppm1 0.686 ppm2 0.834 CV 1
ASSI { 1624}
( segid " " and resid 20 and name HD1%)
( segid " " and resid 71 and name HG1%)
4.000 2.000 2.000 peak 1624 spectrum 1 weight 0.10000E+01 volume 0.97360E-03 ppm1 0.684 ppm2 0.329 CV 1
ASSI { 1626}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 66 and name HA ))
2.500 0.800 0.800 peak 1626 spectrum 1 weight 0.10000E+01 volume 0.42689E-02 ppm1 0.686 ppm2 4.577 CV 1
ASSI { 1628}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 62 and name HA ))
3.300 1.300 1.300 peak 1628 spectrum 1 weight 0.10000E+01 volume 0.21481E-02 ppm1 0.685 ppm2 4.179 CV 1
ASSI { 1629}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 67 and name HA ))
4.400 2.400 1.600 peak 1629 spectrum 1 weight 0.10000E+01 volume 0.91256E-03 ppm1 0.686 ppm2 3.648 CV 1
ASSI { 1634}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 66 and name HN ))
3.400 1.500 1.500 peak 1634 spectrum 1 weight 0.10000E+01 volume 0.83974E-03 ppm1 0.685 ppm2 8.019 CV 1
ASSI { 1636}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 65 and name HA ))
4.100 2.100 1.900 peak 1636 spectrum 1 weight 0.10000E+01 volume 0.53712E-03 ppm1 0.685 ppm2 5.107 CV 1
ASSI { 1637}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 27 and name HA ))
4.500 2.500 1.500 peak 1637 spectrum 1 weight 0.10000E+01 volume 0.71162E-03 ppm1 0.686 ppm2 5.004 CV 1
ASSI { 1638}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 19 and name HA ))
4.100 2.100 1.900 peak 1638 spectrum 1 weight 0.10000E+01 volume 0.56186E-03 ppm1 0.685 ppm2 4.727 CV 1
ASSI { 1639}
( segid " " and resid 44 and name HD1%)
(( segid " " and resid 41 and name HA ))
2.700 0.900 0.900 peak 1639 spectrum 1 weight 0.10000E+01 volume 0.34854E-02 ppm1 0.578 ppm2 3.925 CV 1
ASSI { 1640}
( segid " " and resid 44 and name HD1%)
(( segid " " and resid 44 and name HB ))
2.800 1.000 1.000 peak 1640 spectrum 1 weight 0.10000E+01 volume 0.26221E-02 ppm1 0.579 ppm2 2.116 CV 1
ASSI { 1641}
( segid " " and resid 44 and name HD1%)
(( segid " " and resid 44 and name HG12))
2.400 0.700 0.700 peak 1641 spectrum 1 weight 0.10000E+01 volume 0.49248E-02 ppm1 0.580 ppm2 1.845 CV 1
ASSI { 1642}
( segid " " and resid 44 and name HD1%)
(( segid " " and resid 65 and name HB3 ))
3.400 1.400 1.400 peak 1642 spectrum 1 weight 0.10000E+01 volume 0.30460E-02 ppm1 0.579 ppm2 1.196 CV 1
ASSI { 1645}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 61 and name HA ))
3.300 1.300 1.300 peak 1645 spectrum 1 weight 0.10000E+01 volume 0.29172E-02 ppm1 0.573 ppm2 3.793 CV 1
ASSI { 1646}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 25 and name HB2 ))
3.300 1.300 1.300 peak 1646 spectrum 1 weight 0.10000E+01 volume 0.47483E-03 ppm1 0.572 ppm2 2.327 CV 1
OR { 1646}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 25 and name HG2 ))
OR { 1646}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 25 and name HG3 ))
ASSI { 1648}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 41 and name HB3 ))
3.700 1.700 1.700 peak 1648 spectrum 1 weight 0.10000E+01 volume 0.13705E-02 ppm1 0.573 ppm2 1.991 CV 1
ASSI { 1649}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 61 and name HB ))
2.400 0.700 0.700 peak 1649 spectrum 1 weight 0.10000E+01 volume 0.39680E-02 ppm1 0.573 ppm2 1.707 CV 1
ASSI { 1651}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 61 and name HG13))
2.400 0.700 0.700 peak 1651 spectrum 1 weight 0.10000E+01 volume 0.42417E-02 ppm1 0.573 ppm2 1.067 CV 1
ASSI { 1652}
( segid " " and resid 61 and name HD1%)
( segid " " and resid 61 and name HG2%)
1.700 0.400 0.500 peak 1652 spectrum 1 weight 0.10000E+01 volume 0.36761E-01 ppm1 0.573 ppm2 0.894 CV 1
ASSI { 1653}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 26 and name HA ))
2.600 0.800 0.800 peak 1653 spectrum 1 weight 0.10000E+01 volume 0.26299E-02 ppm1 0.573 ppm2 4.652 CV 1
ASSI { 1654}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 40 and name HA ))
2.900 2.900 3.100 peak 1654 spectrum 1 weight 0.10000E+01 volume 0.94924E-03 ppm1 0.573 ppm2 4.425 CV 1
ASSI { 1655}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 20 and name HA ))
3.700 1.800 1.800 peak 1655 spectrum 1 weight 0.10000E+01 volume 0.67566E-03 ppm1 0.573 ppm2 4.288 CV 1
ASSI { 1657}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 27 and name HA ))
3.900 1.900 1.900 peak 1657 spectrum 1 weight 0.10000E+01 volume 0.69759E-03 ppm1 0.572 ppm2 4.983 CV 1
ASSI { 1658}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 61 and name HN ))
4.600 2.600 1.400 peak 1658 spectrum 1 weight 0.10000E+01 volume 0.50905E-03 ppm1 0.569 ppm2 9.561 CV 1
ASSI { 1661}
( segid " " and resid 61 and name HG2%)
(( segid " " and resid 21 and name HN ))
3.900 1.900 1.900 peak 1661 spectrum 1 weight 0.10000E+01 volume 0.42952E-03 ppm1 0.875 ppm2 8.827 CV 1
ASSI { 1675}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 77 and name HA ))
3.300 1.400 1.400 peak 1675 spectrum 1 weight 0.10000E+01 volume 0.13580E-02 ppm1 0.847 ppm2 4.534 CV 1
ASSI { 1676}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 84 and name HA1 ))
3.500 3.500 2.500 peak 1676 spectrum 1 weight 0.10000E+01 volume 0.12691E-02 ppm1 0.847 ppm2 4.329 CV 1
ASSI { 1677}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 85 and name HA ))
2.700 0.900 0.900 peak 1677 spectrum 1 weight 0.10000E+01 volume 0.37071E-02 ppm1 0.846 ppm2 4.246 CV 1
ASSI { 1678}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 75 and name HA ))
2.600 0.800 0.800 peak 1678 spectrum 1 weight 0.10000E+01 volume 0.35910E-02 ppm1 0.845 ppm2 3.945 CV 1
ASSI { 1682}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 78 and name HG3 ))
3.000 1.200 1.200 peak 1682 spectrum 1 weight 0.10000E+01 volume 0.19968E-02 ppm1 0.846 ppm2 2.354 CV 1
OR { 1682}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 78 and name HG2 ))
ASSI { 1683}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 75 and name HB ))
2.300 0.600 0.600 peak 1683 spectrum 1 weight 0.10000E+01 volume 0.80045E-02 ppm1 0.845 ppm2 1.953 CV 1
ASSI { 1686}
( segid " " and resid 75 and name HG2%)
( segid " " and resid 87 and name HD2%)
3.700 1.700 1.700 peak 1686 spectrum 1 weight 0.10000E+01 volume 0.14462E-02 ppm1 0.845 ppm2 0.190 CV 1
ASSI { 1697}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 48 and name HB3 ))
3.200 1.300 1.300 peak 1697 spectrum 1 weight 0.10000E+01 volume 0.17749E-02 ppm1 0.832 ppm2 3.076 CV 1
ASSI { 1699}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 48 and name HB2 ))
2.500 0.800 0.800 peak 1699 spectrum 1 weight 0.10000E+01 volume 0.25740E-02 ppm1 0.828 ppm2 2.725 CV 1
ASSI { 1700}
( segid " " and resid 72 and name HG2%)
(( segid " " and resid 72 and name HA ))
2.400 0.700 0.700 peak 1700 spectrum 1 weight 0.10000E+01 volume 0.56841E-02 ppm1 0.841 ppm2 4.910 CV 1
ASSI { 1702}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 44 and name HB ))
2.300 0.700 0.700 peak 1702 spectrum 1 weight 0.10000E+01 volume 0.42453E-02 ppm1 0.830 ppm2 2.115 CV 1
ASSI { 1704}
( segid " " and resid 72 and name HG2%)
(( segid " " and resid 72 and name HG13))
2.500 0.800 0.800 peak 1704 spectrum 1 weight 0.10000E+01 volume 0.41810E-02 ppm1 0.843 ppm2 1.634 CV 1
ASSI { 1711}
( segid " " and resid 72 and name HG2%)
(( segid " " and resid 72 and name HG12))
3.300 1.300 1.300 peak 1711 spectrum 1 weight 0.10000E+01 volume 0.45889E-02 ppm1 0.841 ppm2 1.280 CV 1
ASSI { 1713}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 68 and name HA1 ))
4.500 2.600 1.500 peak 1713 spectrum 1 weight 0.10000E+01 volume 0.87409E-03 ppm1 0.773 ppm2 4.418 CV 1
ASSI { 1720}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 13 and name HA ))
3.000 1.100 1.100 peak 1720 spectrum 1 weight 0.10000E+01 volume 0.21371E-02 ppm1 0.773 ppm2 4.905 CV 1
ASSI { 1721}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 12 and name HA ))
2.700 0.900 0.900 peak 1721 spectrum 1 weight 0.10000E+01 volume 0.48679E-02 ppm1 0.773 ppm2 4.734 CV 1
ASSI { 1722}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 25 and name HA ))
3.100 1.200 1.200 peak 1722 spectrum 1 weight 0.10000E+01 volume 0.22771E-02 ppm1 2.308 ppm2 3.793 CV 1
OR { 1722}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 25 and name HA ))
ASSI { 1723}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 67 and name HN ))
3.000 1.200 1.200 peak 1723 spectrum 1 weight 0.10000E+01 volume 0.19035E-02 ppm1 0.773 ppm2 9.038 CV 1
ASSI { 1727}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 64 and name HN ))
4.000 2.000 2.000 peak 1727 spectrum 1 weight 0.10000E+01 volume 0.10479E-02 ppm1 0.831 ppm2 7.202 CV 1
ASSI { 1728}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 69 and name HN ))
4.100 2.100 1.900 peak 1728 spectrum 1 weight 0.10000E+01 volume 0.11229E-02 ppm1 0.772 ppm2 7.716 CV 1
ASSI { 1731}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 18 and name HA ))
3.400 1.400 1.400 peak 1731 spectrum 1 weight 0.10000E+01 volume 0.10270E-02 ppm1 0.773 ppm2 4.523 CV 1
ASSI { 1732}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 17 and name HA ))
2.600 0.800 0.800 peak 1732 spectrum 1 weight 0.10000E+01 volume 0.44872E-02 ppm1 0.773 ppm2 4.291 CV 1
ASSI { 1733}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 67 and name HA ))
2.200 0.600 0.600 peak 1733 spectrum 1 weight 0.10000E+01 volume 0.47921E-02 ppm1 0.774 ppm2 3.648 CV 1
ASSI { 1734}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 17 and name HB ))
2.200 0.600 0.600 peak 1734 spectrum 1 weight 0.10000E+01 volume 0.58701E-02 ppm1 0.774 ppm2 2.388 CV 1
ASSI { 1735}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 67 and name HG2 ))
2.600 0.800 0.800 peak 1735 spectrum 1 weight 0.10000E+01 volume 0.34752E-02 ppm1 0.774 ppm2 2.266 CV 1
OR { 1735}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 67 and name HG3 ))
ASSI { 1736}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 17 and name HG13))
2.300 0.700 0.700 peak 1736 spectrum 1 weight 0.10000E+01 volume 0.48744E-02 ppm1 0.774 ppm2 1.347 CV 1
ASSI { 1739}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 73 and name HB ))
4.500 2.600 1.500 peak 1739 spectrum 1 weight 0.10000E+01 volume 0.46539E-03 ppm1 0.378 ppm2 1.945 CV 1
ASSI { 1740}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 15 and name HA2 ))
3.200 1.200 1.200 peak 1740 spectrum 1 weight 0.10000E+01 volume 0.59687E-03 ppm1 0.378 ppm2 3.157 CV 1
ASSI { 1741}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 70 and name HG3 ))
3.800 1.800 1.800 peak 1741 spectrum 1 weight 0.10000E+01 volume 0.78841E-03 ppm1 0.378 ppm2 2.134 CV 1
ASSI { 1744}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 71 and name HB ))
2.600 0.800 0.800 peak 1744 spectrum 1 weight 0.10000E+01 volume 0.36213E-02 ppm1 0.375 ppm2 1.431 CV 1
ASSI { 1745}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 16 and name HG3 ))
2.700 2.700 3.300 peak 1745 spectrum 1 weight 0.10000E+01 volume 0.14365E-02 ppm1 0.388 ppm2 1.305 CV 1
ASSI { 1750}
( segid " " and resid 71 and name HG2%)
( segid " " and resid 87 and name HD2%)
3.600 1.700 1.700 peak 1750 spectrum 1 weight 0.10000E+01 volume 0.10625E-02 ppm1 0.376 ppm2 0.200 CV 1
ASSI { 1752}
( segid " " and resid 20 and name HG2%)
(( segid " " and resid 21 and name HB2 ))
4.100 2.100 1.900 peak 1752 spectrum 1 weight 0.10000E+01 volume 0.66178E-03 ppm1 0.706 ppm2 2.232 CV 1
ASSI { 1753}
( segid " " and resid 20 and name HG2%)
(( segid " " and resid 20 and name HB ))
2.200 0.600 0.600 peak 1753 spectrum 1 weight 0.10000E+01 volume 0.83481E-02 ppm1 0.706 ppm2 1.829 CV 1
ASSI { 1755}
( segid " " and resid 20 and name HG2%)
(( segid " " and resid 20 and name HG12))
2.400 0.700 0.700 peak 1755 spectrum 1 weight 0.10000E+01 volume 0.36895E-02 ppm1 0.707 ppm2 1.456 CV 1
ASSI { 1756}
( segid " " and resid 20 and name HG2%)
( segid " " and resid 24 and name HD1%)
3.400 1.400 1.400 peak 1756 spectrum 1 weight 0.10000E+01 volume 0.19047E-02 ppm1 0.707 ppm2 1.124 CV 1
ASSI { 1758}
( segid " " and resid 20 and name HG2%)
( segid " " and resid 61 and name HD1%)
2.700 0.900 0.900 peak 1758 spectrum 1 weight 0.10000E+01 volume 0.64009E-02 ppm1 0.706 ppm2 0.604 CV 1
ASSI { 1761}
( segid " " and resid 20 and name HG2%)
(( segid " " and resid 27 and name HA ))
3.800 1.800 1.800 peak 1761 spectrum 1 weight 0.10000E+01 volume 0.92015E-03 ppm1 0.707 ppm2 5.005 CV 1
ASSI { 1763}
( segid " " and resid 20 and name HG2%)
(( segid " " and resid 20 and name HA ))
2.600 0.800 0.800 peak 1763 spectrum 1 weight 0.10000E+01 volume 0.35047E-02 ppm1 0.706 ppm2 4.267 CV 1
ASSI { 1767}
( segid " " and resid 20 and name HG2%)
(( segid " " and resid 21 and name HA ))
3.600 1.600 1.600 peak 1767 spectrum 1 weight 0.10000E+01 volume 0.58596E-03 ppm1 0.707 ppm2 5.339 CV 1
ASSI { 1770}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 72 and name HA ))
3.700 1.700 1.700 peak 1770 spectrum 1 weight 0.10000E+01 volume 0.65582E-03 ppm1 0.369 ppm2 4.900 CV 1
ASSI { 1771}
( segid " " and resid 20 and name HG2%)
(( segid " " and resid 20 and name HN ))
3.800 1.800 1.800 peak 1771 spectrum 1 weight 0.10000E+01 volume 0.11376E-02 ppm1 0.707 ppm2 9.370 CV 1
ASSI { 1774}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 13 and name HN ))
3.700 1.700 1.700 peak 1774 spectrum 1 weight 0.10000E+01 volume 0.52259E-03 ppm1 0.379 ppm2 9.200 CV 1
ASSI { 1775}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 17 and name HN ))
3.100 3.100 2.900 peak 1775 spectrum 1 weight 0.10000E+01 volume 0.67729E-03 ppm1 0.377 ppm2 8.814 CV 1
ASSI { 1777}
( segid " " and resid 55 and name HB% )
(( segid " " and resid 56 and name HA ))
3.400 1.500 1.500 peak 1777 spectrum 1 weight 0.10000E+01 volume 0.13562E-02 ppm1 1.283 ppm2 4.656 CV 1
ASSI { 1778}
( segid " " and resid 55 and name HB% )
(( segid " " and resid 59 and name HA ))
3.500 1.500 1.500 peak 1778 spectrum 1 weight 0.10000E+01 volume 0.12036E-02 ppm1 1.281 ppm2 4.553 CV 1
ASSI { 1779}
( segid " " and resid 55 and name HB% )
(( segid " " and resid 54 and name HA ))
4.600 2.700 1.400 peak 1779 spectrum 1 weight 0.10000E+01 volume 0.66216E-03 ppm1 1.283 ppm2 4.355 CV 1
ASSI { 1783}
( segid " " and resid 55 and name HB% )
(( segid " " and resid 59 and name HD2 ))
4.700 2.800 1.300 peak 1783 spectrum 1 weight 0.10000E+01 volume 0.43361E-03 ppm1 1.283 ppm2 3.884 CV 1
ASSI { 1784}
( segid " " and resid 55 and name HB% )
(( segid " " and resid 59 and name HG3 ))
5.100 3.200 0.900 peak 1784 spectrum 1 weight 0.10000E+01 volume 0.49407E-03 ppm1 1.280 ppm2 2.004 CV 1
OR { 1784}
( segid " " and resid 55 and name HB% )
(( segid " " and resid 59 and name HG2 ))
ASSI { 1785}
( segid " " and resid 55 and name HB% )
(( segid " " and resid 46 and name HB3 ))
3.300 3.300 2.700 peak 1785 spectrum 1 weight 0.10000E+01 volume 0.46536E-03 ppm1 1.282 ppm2 1.706 CV 1
ASSI { 1789}
( segid " " and resid 45 and name HB% )
(( segid " " and resid 95 and name HA1 ))
3.800 3.800 2.200 peak 1789 spectrum 1 weight 0.10000E+01 volume 0.13048E-02 ppm1 1.146 ppm2 3.995 CV 1
OR { 1789}
( segid " " and resid 45 and name HB% )
(( segid " " and resid 95 and name HA2 ))
ASSI { 1790}
( segid " " and resid 45 and name HB% )
(( segid " " and resid 44 and name HA ))
4.300 2.300 1.700 peak 1790 spectrum 1 weight 0.10000E+01 volume 0.82297E-03 ppm1 1.145 ppm2 3.802 CV 1
ASSI { 1796}
( segid " " and resid 94 and name HB% )
(( segid " " and resid 95 and name HA1 ))
3.800 1.800 1.800 peak 1796 spectrum 1 weight 0.10000E+01 volume 0.83002E-03 ppm1 1.433 ppm2 4.029 CV 1
OR { 1796}
( segid " " and resid 94 and name HB% )
(( segid " " and resid 95 and name HA2 ))
ASSI { 1801}
( segid " " and resid 94 and name HB% )
( segid " " and resid 55 and name HB% )
1.400 1.400 4.600 peak 1801 spectrum 1 weight 0.10000E+01 volume 0.64376E-01 ppm1 1.435 ppm2 1.309 CV 1
ASSI { 1806}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 90 and name HB3 ))
3.600 1.700 1.700 peak 1806 spectrum 1 weight 0.10000E+01 volume 0.75960E-03 ppm1 1.145 ppm2 3.083 CV 1
OR { 1806}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 90 and name HB2 ))
ASSI { 1807}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 76 and name HB3 ))
3.200 1.300 1.300 peak 1807 spectrum 1 weight 0.10000E+01 volume 0.57826E-03 ppm1 1.140 ppm2 2.553 CV 1
ASSI { 1808}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 74 and name HG3 ))
2.800 0.900 0.900 peak 1808 spectrum 1 weight 0.10000E+01 volume 0.24105E-02 ppm1 1.142 ppm2 2.313 CV 1
ASSI { 1809}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 74 and name HG2 ))
3.300 1.300 1.300 peak 1809 spectrum 1 weight 0.10000E+01 volume 0.12211E-02 ppm1 1.143 ppm2 2.194 CV 1
ASSI { 1812}
( segid " " and resid 88 and name HG2%)
( segid " " and resid 93 and name HD1%)
2.400 2.400 3.600 peak 1812 spectrum 1 weight 0.10000E+01 volume 0.11275E-01 ppm1 1.142 ppm2 0.923 CV 1
ASSI { 1813}
( segid " " and resid 88 and name HG2%)
( segid " " and resid 91 and name HD1%)
3.100 1.200 1.200 peak 1813 spectrum 1 weight 0.10000E+01 volume 0.15830E-02 ppm1 1.142 ppm2 0.701 CV 1
ASSI { 1814}
( segid " " and resid 88 and name HG2%)
( segid " " and resid 73 and name HG1%)
2.800 1.000 1.000 peak 1814 spectrum 1 weight 0.10000E+01 volume 0.41215E-02 ppm1 1.143 ppm2 0.559 CV 1
ASSI { 1815}
( segid " " and resid 85 and name HB% )
(( segid " " and resid 37 and name HA1 ))
3.300 1.400 1.400 peak 1815 spectrum 1 weight 0.10000E+01 volume 0.85561E-03 ppm1 1.470 ppm2 5.150 CV 1
ASSI { 1816}
( segid " " and resid 85 and name HB% )
(( segid " " and resid 86 and name HA ))
3.700 1.700 1.700 peak 1816 spectrum 1 weight 0.10000E+01 volume 0.78772E-03 ppm1 1.458 ppm2 4.976 CV 1
ASSI { 1818}
( segid " " and resid 33 and name HB% )
(( segid " " and resid 33 and name HA ))
2.300 0.600 0.600 peak 1818 spectrum 1 weight 0.10000E+01 volume 0.89620E-02 ppm1 1.103 ppm2 4.486 CV 1
ASSI { 1820}
( segid " " and resid 33 and name HB% )
(( segid " " and resid 85 and name HA ))
3.800 1.800 1.800 peak 1820 spectrum 1 weight 0.10000E+01 volume 0.67611E-03 ppm1 1.108 ppm2 4.266 CV 1
ASSI { 1821}
( segid " " and resid 33 and name HB% )
(( segid " " and resid 34 and name HA ))
4.100 2.100 1.900 peak 1821 spectrum 1 weight 0.10000E+01 volume 0.70354E-03 ppm1 1.102 ppm2 3.934 CV 1
ASSI { 1822}
( segid " " and resid 33 and name HB% )
(( segid " " and resid 34 and name HB2 ))
3.900 1.900 1.900 peak 1822 spectrum 1 weight 0.10000E+01 volume 0.14116E-02 ppm1 1.103 ppm2 2.035 CV 1
OR { 1822}
( segid " " and resid 33 and name HB% )
(( segid " " and resid 34 and name HB3 ))
ASSI { 1823}
( segid " " and resid 33 and name HB% )
(( segid " " and resid 35 and name HB2 ))
3.900 1.900 1.900 peak 1823 spectrum 1 weight 0.10000E+01 volume 0.71662E-03 ppm1 1.104 ppm2 1.632 CV 1
ASSI { 1826}
( segid " " and resid 33 and name HB% )
(( segid " " and resid 32 and name HN ))
3.300 1.400 1.400 peak 1826 spectrum 1 weight 0.10000E+01 volume 0.42432E-03 ppm1 1.111 ppm2 8.241 CV 1
ASSI { 1831}
( segid " " and resid 33 and name HB% )
( segid " " and resid 31 and name HD% )
3.300 1.400 1.400 peak 1831 spectrum 1 weight 0.10000E+01 volume 0.10075E-02 ppm1 1.104 ppm2 6.585 CV 1
ASSI { 1832}
( segid " " and resid 33 and name HB% )
( segid " " and resid 31 and name HE% )
2.800 1.000 1.000 peak 1832 spectrum 1 weight 0.10000E+01 volume 0.24776E-02 ppm1 1.104 ppm2 6.391 CV 1
ASSI { 1833}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 76 and name HN ))
3.200 1.300 1.300 peak 1833 spectrum 1 weight 0.10000E+01 volume 0.50579E-03 ppm1 1.140 ppm2 9.253 CV 1
ASSI { 1839}
( segid " " and resid 10 and name HB% )
(( segid " " and resid 74 and name HE22))
3.600 1.600 1.600 peak 1839 spectrum 1 weight 0.10000E+01 volume 0.71484E-03 ppm1 1.410 ppm2 6.986 CV 1
ASSI { 1840}
( segid " " and resid 10 and name HB% )
( segid " " and resid 13 and name HE% )
4.000 2.000 2.000 peak 1840 spectrum 1 weight 0.10000E+01 volume 0.45002E-03 ppm1 1.410 ppm2 6.880 CV 1
ASSI { 1841}
( segid " " and resid 94 and name HB% )
(( segid " " and resid 95 and name HN ))
3.200 1.300 1.300 peak 1841 spectrum 1 weight 0.10000E+01 volume 0.21497E-02 ppm1 1.435 ppm2 8.375 CV 1
ASSI { 1846}
( segid " " and resid 29 and name HG2%)
(( segid " " and resid 18 and name HN ))
3.700 1.700 1.700 peak 1846 spectrum 1 weight 0.10000E+01 volume 0.84412E-03 ppm1 0.573 ppm2 9.206 CV 1
ASSI { 1851}
( segid " " and resid 65 and name HD2%)
(( segid " " and resid 65 and name HN ))
3.600 1.600 1.600 peak 1851 spectrum 1 weight 0.10000E+01 volume 0.10485E-02 ppm1 0.621 ppm2 7.162 CV 1
ASSI { 1852}
( segid " " and resid 29 and name HG2%)
(( segid " " and resid 28 and name HA ))
3.500 1.500 1.500 peak 1852 spectrum 1 weight 0.10000E+01 volume 0.90879E-03 ppm1 0.571 ppm2 5.609 CV 1
ASSI { 1853}
( segid " " and resid 65 and name HD2%)
(( segid " " and resid 65 and name HA ))
2.400 0.700 0.700 peak 1853 spectrum 1 weight 0.10000E+01 volume 0.56876E-02 ppm1 0.620 ppm2 5.115 CV 1
ASSI { 1857}
( segid " " and resid 29 and name HG2%)
(( segid " " and resid 14 and name HA ))
4.300 2.300 1.700 peak 1857 spectrum 1 weight 0.10000E+01 volume 0.44557E-03 ppm1 0.575 ppm2 4.864 CV 1
ASSI { 1858}
( segid " " and resid 29 and name HG1%)
(( segid " " and resid 18 and name HN ))
4.100 2.100 1.900 peak 1858 spectrum 1 weight 0.10000E+01 volume 0.59333E-03 ppm1 0.565 ppm2 9.204 CV 1
ASSI { 1861}
( segid " " and resid 29 and name HG1%)
(( segid " " and resid 14 and name HA ))
4.400 2.400 1.600 peak 1861 spectrum 1 weight 0.10000E+01 volume 0.44988E-03 ppm1 0.563 ppm2 4.876 CV 1
ASSI { 1865}
( segid " " and resid 71 and name HG1%)
(( segid " " and resid 72 and name HA ))
4.300 2.300 1.700 peak 1865 spectrum 1 weight 0.10000E+01 volume 0.61514E-03 ppm1 0.313 ppm2 4.902 CV 1
ASSI { 1866}
( segid " " and resid 64 and name HG1%)
( segid " " and resid 48 and name HD% )
4.100 2.100 1.900 peak 1866 spectrum 1 weight 0.10000E+01 volume 0.45651E-03 ppm1 0.106 ppm2 7.289 CV 1
ASSI { 1868}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 60 and name HN ))
3.300 1.400 1.400 peak 1868 spectrum 1 weight 0.10000E+01 volume 0.73325E-03 ppm1 0.362 ppm2 8.297 CV 1
ASSI { 1872}
( segid " " and resid 64 and name HG2%)
( segid " " and resid 49 and name HD% )
3.200 1.200 1.200 peak 1872 spectrum 1 weight 0.10000E+01 volume 0.14595E-02 ppm1 0.362 ppm2 6.961 CV 1
ASSI { 1874}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 64 and name HA ))
2.500 0.800 0.800 peak 1874 spectrum 1 weight 0.10000E+01 volume 0.51115E-02 ppm1 0.362 ppm2 3.816 CV 1
ASSI { 1875}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 49 and name HB3 ))
3.200 1.300 1.300 peak 1875 spectrum 1 weight 0.10000E+01 volume 0.66041E-03 ppm1 0.363 ppm2 3.370 CV 1
ASSI { 1877}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 59 and name HB2 ))
2.900 1.100 1.100 peak 1877 spectrum 1 weight 0.10000E+01 volume 0.11494E-02 ppm1 0.362 ppm2 2.207 CV 1
ASSI { 1878}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 50 and name HD3 ))
3.000 3.000 3.000 peak 1878 spectrum 1 weight 0.10000E+01 volume 0.84117E-03 ppm1 0.107 ppm2 4.164 CV 1
ASSI { 1879}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 64 and name HA ))
2.700 0.900 0.900 peak 1879 spectrum 1 weight 0.10000E+01 volume 0.27910E-02 ppm1 0.107 ppm2 3.841 CV 1
ASSI { 1880}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 49 and name HB3 ))
3.000 1.200 1.200 peak 1880 spectrum 1 weight 0.10000E+01 volume 0.77506E-03 ppm1 0.108 ppm2 3.378 CV 1
ASSI { 1881}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 49 and name HB2 ))
4.300 2.300 1.700 peak 1881 spectrum 1 weight 0.10000E+01 volume 0.10771E-02 ppm1 0.107 ppm2 2.836 CV 1
ASSI { 1882}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 59 and name HB2 ))
3.400 1.500 1.500 peak 1882 spectrum 1 weight 0.10000E+01 volume 0.68168E-03 ppm1 0.109 ppm2 2.216 CV 1
ASSI { 1883}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 59 and name HG3 ))
3.200 1.300 1.300 peak 1883 spectrum 1 weight 0.10000E+01 volume 0.52977E-03 ppm1 0.110 ppm2 2.002 CV 1
OR { 1883}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 59 and name HG2 ))
ASSI { 1884}
( segid " " and resid 71 and name HG1%)
(( segid " " and resid 71 and name HA ))
2.600 0.900 0.900 peak 1884 spectrum 1 weight 0.10000E+01 volume 0.36473E-02 ppm1 0.314 ppm2 4.671 CV 1
ASSI { 1885}
( segid " " and resid 29 and name HG1%)
(( segid " " and resid 29 and name HA ))
2.800 1.000 1.000 peak 1885 spectrum 1 weight 0.10000E+01 volume 0.22368E-02 ppm1 0.565 ppm2 4.661 CV 1
ASSI { 1886}
( segid " " and resid 29 and name HG1%)
(( segid " " and resid 17 and name HA ))
3.900 1.900 1.900 peak 1886 spectrum 1 weight 0.10000E+01 volume 0.58164E-03 ppm1 0.567 ppm2 4.285 CV 1
ASSI { 1890}
( segid " " and resid 29 and name HG1%)
(( segid " " and resid 31 and name HB3 ))
3.100 1.200 1.200 peak 1890 spectrum 1 weight 0.10000E+01 volume 0.13658E-02 ppm1 0.563 ppm2 2.165 CV 1
ASSI { 1891}
( segid " " and resid 29 and name HG1%)
(( segid " " and resid 29 and name HB ))
2.500 0.800 0.800 peak 1891 spectrum 1 weight 0.10000E+01 volume 0.36025E-02 ppm1 0.564 ppm2 1.688 CV 1
ASSI { 1892}
( segid " " and resid 89 and name HG2%)
(( segid " " and resid 44 and name HA ))
3.200 1.300 1.300 peak 1892 spectrum 1 weight 0.10000E+01 volume 0.96505E-03 ppm1 0.975 ppm2 3.806 CV 1
ASSI { 1893}
( segid " " and resid 29 and name HG2%)
(( segid " " and resid 29 and name HA ))
2.800 0.900 0.900 peak 1893 spectrum 1 weight 0.10000E+01 volume 0.22744E-02 ppm1 0.573 ppm2 4.652 CV 1
ASSI { 1894}
( segid " " and resid 65 and name HD2%)
(( segid " " and resid 48 and name HA ))
4.000 2.000 2.000 peak 1894 spectrum 1 weight 0.10000E+01 volume 0.41331E-03 ppm1 0.618 ppm2 4.380 CV 1
ASSI { 1895}
( segid " " and resid 29 and name HG2%)
(( segid " " and resid 17 and name HA ))
3.100 1.200 1.200 peak 1895 spectrum 1 weight 0.10000E+01 volume 0.12151E-02 ppm1 0.571 ppm2 4.290 CV 1
ASSI { 1897}
( segid " " and resid 65 and name HD2%)
(( segid " " and resid 48 and name HB3 ))
3.200 1.300 1.300 peak 1897 spectrum 1 weight 0.10000E+01 volume 0.56631E-03 ppm1 0.619 ppm2 3.075 CV 1
ASSI { 1898}
( segid " " and resid 65 and name HD2%)
(( segid " " and resid 48 and name HB2 ))
4.600 2.700 1.400 peak 1898 spectrum 1 weight 0.10000E+01 volume 0.45761E-03 ppm1 0.619 ppm2 2.716 CV 1
ASSI { 1899}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 59 and name HB3 ))
3.000 1.100 1.100 peak 1899 spectrum 1 weight 0.10000E+01 volume 0.24784E-02 ppm1 0.363 ppm2 1.746 CV 1
ASSI { 1900}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 64 and name HB ))
2.300 0.700 0.700 peak 1900 spectrum 1 weight 0.10000E+01 volume 0.54597E-02 ppm1 0.362 ppm2 1.630 CV 1
ASSI { 1902}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 65 and name HG ))
3.800 1.800 1.800 peak 1902 spectrum 1 weight 0.10000E+01 volume 0.16345E-02 ppm1 0.363 ppm2 1.396 CV 1
ASSI { 1903}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 61 and name HG12))
4.300 2.300 1.700 peak 1903 spectrum 1 weight 0.10000E+01 volume 0.71696E-03 ppm1 0.363 ppm2 1.234 CV 1
ASSI { 1904}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 61 and name HG13))
4.100 4.100 1.900 peak 1904 spectrum 1 weight 0.10000E+01 volume 0.60812E-03 ppm1 0.363 ppm2 1.095 CV 1
ASSI { 1906}
( segid " " and resid 64 and name HG2%)
( segid " " and resid 44 and name HG2%)
2.600 0.800 0.800 peak 1906 spectrum 1 weight 0.10000E+01 volume 0.59099E-02 ppm1 0.363 ppm2 0.839 CV 1
ASSI { 1907}
( segid " " and resid 64 and name HG2%)
( segid " " and resid 20 and name HG2%)
1.600 1.600 4.400 peak 1907 spectrum 1 weight 0.10000E+01 volume 0.34129E-01 ppm1 0.363 ppm2 0.732 CV 1
ASSI { 1908}
( segid " " and resid 64 and name HG2%)
( segid " " and resid 44 and name HD1%)
2.800 1.000 1.000 peak 1908 spectrum 1 weight 0.10000E+01 volume 0.51301E-02 ppm1 0.363 ppm2 0.592 CV 1
ASSI { 1910}
( segid " " and resid 64 and name HG2%)
( segid " " and resid 64 and name HG1%)
2.200 0.600 0.600 peak 1910 spectrum 1 weight 0.10000E+01 volume 0.90859E-02 ppm1 0.362 ppm2 0.114 CV 1
ASSI { 1912}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 59 and name HB3 ))
3.400 1.400 1.400 peak 1912 spectrum 1 weight 0.10000E+01 volume 0.11269E-02 ppm1 0.107 ppm2 1.759 CV 1
ASSI { 1913}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 64 and name HB ))
2.400 0.700 0.700 peak 1913 spectrum 1 weight 0.10000E+01 volume 0.39499E-02 ppm1 0.107 ppm2 1.631 CV 1
ASSI { 1914}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 65 and name HG ))
2.900 1.000 1.000 peak 1914 spectrum 1 weight 0.10000E+01 volume 0.13144E-02 ppm1 0.108 ppm2 1.393 CV 1
ASSI { 1916}
( segid " " and resid 64 and name HG1%)
( segid " " and resid 44 and name HG2%)
2.300 0.700 0.700 peak 1916 spectrum 1 weight 0.10000E+01 volume 0.48569E-02 ppm1 0.107 ppm2 0.837 CV 1
ASSI { 1921}
( segid " " and resid 29 and name HG1%)
( segid " " and resid 71 and name HG2%)
2.700 0.900 0.900 peak 1921 spectrum 1 weight 0.10000E+01 volume 0.35621E-02 ppm1 0.565 ppm2 0.381 CV 1
ASSI { 1925}
( segid " " and resid 89 and name HG2%)
(( segid " " and resid 39 and name HG ))
2.200 2.200 3.800 peak 1925 spectrum 1 weight 0.10000E+01 volume 0.15358E-01 ppm1 0.971 ppm2 1.207 CV 1
ASSI { 1927}
( segid " " and resid 89 and name HG2%)
( segid " " and resid 73 and name HG1%)
2.400 0.700 0.700 peak 1927 spectrum 1 weight 0.10000E+01 volume 0.63710E-02 ppm1 0.972 ppm2 0.579 CV 1
ASSI { 1928}
( segid " " and resid 89 and name HG2%)
( segid " " and resid 39 and name HD2%)
2.600 0.900 0.900 peak 1928 spectrum 1 weight 0.10000E+01 volume 0.39620E-02 ppm1 0.972 ppm2 0.327 CV 1
ASSI { 1933}
( segid " " and resid 65 and name HD2%)
(( segid " " and resid 69 and name HB3 ))
3.700 1.700 1.700 peak 1933 spectrum 1 weight 0.10000E+01 volume 0.43535E-03 ppm1 0.619 ppm2 2.077 CV 1
ASSI { 1935}
( segid " " and resid 29 and name HG2%)
(( segid " " and resid 29 and name HB ))
2.400 0.700 0.700 peak 1935 spectrum 1 weight 0.10000E+01 volume 0.58762E-02 ppm1 0.572 ppm2 1.687 CV 1
ASSI { 1937}
( segid " " and resid 65 and name HD2%)
(( segid " " and resid 65 and name HG ))
2.300 0.700 0.700 peak 1937 spectrum 1 weight 0.10000E+01 volume 0.65221E-02 ppm1 0.621 ppm2 1.388 CV 1
OR { 1937}
( segid " " and resid 65 and name HD2%)
(( segid " " and resid 65 and name HB2 ))
ASSI { 1938}
( segid " " and resid 65 and name HD2%)
(( segid " " and resid 65 and name HB3 ))
2.400 0.700 0.700 peak 1938 spectrum 1 weight 0.10000E+01 volume 0.40359E-02 ppm1 0.619 ppm2 1.177 CV 1
ASSI { 1939}
( segid " " and resid 29 and name HG2%)
( segid " " and resid 27 and name HB% )
2.500 2.500 3.500 peak 1939 spectrum 1 weight 0.10000E+01 volume 0.27293E-02 ppm1 0.574 ppm2 1.164 CV 1
ASSI { 1942}
( segid " " and resid 65 and name HD2%)
( segid " " and resid 17 and name HG2%)
2.500 2.500 3.500 peak 1942 spectrum 1 weight 0.10000E+01 volume 0.15345E-01 ppm1 0.610 ppm2 0.759 CV 1
ASSI { 1944}
( segid " " and resid 65 and name HD2%)
( segid " " and resid 71 and name HG1%)
2.500 0.800 0.800 peak 1944 spectrum 1 weight 0.10000E+01 volume 0.50010E-02 ppm1 0.615 ppm2 0.341 CV 1
ASSI { 1945}
( segid " " and resid 29 and name HG2%)
( segid " " and resid 87 and name HD2%)
3.400 1.500 1.500 peak 1945 spectrum 1 weight 0.10000E+01 volume 0.87033E-03 ppm1 0.571 ppm2 0.198 CV 1
ASSI { 1946}
( segid " " and resid 65 and name HD2%)
( segid " " and resid 64 and name HG1%)
3.000 1.100 1.100 peak 1946 spectrum 1 weight 0.10000E+01 volume 0.20914E-02 ppm1 0.621 ppm2 0.116 CV 1
ASSI { 1947}
( segid " " and resid 73 and name HG1%)
(( segid " " and resid 73 and name HN ))
3.200 1.200 1.200 peak 1947 spectrum 1 weight 0.10000E+01 volume 0.20434E-02 ppm1 0.547 ppm2 9.062 CV 1
ASSI { 1948}
( segid " " and resid 73 and name HG1%)
(( segid " " and resid 74 and name HN ))
3.700 1.700 1.700 peak 1948 spectrum 1 weight 0.10000E+01 volume 0.15616E-02 ppm1 0.547 ppm2 8.652 CV 1
ASSI { 1951}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 39 and name HN ))
4.100 2.100 1.900 peak 1951 spectrum 1 weight 0.10000E+01 volume 0.46687E-03 ppm1 0.608 ppm2 8.894 CV 1
ASSI { 1954}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 49 and name HZ ))
4.000 2.000 2.000 peak 1954 spectrum 1 weight 0.10000E+01 volume 0.13735E-02 ppm1 0.795 ppm2 7.254 CV 1
ASSI { 1955}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 61 and name HN ))
3.300 1.400 1.400 peak 1955 spectrum 1 weight 0.10000E+01 volume 0.51725E-03 ppm1 0.794 ppm2 9.556 CV 1
ASSI { 1961}
( segid " " and resid 73 and name HG1%)
(( segid " " and resid 89 and name HA ))
3.100 1.200 1.200 peak 1961 spectrum 1 weight 0.10000E+01 volume 0.14792E-02 ppm1 0.546 ppm2 5.187 CV 1
ASSI { 1962}
( segid " " and resid 73 and name HG1%)
(( segid " " and resid 88 and name HB ))
4.300 2.300 1.700 peak 1962 spectrum 1 weight 0.10000E+01 volume 0.47911E-03 ppm1 0.546 ppm2 4.159 CV 1
ASSI { 1966}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 39 and name HA ))
3.100 1.200 1.200 peak 1966 spectrum 1 weight 0.10000E+01 volume 0.40493E-02 ppm1 0.609 ppm2 4.976 CV 1
ASSI { 1971}
( segid " " and resid 93 and name HD2%)
(( segid " " and resid 93 and name HA ))
2.700 0.900 0.900 peak 1971 spectrum 1 weight 0.10000E+01 volume 0.59310E-02 ppm1 0.864 ppm2 4.473 CV 1
ASSI { 1974}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 60 and name HA ))
3.900 1.900 1.900 peak 1974 spectrum 1 weight 0.10000E+01 volume 0.49889E-03 ppm1 0.792 ppm2 4.978 CV 1
ASSI { 1976}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 42 and name HA ))
3.900 1.900 1.900 peak 1976 spectrum 1 weight 0.10000E+01 volume 0.53338E-03 ppm1 0.795 ppm2 4.305 CV 1
ASSI { 1977}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 62 and name HA ))
4.400 2.400 1.600 peak 1977 spectrum 1 weight 0.10000E+01 volume 0.51992E-03 ppm1 0.796 ppm2 4.170 CV 1
ASSI { 1978}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 41 and name HA ))
2.500 0.800 0.800 peak 1978 spectrum 1 weight 0.10000E+01 volume 0.45182E-02 ppm1 0.794 ppm2 3.923 CV 1
ASSI { 1980}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 30 and name HA ))
3.700 1.700 1.700 peak 1980 spectrum 1 weight 0.10000E+01 volume 0.77335E-03 ppm1 1.013 ppm2 5.085 CV 1
ASSI { 1981}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 29 and name HA ))
2.900 1.100 1.100 peak 1981 spectrum 1 weight 0.10000E+01 volume 0.13931E-02 ppm1 1.015 ppm2 4.650 CV 1
ASSI { 1982}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 18 and name HA ))
2.600 0.800 0.800 peak 1982 spectrum 1 weight 0.10000E+01 volume 0.52807E-02 ppm1 1.015 ppm2 4.521 CV 1
ASSI { 1983}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 18 and name HB ))
2.300 0.600 0.600 peak 1983 spectrum 1 weight 0.10000E+01 volume 0.71799E-02 ppm1 1.015 ppm2 4.218 CV 1
ASSI { 1986}
( segid " " and resid 73 and name HG1%)
(( segid " " and resid 73 and name HB ))
2.400 0.700 0.700 peak 1986 spectrum 1 weight 0.10000E+01 volume 0.49068E-02 ppm1 0.546 ppm2 1.950 CV 1
ASSI { 1987}
( segid " " and resid 73 and name HG1%)
(( segid " " and resid 71 and name HB ))
2.900 1.000 1.000 peak 1987 spectrum 1 weight 0.10000E+01 volume 0.18772E-02 ppm1 0.547 ppm2 1.442 CV 1
ASSI { 1988}
( segid " " and resid 73 and name HG1%)
(( segid " " and resid 39 and name HG ))
3.400 1.400 1.400 peak 1988 spectrum 1 weight 0.10000E+01 volume 0.10555E-02 ppm1 0.549 ppm2 1.223 CV 1
ASSI { 1992}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 43 and name HB2 ))
3.800 1.800 1.800 peak 1992 spectrum 1 weight 0.10000E+01 volume 0.66026E-03 ppm1 0.608 ppm2 3.115 CV 1
ASSI { 1995}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 87 and name HB2 ))
2.900 1.100 1.100 peak 1995 spectrum 1 weight 0.10000E+01 volume 0.21533E-02 ppm1 0.609 ppm2 1.523 CV 1
OR { 1995}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 87 and name HG ))
ASSI { 1996}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 39 and name HG ))
2.500 0.800 0.800 peak 1996 spectrum 1 weight 0.10000E+01 volume 0.41263E-02 ppm1 0.608 ppm2 1.194 CV 1
ASSI { 1999}
( segid " " and resid 39 and name HD1%)
( segid " " and resid 39 and name HD2%)
2.500 0.800 0.800 peak 1999 spectrum 1 weight 0.10000E+01 volume 0.56093E-02 ppm1 0.609 ppm2 0.325 CV 1
ASSI { 2002}
( segid " " and resid 93 and name HD2%)
(( segid " " and resid 47 and name HG2 ))
3.000 1.100 1.100 peak 2002 spectrum 1 weight 0.10000E+01 volume 0.14975E-02 ppm1 0.864 ppm2 1.941 CV 1
ASSI { 2003}
( segid " " and resid 93 and name HD2%)
(( segid " " and resid 93 and name HB3 ))
2.200 0.600 0.600 peak 2003 spectrum 1 weight 0.10000E+01 volume 0.13100E-01 ppm1 0.868 ppm2 1.645 CV 1
OR { 2003}
( segid " " and resid 93 and name HD2%)
(( segid " " and resid 93 and name HB2 ))
ASSI { 2004}
( segid " " and resid 41 and name HD1%)
( segid " " and resid 41 and name HD2%)
1.900 0.500 0.500 peak 2004 spectrum 1 weight 0.10000E+01 volume 0.22227E-01 ppm1 0.795 ppm2 0.925 CV 1
ASSI { 2005}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 25 and name HB2 ))
4.600 2.600 1.400 peak 2005 spectrum 1 weight 0.10000E+01 volume 0.40056E-03 ppm1 0.794 ppm2 2.330 CV 1
ASSI { 2006}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 59 and name HB2 ))
3.000 1.100 1.100 peak 2006 spectrum 1 weight 0.10000E+01 volume 0.84692E-03 ppm1 0.794 ppm2 2.215 CV 1
ASSI { 2007}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 44 and name HB ))
2.800 1.000 1.000 peak 2007 spectrum 1 weight 0.10000E+01 volume 0.13765E-02 ppm1 0.795 ppm2 2.117 CV 1
ASSI { 2009}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 44 and name HG12))
3.700 1.700 1.700 peak 2009 spectrum 1 weight 0.10000E+01 volume 0.13589E-02 ppm1 0.795 ppm2 1.865 CV 1
ASSI { 2010}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 41 and name HG ))
2.200 0.600 0.600 peak 2010 spectrum 1 weight 0.10000E+01 volume 0.66244E-02 ppm1 0.795 ppm2 1.635 CV 1
ASSI { 2012}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 41 and name HB2 ))
2.400 0.700 0.700 peak 2012 spectrum 1 weight 0.10000E+01 volume 0.36480E-02 ppm1 0.794 ppm2 1.395 CV 1
ASSI { 2013}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 61 and name HG12))
3.600 1.600 1.600 peak 2013 spectrum 1 weight 0.10000E+01 volume 0.24268E-02 ppm1 0.794 ppm2 1.257 CV 1
ASSI { 2015}
( segid " " and resid 41 and name HD1%)
( segid " " and resid 39 and name HD2%)
2.400 2.400 3.600 peak 2015 spectrum 1 weight 0.10000E+01 volume 0.16490E-01 ppm1 0.795 ppm2 0.321 CV 1
ASSI { 2016}
( segid " " and resid 41 and name HD1%)
( segid " " and resid 64 and name HG1%)
3.400 1.400 1.400 peak 2016 spectrum 1 weight 0.10000E+01 volume 0.14332E-02 ppm1 0.795 ppm2 0.109 CV 1
ASSI { 2022}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 28 and name HB3 ))
3.400 1.400 1.400 peak 2022 spectrum 1 weight 0.10000E+01 volume 0.79696E-03 ppm1 1.017 ppm2 3.011 CV 1
ASSI { 2023}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 30 and name HB3 ))
3.200 1.300 1.300 peak 2023 spectrum 1 weight 0.10000E+01 volume 0.27485E-02 ppm1 1.015 ppm2 2.776 CV 1
ASSI { 2024}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 17 and name HB ))
4.400 2.500 1.600 peak 2024 spectrum 1 weight 0.10000E+01 volume 0.47072E-03 ppm1 1.015 ppm2 2.364 CV 1
ASSI { 2025}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 67 and name HG2 ))
4.500 2.600 1.500 peak 2025 spectrum 1 weight 0.10000E+01 volume 0.43541E-03 ppm1 1.016 ppm2 2.258 CV 1
OR { 2025}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 67 and name HG3 ))
ASSI { 2026}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 30 and name HB2 ))
2.500 0.800 0.800 peak 2026 spectrum 1 weight 0.10000E+01 volume 0.32899E-02 ppm1 1.015 ppm2 2.140 CV 1
ASSI { 2027}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 19 and name HB2 ))
4.500 2.500 1.500 peak 2027 spectrum 1 weight 0.10000E+01 volume 0.44048E-03 ppm1 1.016 ppm2 2.031 CV 1
ASSI { 2029}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 20 and name HG12))
4.700 2.800 1.300 peak 2029 spectrum 1 weight 0.10000E+01 volume 0.50919E-03 ppm1 1.022 ppm2 1.444 CV 1
ASSI { 2030}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 17 and name HG13))
3.700 1.700 1.700 peak 2030 spectrum 1 weight 0.10000E+01 volume 0.16516E-02 ppm1 1.011 ppm2 1.351 CV 1
ASSI { 2032}
( segid " " and resid 18 and name HG2%)
( segid " " and resid 33 and name HB% )
2.600 2.600 3.400 peak 2032 spectrum 1 weight 0.10000E+01 volume 0.97299E-02 ppm1 1.019 ppm2 1.114 CV 1
ASSI { 2033}
( segid " " and resid 18 and name HG2%)
( segid " " and resid 17 and name HG2%)
3.900 1.900 1.900 peak 2033 spectrum 1 weight 0.10000E+01 volume 0.13377E-02 ppm1 1.005 ppm2 0.780 CV 1
ASSI { 2035}
( segid " " and resid 5 and name HD1%)
(( segid " " and resid 5 and name HA ))
3.900 1.900 1.900 peak 2035 spectrum 1 weight 0.10000E+01 volume 0.12571E-02 ppm1 0.971 ppm2 4.363 CV 1
ASSI { 2038}
( segid " " and resid 93 and name HD1%)
( segid " " and resid 73 and name HG1%)
1.800 1.800 4.200 peak 2038 spectrum 1 weight 0.10000E+01 volume 0.15900E-01 ppm1 0.948 ppm2 0.578 CV 1
OR { 2038}
( segid " " and resid 93 and name HD1%)
( segid " " and resid 73 and name HG2%)
ASSI { 2040}
( segid " " and resid 93 and name HD1%)
( segid " " and resid 71 and name HG1%)
2.500 2.500 3.500 peak 2040 spectrum 1 weight 0.10000E+01 volume 0.26232E-02 ppm1 0.945 ppm2 0.321 CV 1
ASSI { 2044}
( segid " " and resid 93 and name HD1%)
(( segid " " and resid 93 and name HB2 ))
2.400 0.700 0.700 peak 2044 spectrum 1 weight 0.10000E+01 volume 0.73817E-02 ppm1 0.935 ppm2 1.647 CV 1
OR { 2044}
( segid " " and resid 93 and name HD1%)
(( segid " " and resid 93 and name HB3 ))
ASSI { 2045}
( segid " " and resid 39 and name HD2%)
(( segid " " and resid 39 and name HA ))
3.700 1.800 1.800 peak 2045 spectrum 1 weight 0.10000E+01 volume 0.60725E-03 ppm1 0.316 ppm2 4.990 CV 1
ASSI { 2047}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 39 and name HA ))
3.400 1.400 1.400 peak 2047 spectrum 1 weight 0.10000E+01 volume 0.87861E-03 ppm1 0.541 ppm2 4.988 CV 1
ASSI { 2048}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 38 and name HA ))
3.700 1.700 1.700 peak 2048 spectrum 1 weight 0.10000E+01 volume 0.46257E-03 ppm1 0.542 ppm2 4.631 CV 1
ASSI { 2049}
(( segid " " and resid 6 and name HG2 ))
(( segid " " and resid 9 and name HD2 ))
3.200 1.300 1.300 peak 2049 spectrum 1 weight 0.10000E+01 volume 0.17739E-02 ppm1 2.304 ppm2 1.714 CV 1
OR { 2049}
(( segid " " and resid 6 and name HG3 ))
(( segid " " and resid 9 and name HD2 ))
OR { 2049}
(( segid " " and resid 6 and name HG2 ))
(( segid " " and resid 9 and name HD3 ))
OR { 2049}
(( segid " " and resid 6 and name HG3 ))
(( segid " " and resid 9 and name HD3 ))
ASSI { 2050}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 73 and name HB ))
3.800 1.800 1.800 peak 2050 spectrum 1 weight 0.10000E+01 volume 0.80394E-03 ppm1 0.540 ppm2 1.931 CV 1
ASSI { 2051}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 44 and name HG12))
3.300 1.400 1.400 peak 2051 spectrum 1 weight 0.10000E+01 volume 0.10506E-02 ppm1 0.544 ppm2 1.840 CV 1
ASSI { 2053}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 87 and name HG ))
2.100 0.600 0.600 peak 2053 spectrum 1 weight 0.10000E+01 volume 0.91899E-02 ppm1 0.542 ppm2 1.510 CV 1
OR { 2053}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 87 and name HB2 ))
ASSI { 2054}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 61 and name HG13))
2.000 0.500 0.500 peak 2054 spectrum 1 weight 0.10000E+01 volume 0.96724E-02 ppm1 0.542 ppm2 1.059 CV 1
ASSI { 2057}
( segid " " and resid 65 and name HD1%)
( segid " " and resid 17 and name HG2%)
2.800 1.000 1.000 peak 2057 spectrum 1 weight 0.10000E+01 volume 0.65273E-02 ppm1 0.544 ppm2 0.753 CV 1
ASSI { 2058}
( segid " " and resid 87 and name HD1%)
( segid " " and resid 87 and name HD2%)
2.500 0.800 0.800 peak 2058 spectrum 1 weight 0.10000E+01 volume 0.51064E-02 ppm1 0.542 ppm2 0.197 CV 1
ASSI { 2059}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 65 and name HG ))
2.000 0.500 0.500 peak 2059 spectrum 1 weight 0.10000E+01 volume 0.14241E-01 ppm1 0.545 ppm2 1.390 CV 1
OR { 2059}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 65 and name HB2 ))
ASSI { 2062}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 37 and name HN ))
4.100 2.100 1.900 peak 2062 spectrum 1 weight 0.10000E+01 volume 0.49275E-03 ppm1 0.541 ppm2 9.798 CV 1
ASSI { 2063}
(( segid " " and resid 6 and name HG2 ))
(( segid " " and resid 9 and name HB2 ))
3.200 1.200 1.200 peak 2063 spectrum 1 weight 0.10000E+01 volume 0.22491E-02 ppm1 2.310 ppm2 1.904 CV 1
OR { 2063}
(( segid " " and resid 6 and name HG3 ))
(( segid " " and resid 9 and name HB2 ))
ASSI { 2064}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 87 and name HN ))
3.200 1.300 1.300 peak 2064 spectrum 1 weight 0.10000E+01 volume 0.12825E-02 ppm1 0.540 ppm2 8.969 CV 1
ASSI { 2065}
( segid " " and resid 87 and name HD1%)
( segid " " and resid 31 and name HD% )
3.000 3.000 3.000 peak 2065 spectrum 1 weight 0.10000E+01 volume 0.83440E-03 ppm1 0.540 ppm2 6.582 CV 1
ASSI { 2066}
( segid " " and resid 87 and name HD1%)
( segid " " and resid 31 and name HE% )
3.800 1.800 1.800 peak 2066 spectrum 1 weight 0.10000E+01 volume 0.55491E-03 ppm1 0.541 ppm2 6.390 CV 1
ASSI { 2067}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 66 and name HN ))
4.500 2.500 1.500 peak 2067 spectrum 1 weight 0.10000E+01 volume 0.53229E-03 ppm1 0.545 ppm2 8.018 CV 1
ASSI { 2068}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 65 and name HN ))
3.400 1.500 1.500 peak 2068 spectrum 1 weight 0.10000E+01 volume 0.12127E-02 ppm1 0.545 ppm2 7.155 CV 1
ASSI { 2074}
(( segid " " and resid 61 and name HG12))
(( segid " " and resid 20 and name HG12))
2.300 2.300 3.700 peak 2074 spectrum 1 weight 0.10000E+01 volume 0.30174E-02 ppm1 1.255 ppm2 1.440 CV 1
ASSI { 2075}
(( segid " " and resid 61 and name HG12))
(( segid " " and resid 17 and name HG13))
3.300 3.300 2.700 peak 2075 spectrum 1 weight 0.10000E+01 volume 0.24255E-02 ppm1 1.256 ppm2 1.336 CV 1
ASSI { 2076}
(( segid " " and resid 61 and name HG12))
( segid " " and resid 27 and name HB% )
3.200 1.300 1.300 peak 2076 spectrum 1 weight 0.10000E+01 volume 0.13626E-02 ppm1 1.236 ppm2 1.171 CV 1
ASSI { 2077}
(( segid " " and resid 61 and name HG12))
(( segid " " and resid 61 and name HG13))
1.800 0.400 0.400 peak 2077 spectrum 1 weight 0.10000E+01 volume 0.66159E-02 ppm1 1.251 ppm2 1.074 CV 1
ASSI { 2079}
(( segid " " and resid 61 and name HG12))
( segid " " and resid 20 and name HG2%)
3.000 1.100 1.100 peak 2079 spectrum 1 weight 0.10000E+01 volume 0.11461E-02 ppm1 1.250 ppm2 0.709 CV 1
OR { 2079}
(( segid " " and resid 61 and name HG12))
( segid " " and resid 20 and name HD1%)
ASSI { 2080}
(( segid " " and resid 61 and name HG12))
( segid " " and resid 61 and name HD1%)
2.500 0.800 0.800 peak 2080 spectrum 1 weight 0.10000E+01 volume 0.30912E-02 ppm1 1.252 ppm2 0.581 CV 1
ASSI { 2083}
(( segid " " and resid 61 and name HG13))
(( segid " " and resid 20 and name HG12))
3.200 3.200 2.800 peak 2083 spectrum 1 weight 0.10000E+01 volume 0.19449E-02 ppm1 1.064 ppm2 1.430 CV 1
ASSI { 2087}
(( segid " " and resid 61 and name HG13))
( segid " " and resid 20 and name HG2%)
3.700 1.700 1.700 peak 2087 spectrum 1 weight 0.10000E+01 volume 0.15111E-02 ppm1 1.066 ppm2 0.710 CV 1
OR { 2087}
(( segid " " and resid 61 and name HG13))
( segid " " and resid 20 and name HD1%)
ASSI { 2090}
(( segid " " and resid 20 and name HG13))
(( segid " " and resid 67 and name HG2 ))
4.100 2.100 1.900 peak 2090 spectrum 1 weight 0.10000E+01 volume 0.43540E-03 ppm1 0.824 ppm2 2.264 CV 1
OR { 2090}
(( segid " " and resid 20 and name HG13))
(( segid " " and resid 67 and name HG3 ))
ASSI { 2093}
(( segid " " and resid 20 and name HG13))
(( segid " " and resid 20 and name HG12))
1.800 0.400 0.400 peak 2093 spectrum 1 weight 0.10000E+01 volume 0.75385E-02 ppm1 0.821 ppm2 1.455 CV 1
ASSI { 2094}
(( segid " " and resid 20 and name HG13))
(( segid " " and resid 17 and name HG13))
3.400 1.500 1.500 peak 2094 spectrum 1 weight 0.10000E+01 volume 0.12092E-02 ppm1 0.821 ppm2 1.347 CV 1
ASSI { 2095}
(( segid " " and resid 20 and name HG13))
( segid " " and resid 27 and name HB% )
3.000 1.100 1.100 peak 2095 spectrum 1 weight 0.10000E+01 volume 0.18251E-02 ppm1 0.821 ppm2 1.165 CV 1
ASSI { 2096}
(( segid " " and resid 20 and name HG13))
(( segid " " and resid 61 and name HG13))
5.000 3.100 1.000 peak 2096 spectrum 1 weight 0.10000E+01 volume 0.55349E-03 ppm1 0.833 ppm2 1.053 CV 1
ASSI { 2097}
(( segid " " and resid 20 and name HG13))
( segid " " and resid 20 and name HD1%)
2.300 0.700 0.700 peak 2097 spectrum 1 weight 0.10000E+01 volume 0.74659E-02 ppm1 0.821 ppm2 0.702 CV 1
OR { 2097}
(( segid " " and resid 20 and name HG13))
( segid " " and resid 20 and name HG2%)
ASSI { 2100}
(( segid " " and resid 75 and name HG12))
(( segid " " and resid 75 and name HG13))
1.900 0.400 0.400 peak 2100 spectrum 1 weight 0.10000E+01 volume 0.80114E-02 ppm1 0.979 ppm2 1.537 CV 1
ASSI { 2104}
(( segid " " and resid 75 and name HG12))
( segid " " and resid 87 and name HD2%)
3.400 1.500 1.500 peak 2104 spectrum 1 weight 0.10000E+01 volume 0.12040E-02 ppm1 0.977 ppm2 0.199 CV 1
ASSI { 2108}
(( segid " " and resid 75 and name HG12))
( segid " " and resid 13 and name HD% )
3.600 1.600 1.600 peak 2108 spectrum 1 weight 0.10000E+01 volume 0.44604E-03 ppm1 0.978 ppm2 7.097 CV 1
ASSI { 2109}
(( segid " " and resid 12 and name HG12))
(( segid " " and resid 12 and name HN ))
4.300 2.300 1.700 peak 2109 spectrum 1 weight 0.10000E+01 volume 0.60120E-03 ppm1 0.886 ppm2 7.357 CV 1
ASSI { 2110}
(( segid " " and resid 75 and name HG12))
( segid " " and resid 13 and name HE% )
3.400 1.500 1.500 peak 2110 spectrum 1 weight 0.10000E+01 volume 0.81373E-03 ppm1 0.977 ppm2 6.876 CV 1
ASSI { 2111}
(( segid " " and resid 20 and name HG13))
(( segid " " and resid 20 and name HN ))
3.300 1.400 1.400 peak 2111 spectrum 1 weight 0.10000E+01 volume 0.68671E-03 ppm1 0.821 ppm2 9.366 CV 1
ASSI { 2114}
(( segid " " and resid 39 and name HG ))
(( segid " " and resid 87 and name HB3 ))
3.500 3.500 2.500 peak 2114 spectrum 1 weight 0.10000E+01 volume 0.17105E-02 ppm1 1.187 ppm2 1.123 CV 1
ASSI { 2120}
(( segid " " and resid 72 and name HG12))
(( segid " " and resid 72 and name HG13))
1.900 0.400 0.400 peak 2120 spectrum 1 weight 0.10000E+01 volume 0.71559E-02 ppm1 1.270 ppm2 1.631 CV 1
ASSI { 2128}
(( segid " " and resid 17 and name HG13))
(( segid " " and resid 17 and name HB ))
3.300 1.300 1.300 peak 2128 spectrum 1 weight 0.10000E+01 volume 0.11597E-02 ppm1 1.327 ppm2 2.389 CV 1
ASSI { 2129}
(( segid " " and resid 17 and name HG13))
(( segid " " and resid 69 and name HB3 ))
4.200 2.200 1.800 peak 2129 spectrum 1 weight 0.10000E+01 volume 0.60998E-03 ppm1 1.327 ppm2 2.064 CV 1
ASSI { 2134}
(( segid " " and resid 17 and name HG13))
( segid " " and resid 71 and name HG1%)
4.100 2.100 1.900 peak 2134 spectrum 1 weight 0.10000E+01 volume 0.77041E-03 ppm1 1.334 ppm2 0.333 CV 1
ASSI { 2135}
(( segid " " and resid 91 and name HG13))
(( segid " " and resid 91 and name HB ))
3.100 1.200 1.200 peak 2135 spectrum 1 weight 0.10000E+01 volume 0.17117E-02 ppm1 1.409 ppm2 1.914 CV 1
ASSI { 2137}
(( segid " " and resid 65 and name HG ))
(( segid " " and resid 65 and name HB3 ))
2.700 0.900 0.900 peak 2137 spectrum 1 weight 0.10000E+01 volume 0.36317E-02 ppm1 1.398 ppm2 1.205 CV 1
ASSI { 2138}
(( segid " " and resid 65 and name HG ))
(( segid " " and resid 61 and name HG13))
3.300 1.400 1.400 peak 2138 spectrum 1 weight 0.10000E+01 volume 0.67707E-03 ppm1 1.394 ppm2 1.056 CV 1
ASSI { 2139}
(( segid " " and resid 91 and name HG13))
( segid " " and resid 91 and name HG2%)
2.900 1.000 1.000 peak 2139 spectrum 1 weight 0.10000E+01 volume 0.42413E-02 ppm1 1.407 ppm2 0.858 CV 1
ASSI { 2144}
(( segid " " and resid 91 and name HG13))
(( segid " " and resid 91 and name HA ))
3.500 1.500 1.500 peak 2144 spectrum 1 weight 0.10000E+01 volume 0.51981E-03 ppm1 1.411 ppm2 4.097 CV 1
ASSI { 2145}
(( segid " " and resid 65 and name HG ))
(( segid " " and resid 65 and name HA ))
3.600 1.600 1.600 peak 2145 spectrum 1 weight 0.10000E+01 volume 0.50976E-03 ppm1 1.393 ppm2 5.119 CV 1
ASSI { 2146}
(( segid " " and resid 17 and name HG13))
(( segid " " and resid 17 and name HA ))
3.300 1.400 1.400 peak 2146 spectrum 1 weight 0.10000E+01 volume 0.49286E-03 ppm1 1.323 ppm2 4.292 CV 1
ASSI { 2147}
(( segid " " and resid 72 and name HG12))
(( segid " " and resid 72 and name HA ))
3.500 1.600 1.600 peak 2147 spectrum 1 weight 0.10000E+01 volume 0.10108E-02 ppm1 1.266 ppm2 4.911 CV 1
ASSI { 2150}
(( segid " " and resid 17 and name HG13))
(( segid " " and resid 17 and name HN ))
3.600 1.600 1.600 peak 2150 spectrum 1 weight 0.10000E+01 volume 0.12791E-02 ppm1 1.329 ppm2 8.816 CV 1
ASSI { 2152}
(( segid " " and resid 91 and name HG12))
(( segid " " and resid 91 and name HN ))
3.700 1.700 1.700 peak 2152 spectrum 1 weight 0.10000E+01 volume 0.14916E-02 ppm1 1.338 ppm2 7.677 CV 1
ASSI { 2155}
(( segid " " and resid 87 and name HG ))
( segid " " and resid 75 and name HD1%)
3.600 1.600 1.600 peak 2155 spectrum 1 weight 0.10000E+01 volume 0.60171E-03 ppm1 1.505 ppm2 0.781 CV 1
ASSI { 2156}
(( segid " " and resid 87 and name HG ))
( segid " " and resid 87 and name HD1%)
2.400 0.700 0.700 peak 2156 spectrum 1 weight 0.10000E+01 volume 0.51727E-02 ppm1 1.510 ppm2 0.553 CV 1
ASSI { 2157}
(( segid " " and resid 87 and name HG ))
( segid " " and resid 39 and name HD2%)
4.200 2.200 1.800 peak 2157 spectrum 1 weight 0.10000E+01 volume 0.51352E-03 ppm1 1.541 ppm2 0.323 CV 1
ASSI { 2158}
(( segid " " and resid 87 and name HG ))
(( segid " " and resid 39 and name HG ))
4.000 2.000 2.000 peak 2158 spectrum 1 weight 0.10000E+01 volume 0.49152E-03 ppm1 1.501 ppm2 1.206 CV 1
ASSI { 2159}
(( segid " " and resid 87 and name HG ))
( segid " " and resid 87 and name HD2%)
2.900 1.100 1.100 peak 2159 spectrum 1 weight 0.10000E+01 volume 0.14147E-02 ppm1 1.511 ppm2 0.192 CV 1
ASSI { 2160}
(( segid " " and resid 87 and name HG ))
(( segid " " and resid 87 and name HN ))
3.300 1.400 1.400 peak 2160 spectrum 1 weight 0.10000E+01 volume 0.61100E-03 ppm1 1.510 ppm2 8.959 CV 1
ASSI { 2167}
(( segid " " and resid 19 and name HG3 ))
(( segid " " and resid 19 and name HB2 ))
2.300 0.700 0.700 peak 2167 spectrum 1 weight 0.10000E+01 volume 0.40833E-02 ppm1 1.582 ppm2 2.007 CV 1
ASSI { 2168}
(( segid " " and resid 19 and name HG3 ))
(( segid " " and resid 19 and name HB3 ))
2.600 0.800 0.800 peak 2168 spectrum 1 weight 0.10000E+01 volume 0.69547E-02 ppm1 1.581 ppm2 1.871 CV 1
ASSI { 2169}
(( segid " " and resid 12 and name HG13))
(( segid " " and resid 14 and name HB2 ))
2.600 2.600 3.400 peak 2169 spectrum 1 weight 0.10000E+01 volume 0.34703E-02 ppm1 1.499 ppm2 1.873 CV 1
ASSI { 2170}
(( segid " " and resid 17 and name HG12))
(( segid " " and resid 17 and name HG13))
1.900 0.400 0.400 peak 2170 spectrum 1 weight 0.10000E+01 volume 0.59371E-02 ppm1 1.508 ppm2 1.331 CV 1
ASSI { 2172}
(( segid " " and resid 12 and name HG13))
(( segid " " and resid 12 and name HG12))
1.800 0.400 0.400 peak 2172 spectrum 1 weight 0.10000E+01 volume 0.12409E-01 ppm1 1.487 ppm2 0.879 CV 1
ASSI { 2173}
(( segid " " and resid 17 and name HG12))
(( segid " " and resid 17 and name HA ))
3.900 1.900 1.900 peak 2173 spectrum 1 weight 0.10000E+01 volume 0.88751E-03 ppm1 1.534 ppm2 4.299 CV 1
ASSI { 2175}
(( segid " " and resid 66 and name HG2 ))
(( segid " " and resid 67 and name HA ))
4.100 2.100 1.900 peak 2175 spectrum 1 weight 0.10000E+01 volume 0.40838E-03 ppm1 1.576 ppm2 3.662 CV 1
OR { 2175}
(( segid " " and resid 66 and name HG3 ))
(( segid " " and resid 67 and name HA ))
ASSI { 2177}
(( segid " " and resid 17 and name HG12))
(( segid " " and resid 17 and name HB ))
2.700 0.900 0.900 peak 2177 spectrum 1 weight 0.10000E+01 volume 0.14172E-02 ppm1 1.528 ppm2 2.379 CV 1
ASSI { 2182}
(( segid " " and resid 75 and name HG13))
( segid " " and resid 87 and name HD2%)
3.800 1.800 1.800 peak 2182 spectrum 1 weight 0.10000E+01 volume 0.69691E-03 ppm1 1.536 ppm2 0.191 CV 1
ASSI { 2183}
(( segid " " and resid 75 and name HG13))
(( segid " " and resid 75 and name HA ))
3.800 1.800 1.800 peak 2183 spectrum 1 weight 0.10000E+01 volume 0.59220E-03 ppm1 1.536 ppm2 3.944 CV 1
ASSI { 2185}
(( segid " " and resid 72 and name HG13))
( segid " " and resid 93 and name HD1%)
3.000 1.100 1.100 peak 2185 spectrum 1 weight 0.10000E+01 volume 0.34604E-02 ppm1 1.641 ppm2 0.949 CV 1
ASSI { 2186}
(( segid " " and resid 72 and name HG13))
(( segid " " and resid 72 and name HA ))
3.800 1.800 1.800 peak 2186 spectrum 1 weight 0.10000E+01 volume 0.10782E-02 ppm1 1.637 ppm2 4.896 CV 1
ASSI { 2191}
(( segid " " and resid 35 and name HG2 ))
(( segid " " and resid 35 and name HA ))
3.000 1.100 1.100 peak 2191 spectrum 1 weight 0.10000E+01 volume 0.22740E-02 ppm1 1.595 ppm2 4.546 CV 1
ASSI { 2192}
(( segid " " and resid 5 and name HG ))
(( segid " " and resid 5 and name HA ))
3.100 1.200 1.200 peak 2192 spectrum 1 weight 0.10000E+01 volume 0.22045E-02 ppm1 1.657 ppm2 4.370 CV 1
ASSI { 2194}
(( segid " " and resid 5 and name HG ))
(( segid " " and resid 4 and name HB3 ))
2.400 2.400 3.600 peak 2194 spectrum 1 weight 0.10000E+01 volume 0.76254E-02 ppm1 1.642 ppm2 2.005 CV 1
ASSI { 2201}
(( segid " " and resid 80 and name HG2 ))
(( segid " " and resid 80 and name HA ))
3.000 1.100 1.100 peak 2201 spectrum 1 weight 0.10000E+01 volume 0.36680E-02 ppm1 1.685 ppm2 4.562 CV 1
ASSI { 2216}
(( segid " " and resid 12 and name HG13))
(( segid " " and resid 13 and name HN ))
3.700 1.700 1.700 peak 2216 spectrum 1 weight 0.10000E+01 volume 0.48430E-03 ppm1 1.491 ppm2 9.226 CV 1
ASSI { 2218}
(( segid " " and resid 19 and name HG3 ))
(( segid " " and resid 19 and name HE ))
3.300 1.400 1.400 peak 2218 spectrum 1 weight 0.10000E+01 volume 0.59519E-03 ppm1 1.570 ppm2 7.396 CV 1
ASSI { 2219}
(( segid " " and resid 12 and name HG13))
(( segid " " and resid 12 and name HN ))
3.800 1.800 1.800 peak 2219 spectrum 1 weight 0.10000E+01 volume 0.12230E-02 ppm1 1.487 ppm2 7.373 CV 1
ASSI { 2220}
(( segid " " and resid 72 and name HG13))
(( segid " " and resid 72 and name HN ))
4.500 2.500 1.500 peak 2220 spectrum 1 weight 0.10000E+01 volume 0.98223E-03 ppm1 1.630 ppm2 7.294 CV 1
ASSI { 2223}
(( segid " " and resid 35 and name HG2 ))
(( segid " " and resid 35 and name HN ))
3.300 1.300 1.300 peak 2223 spectrum 1 weight 0.10000E+01 volume 0.12503E-02 ppm1 1.576 ppm2 7.682 CV 1
ASSI { 2229}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 19 and name HE ))
4.200 2.200 1.800 peak 2229 spectrum 1 weight 0.10000E+01 volume 0.50635E-03 ppm1 1.667 ppm2 7.398 CV 1
ASSI { 2230}
(( segid " " and resid 19 and name HG2 ))
( segid " " and resid 28 and name HD% )
3.900 1.900 1.900 peak 2230 spectrum 1 weight 0.10000E+01 volume 0.49495E-03 ppm1 1.666 ppm2 7.123 CV 1
ASSI { 2243}
(( segid " " and resid 16 and name HG3 ))
(( segid " " and resid 17 and name HN ))
4.400 2.400 1.600 peak 2243 spectrum 1 weight 0.10000E+01 volume 0.57113E-03 ppm1 1.324 ppm2 8.813 CV 1
ASSI { 2245}
(( segid " " and resid 14 and name HG2 ))
(( segid " " and resid 14 and name HA ))
3.300 1.400 1.400 peak 2245 spectrum 1 weight 0.10000E+01 volume 0.92966E-03 ppm1 1.473 ppm2 4.860 CV 1
ASSI { 2246}
(( segid " " and resid 14 and name HG3 ))
(( segid " " and resid 14 and name HA ))
3.300 1.400 1.400 peak 2246 spectrum 1 weight 0.10000E+01 volume 0.11227E-02 ppm1 1.374 ppm2 4.856 CV 1
ASSI { 2248}
(( segid " " and resid 16 and name HG3 ))
(( segid " " and resid 16 and name HN ))
3.700 1.700 1.700 peak 2248 spectrum 1 weight 0.10000E+01 volume 0.40690E-03 ppm1 1.319 ppm2 8.107 CV 1
ASSI { 2259}
(( segid " " and resid 16 and name HG2 ))
(( segid " " and resid 68 and name HA1 ))
3.600 1.600 1.600 peak 2259 spectrum 1 weight 0.10000E+01 volume 0.50885E-03 ppm1 1.394 ppm2 4.448 CV 1
ASSI { 2261}
(( segid " " and resid 16 and name HG3 ))
(( segid " " and resid 70 and name HG2 ))
4.500 2.600 1.500 peak 2261 spectrum 1 weight 0.10000E+01 volume 0.44802E-03 ppm1 1.321 ppm2 2.425 CV 1
ASSI { 2263}
(( segid " " and resid 8 and name HG2 ))
(( segid " " and resid 7 and name HB2 ))
3.500 3.500 2.500 peak 2263 spectrum 1 weight 0.10000E+01 volume 0.90386E-03 ppm1 1.465 ppm2 2.130 CV 1
OR { 2263}
(( segid " " and resid 8 and name HG3 ))
(( segid " " and resid 7 and name HB2 ))
ASSI { 2266}
(( segid " " and resid 9 and name HG3 ))
(( segid " " and resid 11 and name HB3 ))
4.100 2.100 1.900 peak 2266 spectrum 1 weight 0.10000E+01 volume 0.45258E-03 ppm1 1.503 ppm2 2.832 CV 1
OR { 2266}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 11 and name HB3 ))
ASSI { 2267}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 11 and name HA ))
3.900 1.900 1.900 peak 2267 spectrum 1 weight 0.10000E+01 volume 0.44376E-03 ppm1 1.477 ppm2 4.652 CV 1
OR { 2267}
(( segid " " and resid 9 and name HG3 ))
(( segid " " and resid 11 and name HA ))
ASSI { 2268}
(( segid " " and resid 16 and name HG3 ))
(( segid " " and resid 68 and name HA1 ))
4.300 2.300 1.700 peak 2268 spectrum 1 weight 0.10000E+01 volume 0.49246E-03 ppm1 1.328 ppm2 4.442 CV 1
ASSI { 2271}
(( segid " " and resid 16 and name HG3 ))
(( segid " " and resid 68 and name HA2 ))
5.100 3.200 0.900 peak 2271 spectrum 1 weight 0.10000E+01 volume 0.52745E-03 ppm1 1.319 ppm2 3.605 CV 1
ASSI { 2276}
(( segid " " and resid 16 and name HG3 ))
(( segid " " and resid 16 and name HB3 ))
2.200 0.600 0.600 peak 2276 spectrum 1 weight 0.10000E+01 volume 0.10230E-01 ppm1 1.323 ppm2 1.683 CV 1
OR { 2276}
(( segid " " and resid 16 and name HG3 ))
(( segid " " and resid 16 and name HB2 ))
ASSI { 2277}
(( segid " " and resid 83 and name HG2 ))
(( segid " " and resid 83 and name HD3 ))
2.100 0.600 0.600 peak 2277 spectrum 1 weight 0.10000E+01 volume 0.13729E-01 ppm1 1.492 ppm2 1.622 CV 1
OR { 2277}
(( segid " " and resid 83 and name HG3 ))
(( segid " " and resid 83 and name HD2 ))
OR { 2277}
(( segid " " and resid 83 and name HG2 ))
(( segid " " and resid 83 and name HD2 ))
OR { 2277}
(( segid " " and resid 83 and name HG3 ))
(( segid " " and resid 83 and name HD3 ))
ASSI { 2278}
(( segid " " and resid 16 and name HG3 ))
(( segid " " and resid 16 and name HG2 ))
1.400 0.200 0.800 peak 2278 spectrum 1 weight 0.10000E+01 volume 0.43605E-01 ppm1 1.330 ppm2 1.364 CV 1
ASSI { 2280}
(( segid " " and resid 42 and name HG2 ))
(( segid " " and resid 42 and name HE3 ))
2.900 1.000 1.000 peak 2280 spectrum 1 weight 0.10000E+01 volume 0.24834E-02 ppm1 1.548 ppm2 3.096 CV 1
OR { 2280}
(( segid " " and resid 42 and name HG2 ))
(( segid " " and resid 42 and name HE2 ))
OR { 2280}
(( segid " " and resid 42 and name HG3 ))
(( segid " " and resid 42 and name HE3 ))
OR { 2280}
(( segid " " and resid 42 and name HG3 ))
(( segid " " and resid 42 and name HE2 ))
ASSI { 2284}
(( segid " " and resid 62 and name HG2 ))
(( segid " " and resid 62 and name HA ))
3.300 1.400 1.400 peak 2284 spectrum 1 weight 0.10000E+01 volume 0.10999E-02 ppm1 1.525 ppm2 4.178 CV 1
ASSI { 2286}
(( segid " " and resid 62 and name HG2 ))
( segid " " and resid 20 and name HG2%)
3.000 3.000 3.000 peak 2286 spectrum 1 weight 0.10000E+01 volume 0.94554E-03 ppm1 1.521 ppm2 0.703 CV 1
OR { 2286}
(( segid " " and resid 62 and name HG2 ))
( segid " " and resid 20 and name HD1%)
ASSI { 2287}
(( segid " " and resid 62 and name HG3 ))
( segid " " and resid 20 and name HG2%)
3.100 3.100 2.900 peak 2287 spectrum 1 weight 0.10000E+01 volume 0.95259E-03 ppm1 1.452 ppm2 0.709 CV 1
OR { 2287}
(( segid " " and resid 62 and name HG3 ))
( segid " " and resid 20 and name HD1%)
ASSI { 2288}
(( segid " " and resid 77 and name HG2 ))
(( segid " " and resid 77 and name HA ))
2.900 1.000 1.000 peak 2288 spectrum 1 weight 0.10000E+01 volume 0.25475E-02 ppm1 1.478 ppm2 4.542 CV 1
OR { 2288}
(( segid " " and resid 77 and name HG3 ))
(( segid " " and resid 77 and name HA ))
ASSI { 2289}
(( segid " " and resid 77 and name HG2 ))
(( segid " " and resid 76 and name HB3 ))
3.600 1.600 1.600 peak 2289 spectrum 1 weight 0.10000E+01 volume 0.50645E-03 ppm1 1.478 ppm2 2.541 CV 1
OR { 2289}
(( segid " " and resid 77 and name HG3 ))
(( segid " " and resid 76 and name HB3 ))
ASSI { 2293}
(( segid " " and resid 40 and name HG2 ))
(( segid " " and resid 39 and name HA ))
4.500 2.500 1.500 peak 2293 spectrum 1 weight 0.10000E+01 volume 0.10525E-02 ppm1 2.175 ppm2 4.981 CV 1
OR { 2293}
(( segid " " and resid 40 and name HG3 ))
(( segid " " and resid 39 and name HA ))
ASSI { 2294}
(( segid " " and resid 40 and name HG2 ))
(( segid " " and resid 40 and name HA ))
3.500 1.500 1.500 peak 2294 spectrum 1 weight 0.10000E+01 volume 0.10889E-02 ppm1 2.177 ppm2 4.430 CV 1
OR { 2294}
(( segid " " and resid 40 and name HG3 ))
(( segid " " and resid 40 and name HA ))
ASSI { 2295}
(( segid " " and resid 40 and name HG2 ))
(( segid " " and resid 40 and name HD2 ))
2.700 0.900 0.900 peak 2295 spectrum 1 weight 0.10000E+01 volume 0.28210E-02 ppm1 2.179 ppm2 3.877 CV 1
OR { 2295}
(( segid " " and resid 40 and name HG3 ))
(( segid " " and resid 40 and name HD2 ))
ASSI { 2296}
(( segid " " and resid 40 and name HG3 ))
(( segid " " and resid 42 and name HE3 ))
4.200 2.200 1.800 peak 2296 spectrum 1 weight 0.10000E+01 volume 0.42293E-03 ppm1 2.171 ppm2 3.097 CV 1
OR { 2296}
(( segid " " and resid 40 and name HG3 ))
(( segid " " and resid 42 and name HE2 ))
OR { 2296}
(( segid " " and resid 40 and name HG2 ))
(( segid " " and resid 42 and name HE3 ))
OR { 2296}
(( segid " " and resid 40 and name HG2 ))
(( segid " " and resid 42 and name HE2 ))
ASSI { 2297}
(( segid " " and resid 40 and name HG3 ))
(( segid " " and resid 43 and name HG2 ))
3.700 1.700 1.700 peak 2297 spectrum 1 weight 0.10000E+01 volume 0.84015E-03 ppm1 2.172 ppm2 2.928 CV 1
OR { 2297}
(( segid " " and resid 40 and name HG2 ))
(( segid " " and resid 43 and name HG2 ))
ASSI { 2298}
(( segid " " and resid 40 and name HG3 ))
(( segid " " and resid 42 and name HD3 ))
3.700 3.700 2.300 peak 2298 spectrum 1 weight 0.10000E+01 volume 0.11574E-02 ppm1 2.213 ppm2 1.781 CV 1
OR { 2298}
(( segid " " and resid 40 and name HG2 ))
(( segid " " and resid 42 and name HD3 ))
ASSI { 2300}
(( segid " " and resid 40 and name HG3 ))
(( segid " " and resid 42 and name HG2 ))
3.800 1.800 1.800 peak 2300 spectrum 1 weight 0.10000E+01 volume 0.16119E-02 ppm1 2.195 ppm2 1.572 CV 1
OR { 2300}
(( segid " " and resid 40 and name HG2 ))
(( segid " " and resid 42 and name HG3 ))
OR { 2300}
(( segid " " and resid 40 and name HG2 ))
(( segid " " and resid 42 and name HG2 ))
ASSI { 2301}
(( segid " " and resid 40 and name HG2 ))
( segid " " and resid 26 and name HB% )
3.900 1.900 1.900 peak 2301 spectrum 1 weight 0.10000E+01 volume 0.88422E-03 ppm1 2.177 ppm2 0.595 CV 1
OR { 2301}
(( segid " " and resid 40 and name HG3 ))
( segid " " and resid 26 and name HB% )
ASSI { 2302}
(( segid " " and resid 50 and name HG2 ))
(( segid " " and resid 53 and name HB3 ))
4.500 2.600 1.500 peak 2302 spectrum 1 weight 0.10000E+01 volume 0.48868E-03 ppm1 2.195 ppm2 3.201 CV 1
OR { 2302}
(( segid " " and resid 50 and name HG3 ))
(( segid " " and resid 53 and name HB3 ))
ASSI { 2303}
(( segid " " and resid 50 and name HG2 ))
( segid " " and resid 51 and name HB% )
3.600 3.600 2.400 peak 2303 spectrum 1 weight 0.10000E+01 volume 0.12155E-02 ppm1 2.199 ppm2 1.483 CV 1
ASSI { 2315}
(( segid " " and resid 44 and name HG12))
( segid " " and resid 20 and name HG2%)
4.400 2.400 1.600 peak 2315 spectrum 1 weight 0.10000E+01 volume 0.53264E-03 ppm1 1.845 ppm2 0.722 CV 1
OR { 2315}
(( segid " " and resid 44 and name HG12))
( segid " " and resid 20 and name HD1%)
ASSI { 2316}
(( segid " " and resid 44 and name HG12))
(( segid " " and resid 44 and name HA ))
3.200 1.200 1.200 peak 2316 spectrum 1 weight 0.10000E+01 volume 0.70621E-03 ppm1 1.844 ppm2 3.822 CV 1
ASSI { 2322}
(( segid " " and resid 44 and name HG12))
( segid " " and resid 44 and name HG2%)
3.000 1.100 1.100 peak 2322 spectrum 1 weight 0.10000E+01 volume 0.15310E-02 ppm1 1.842 ppm2 0.831 CV 1
ASSI { 2324}
(( segid " " and resid 44 and name HG12))
(( segid " " and resid 44 and name HG13))
2.100 0.600 0.600 peak 2324 spectrum 1 weight 0.10000E+01 volume 0.30331E-02 ppm1 1.842 ppm2 0.496 CV 1
ASSI { 2327}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 25 and name HB2 ))
1.800 0.400 0.400 peak 2327 spectrum 1 weight 0.10000E+01 volume 0.16731E-01 ppm1 2.212 ppm2 2.325 CV 1
OR { 2327}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 25 and name HG2 ))
ASSI { 2330}
(( segid " " and resid 40 and name HG3 ))
(( segid " " and resid 43 and name HN ))
4.400 2.400 1.600 peak 2330 spectrum 1 weight 0.10000E+01 volume 0.66564E-03 ppm1 2.175 ppm2 7.890 CV 1
OR { 2330}
(( segid " " and resid 40 and name HG2 ))
(( segid " " and resid 43 and name HN ))
ASSI { 2333}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HN ))
4.000 2.000 2.000 peak 2333 spectrum 1 weight 0.10000E+01 volume 0.69335E-03 ppm1 2.319 ppm2 7.974 CV 1
ASSI { 2334}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 25 and name HN ))
3.900 1.900 1.900 peak 2334 spectrum 1 weight 0.10000E+01 volume 0.65883E-03 ppm1 2.210 ppm2 7.978 CV 1
ASSI { 2336}
(( segid " " and resid 40 and name HG2 ))
(( segid " " and resid 41 and name HN ))
5.000 3.100 1.000 peak 2336 spectrum 1 weight 0.10000E+01 volume 0.41403E-03 ppm1 2.180 ppm2 8.476 CV 1
OR { 2336}
(( segid " " and resid 40 and name HG3 ))
(( segid " " and resid 41 and name HN ))
ASSI { 2340}
(( segid " " and resid 20 and name HG12))
(( segid " " and resid 67 and name HG3 ))
4.200 2.200 1.800 peak 2340 spectrum 1 weight 0.10000E+01 volume 0.96792E-03 ppm1 1.450 ppm2 2.264 CV 1
OR { 2340}
(( segid " " and resid 20 and name HG12))
(( segid " " and resid 67 and name HG2 ))
ASSI { 2341}
(( segid " " and resid 20 and name HG12))
(( segid " " and resid 20 and name HB ))
2.900 1.000 1.000 peak 2341 spectrum 1 weight 0.10000E+01 volume 0.24890E-02 ppm1 1.454 ppm2 1.824 CV 1
ASSI { 2342}
(( segid " " and resid 20 and name HG12))
(( segid " " and resid 17 and name HG12))
3.100 1.200 1.200 peak 2342 spectrum 1 weight 0.10000E+01 volume 0.22283E-02 ppm1 1.461 ppm2 1.550 CV 1
ASSI { 2353}
(( segid " " and resid 9 and name HD2 ))
(( segid " " and resid 9 and name HA ))
3.100 1.200 1.200 peak 2353 spectrum 1 weight 0.10000E+01 volume 0.34646E-02 ppm1 1.735 ppm2 4.342 CV 1
OR { 2353}
(( segid " " and resid 9 and name HD3 ))
(( segid " " and resid 9 and name HA ))
ASSI { 2357}
(( segid " " and resid 42 and name HD3 ))
(( segid " " and resid 42 and name HE2 ))
2.800 1.000 1.000 peak 2357 spectrum 1 weight 0.10000E+01 volume 0.26797E-02 ppm1 1.815 ppm2 3.103 CV 1
OR { 2357}
(( segid " " and resid 42 and name HD2 ))
(( segid " " and resid 42 and name HE3 ))
OR { 2357}
(( segid " " and resid 42 and name HD3 ))
(( segid " " and resid 42 and name HE3 ))
OR { 2357}
(( segid " " and resid 42 and name HD2 ))
(( segid " " and resid 42 and name HE2 ))
ASSI { 2359}
(( segid " " and resid 83 and name HD2 ))
(( segid " " and resid 83 and name HA ))
3.700 1.800 1.800 peak 2359 spectrum 1 weight 0.10000E+01 volume 0.74974E-03 ppm1 1.645 ppm2 4.434 CV 1
OR { 2359}
(( segid " " and resid 83 and name HD3 ))
(( segid " " and resid 83 and name HA ))
ASSI { 2361}
(( segid " " and resid 67 and name HB3 ))
( segid " " and resid 17 and name HG2%)
4.400 2.400 1.600 peak 2361 spectrum 1 weight 0.10000E+01 volume 0.47977E-03 ppm1 2.001 ppm2 0.782 CV 1
OR { 2361}
(( segid " " and resid 67 and name HB2 ))
( segid " " and resid 17 and name HG2%)
ASSI { 2362}
(( segid " " and resid 43 and name HB3 ))
(( segid " " and resid 44 and name HB ))
3.400 3.400 2.600 peak 2362 spectrum 1 weight 0.10000E+01 volume 0.24862E-02 ppm1 1.957 ppm2 2.118 CV 1
ASSI { 2364}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 9 and name HD2 ))
3.300 3.300 2.700 peak 2364 spectrum 1 weight 0.10000E+01 volume 0.14897E-02 ppm1 2.126 ppm2 1.736 CV 1
OR { 2364}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 9 and name HD3 ))
ASSI { 2365}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 6 and name HB2 ))
1.300 0.200 0.900 peak 2365 spectrum 1 weight 0.10000E+01 volume 0.12413E+00 ppm1 2.010 ppm2 2.081 CV 1
ASSI { 2371}
(( segid " " and resid 78 and name HB2 ))
(( segid " " and resid 78 and name HG2 ))
2.300 0.600 0.600 peak 2371 spectrum 1 weight 0.10000E+01 volume 0.10339E-01 ppm1 2.135 ppm2 2.354 CV 1
OR { 2371}
(( segid " " and resid 78 and name HB2 ))
(( segid " " and resid 78 and name HG3 ))
ASSI { 2372}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 9 and name HB3 ))
3.400 3.400 2.600 peak 2372 spectrum 1 weight 0.10000E+01 volume 0.11812E-02 ppm1 2.078 ppm2 1.799 CV 1
ASSI { 2374}
(( segid " " and resid 78 and name HB2 ))
(( segid " " and resid 80 and name HB3 ))
3.600 3.600 2.400 peak 2374 spectrum 1 weight 0.10000E+01 volume 0.69807E-03 ppm1 2.149 ppm2 1.789 CV 1
ASSI { 2378}
(( segid " " and resid 78 and name HB2 ))
( segid " " and resid 75 and name HG2%)
4.000 2.100 2.000 peak 2378 spectrum 1 weight 0.10000E+01 volume 0.47628E-03 ppm1 2.149 ppm2 0.843 CV 1
ASSI { 2385}
(( segid " " and resid 69 and name HB3 ))
(( segid " " and resid 17 and name HN ))
3.700 1.700 1.700 peak 2385 spectrum 1 weight 0.10000E+01 volume 0.43811E-03 ppm1 2.059 ppm2 8.819 CV 1
ASSI { 2386}
(( segid " " and resid 69 and name HB3 ))
(( segid " " and resid 66 and name HN ))
3.500 1.500 1.500 peak 2386 spectrum 1 weight 0.10000E+01 volume 0.69485E-03 ppm1 2.067 ppm2 8.020 CV 1
ASSI { 2387}
(( segid " " and resid 69 and name HB3 ))
(( segid " " and resid 69 and name HE21))
3.100 1.200 1.200 peak 2387 spectrum 1 weight 0.10000E+01 volume 0.53655E-03 ppm1 2.065 ppm2 7.577 CV 1
ASSI { 2389}
(( segid " " and resid 69 and name HB2 ))
(( segid " " and resid 66 and name HN ))
3.500 1.600 1.600 peak 2389 spectrum 1 weight 0.10000E+01 volume 0.69465E-03 ppm1 2.290 ppm2 8.019 CV 1
ASSI { 2391}
(( segid " " and resid 69 and name HB2 ))
(( segid " " and resid 69 and name HE21))
3.300 1.400 1.400 peak 2391 spectrum 1 weight 0.10000E+01 volume 0.56516E-03 ppm1 2.287 ppm2 7.575 CV 1
ASSI { 2396}
(( segid " " and resid 58 and name HB3 ))
(( segid " " and resid 58 and name HB2 ))
1.600 0.300 0.600 peak 2396 spectrum 1 weight 0.10000E+01 volume 0.25718E-01 ppm1 1.785 ppm2 1.881 CV 1
ASSI { 2400}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 43 and name HG2 ))
3.300 1.300 1.300 peak 2400 spectrum 1 weight 0.10000E+01 volume 0.41833E-03 ppm1 1.998 ppm2 2.919 CV 1
ASSI { 2402}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 50 and name HA ))
3.200 1.300 1.300 peak 2402 spectrum 1 weight 0.10000E+01 volume 0.20271E-02 ppm1 2.074 ppm2 4.565 CV 1
ASSI { 2403}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 50 and name HD3 ))
3.900 1.900 1.900 peak 2403 spectrum 1 weight 0.10000E+01 volume 0.12031E-02 ppm1 2.074 ppm2 4.180 CV 1
ASSI { 2407}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 25 and name HB2 ))
2.500 2.500 3.500 peak 2407 spectrum 1 weight 0.10000E+01 volume 0.23048E-02 ppm1 2.071 ppm2 2.322 CV 1
OR { 2407}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 25 and name HG2 ))
OR { 2407}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 25 and name HG3 ))
ASSI { 2408}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 50 and name HG2 ))
2.200 0.600 0.600 peak 2408 spectrum 1 weight 0.10000E+01 volume 0.10596E-01 ppm1 2.071 ppm2 2.196 CV 1
OR { 2408}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 50 and name HG3 ))
ASSI { 2410}
(( segid " " and resid 4 and name HB2 ))
(( segid " " and resid 4 and name HA ))
3.700 1.700 1.700 peak 2410 spectrum 1 weight 0.10000E+01 volume 0.68023E-03 ppm1 2.115 ppm2 4.448 CV 1
ASSI { 2411}
(( segid " " and resid 70 and name HB2 ))
( segid " " and resid 72 and name HD1%)
4.000 2.000 2.000 peak 2411 spectrum 1 weight 0.10000E+01 volume 0.42198E-03 ppm1 2.072 ppm2 0.878 CV 1
OR { 2411}
(( segid " " and resid 70 and name HB3 ))
( segid " " and resid 72 and name HD1%)
ASSI { 2412}
(( segid " " and resid 70 and name HB2 ))
( segid " " and resid 72 and name HD1%)
3.700 1.700 1.700 peak 2412 spectrum 1 weight 0.10000E+01 volume 0.48445E-03 ppm1 2.037 ppm2 0.869 CV 1
OR { 2412}
(( segid " " and resid 70 and name HB2 ))
( segid " " and resid 72 and name HG2%)
ASSI { 2429}
(( segid " " and resid 70 and name HB3 ))
(( segid " " and resid 17 and name HN ))
4.800 2.800 1.200 peak 2429 spectrum 1 weight 0.10000E+01 volume 0.55118E-03 ppm1 2.096 ppm2 8.813 CV 1
ASSI { 2430}
(( segid " " and resid 70 and name HB2 ))
(( segid " " and resid 70 and name HN ))
3.600 1.600 1.600 peak 2430 spectrum 1 weight 0.10000E+01 volume 0.20150E-02 ppm1 2.052 ppm2 8.669 CV 1
ASSI { 2432}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 62 and name HE2 ))
3.700 1.700 1.700 peak 2432 spectrum 1 weight 0.10000E+01 volume 0.11865E-02 ppm1 1.825 ppm2 3.047 CV 1
OR { 2432}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 62 and name HE3 ))
OR { 2432}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 62 and name HE2 ))
OR { 2432}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 62 and name HE3 ))
ASSI { 2434}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 58 and name HA ))
4.800 2.900 1.200 peak 2434 spectrum 1 weight 0.10000E+01 volume 0.51732E-03 ppm1 1.736 ppm2 4.658 CV 1
ASSI { 2438}
(( segid " " and resid 66 and name HB3 ))
(( segid " " and resid 69 and name HB3 ))
4.400 2.400 1.600 peak 2438 spectrum 1 weight 0.10000E+01 volume 0.71306E-03 ppm1 1.697 ppm2 2.056 CV 1
ASSI { 2441}
(( segid " " and resid 14 and name HB2 ))
( segid " " and resid 72 and name HD1%)
3.300 1.400 1.400 peak 2441 spectrum 1 weight 0.10000E+01 volume 0.97531E-03 ppm1 1.887 ppm2 0.865 CV 1
OR { 2441}
(( segid " " and resid 14 and name HB2 ))
( segid " " and resid 72 and name HG2%)
ASSI { 2443}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 14 and name HG3 ))
2.600 0.800 0.800 peak 2443 spectrum 1 weight 0.10000E+01 volume 0.33910E-02 ppm1 1.887 ppm2 1.399 CV 1
ASSI { 2446}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 35 and name HD2 ))
3.600 1.700 1.700 peak 2446 spectrum 1 weight 0.10000E+01 volume 0.67284E-03 ppm1 1.618 ppm2 3.086 CV 1
ASSI { 2447}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 35 and name HD3 ))
3.800 1.800 1.800 peak 2447 spectrum 1 weight 0.10000E+01 volume 0.65528E-03 ppm1 1.619 ppm2 2.991 CV 1
ASSI { 2452}
(( segid " " and resid 66 and name HB2 ))
(( segid " " and resid 66 and name HG3 ))
2.200 0.600 0.600 peak 2452 spectrum 1 weight 0.10000E+01 volume 0.92789E-02 ppm1 1.829 ppm2 1.602 CV 1
OR { 2452}
(( segid " " and resid 66 and name HB2 ))
(( segid " " and resid 66 and name HG2 ))
ASSI { 2456}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 9 and name HB2 ))
1.200 0.200 1.000 peak 2456 spectrum 1 weight 0.10000E+01 volume 0.12939E+00 ppm1 1.817 ppm2 1.883 CV 1
ASSI { 2458}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name HG2 ))
2.000 0.500 0.500 peak 2458 spectrum 1 weight 0.10000E+01 volume 0.15564E-01 ppm1 1.891 ppm2 1.497 CV 1
OR { 2458}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name HG3 ))
ASSI { 2459}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 9 and name HG3 ))
2.200 0.600 0.600 peak 2459 spectrum 1 weight 0.10000E+01 volume 0.11756E-01 ppm1 1.815 ppm2 1.501 CV 1
OR { 2459}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 9 and name HG2 ))
ASSI { 2469}
(( segid " " and resid 69 and name HG3 ))
(( segid " " and resid 69 and name HB2 ))
2.400 0.700 0.700 peak 2469 spectrum 1 weight 0.10000E+01 volume 0.69615E-02 ppm1 2.477 ppm2 2.312 CV 1
OR { 2469}
(( segid " " and resid 69 and name HG2 ))
(( segid " " and resid 69 and name HB2 ))
ASSI { 2470}
(( segid " " and resid 69 and name HG2 ))
(( segid " " and resid 69 and name HB3 ))
2.500 0.800 0.800 peak 2470 spectrum 1 weight 0.10000E+01 volume 0.47944E-02 ppm1 2.481 ppm2 2.073 CV 1
OR { 2470}
(( segid " " and resid 69 and name HG3 ))
(( segid " " and resid 69 and name HB3 ))
ASSI { 2472}
(( segid " " and resid 69 and name HG3 ))
(( segid " " and resid 66 and name HG2 ))
4.400 2.400 1.600 peak 2472 spectrum 1 weight 0.10000E+01 volume 0.56332E-03 ppm1 2.479 ppm2 1.570 CV 1
OR { 2472}
(( segid " " and resid 69 and name HG2 ))
(( segid " " and resid 66 and name HG2 ))
OR { 2472}
(( segid " " and resid 69 and name HG3 ))
(( segid " " and resid 66 and name HG3 ))
ASSI { 2473}
(( segid " " and resid 69 and name HG2 ))
( segid " " and resid 65 and name HD2%)
3.700 1.700 1.700 peak 2473 spectrum 1 weight 0.10000E+01 volume 0.65632E-03 ppm1 2.481 ppm2 0.631 CV 1
OR { 2473}
(( segid " " and resid 69 and name HG3 ))
( segid " " and resid 65 and name HD2%)
ASSI { 2476}
(( segid " " and resid 74 and name HG2 ))
(( segid " " and resid 74 and name HG3 ))
1.900 0.400 0.400 peak 2476 spectrum 1 weight 0.10000E+01 volume 0.88484E-02 ppm1 2.193 ppm2 2.320 CV 1
ASSI { 2480}
(( segid " " and resid 7 and name HG2 ))
(( segid " " and resid 9 and name HB3 ))
4.100 2.100 1.900 peak 2480 spectrum 1 weight 0.10000E+01 volume 0.45396E-03 ppm1 2.400 ppm2 1.830 CV 1
OR { 2480}
(( segid " " and resid 7 and name HG3 ))
(( segid " " and resid 9 and name HB3 ))
ASSI { 2492}
(( segid " " and resid 74 and name HG3 ))
(( segid " " and resid 74 and name HA ))
3.900 1.900 1.900 peak 2492 spectrum 1 weight 0.10000E+01 volume 0.72565E-03 ppm1 2.311 ppm2 5.132 CV 1
ASSI { 2493}
(( segid " " and resid 74 and name HG2 ))
(( segid " " and resid 74 and name HA ))
4.000 2.000 2.000 peak 2493 spectrum 1 weight 0.10000E+01 volume 0.80654E-03 ppm1 2.195 ppm2 5.124 CV 1
ASSI { 2497}
(( segid " " and resid 4 and name HG3 ))
(( segid " " and resid 4 and name HG2 ))
1.300 0.200 0.900 peak 2497 spectrum 1 weight 0.10000E+01 volume 0.10732E+00 ppm1 2.504 ppm2 2.559 CV 1
ASSI { 2499}
(( segid " " and resid 69 and name HG2 ))
(( segid " " and resid 17 and name HN ))
4.400 2.400 1.600 peak 2499 spectrum 1 weight 0.10000E+01 volume 0.48274E-03 ppm1 2.478 ppm2 8.805 CV 1
OR { 2499}
(( segid " " and resid 69 and name HG3 ))
(( segid " " and resid 17 and name HN ))
ASSI { 2500}
(( segid " " and resid 69 and name HG2 ))
(( segid " " and resid 70 and name HN ))
3.000 1.200 1.200 peak 2500 spectrum 1 weight 0.10000E+01 volume 0.24218E-02 ppm1 2.476 ppm2 8.672 CV 1
OR { 2500}
(( segid " " and resid 69 and name HG3 ))
(( segid " " and resid 70 and name HN ))
ASSI { 2501}
(( segid " " and resid 69 and name HG2 ))
(( segid " " and resid 66 and name HN ))
4.400 2.400 1.600 peak 2501 spectrum 1 weight 0.10000E+01 volume 0.63149E-03 ppm1 2.475 ppm2 8.017 CV 1
OR { 2501}
(( segid " " and resid 69 and name HG3 ))
(( segid " " and resid 66 and name HN ))
ASSI { 2502}
(( segid " " and resid 69 and name HG3 ))
(( segid " " and resid 69 and name HN ))
3.800 1.800 1.800 peak 2502 spectrum 1 weight 0.10000E+01 volume 0.14946E-02 ppm1 2.483 ppm2 7.713 CV 1
OR { 2502}
(( segid " " and resid 69 and name HG2 ))
(( segid " " and resid 69 and name HN ))
ASSI { 2503}
(( segid " " and resid 69 and name HG2 ))
(( segid " " and resid 69 and name HE21))
2.700 0.900 0.900 peak 2503 spectrum 1 weight 0.10000E+01 volume 0.37181E-02 ppm1 2.480 ppm2 7.555 CV 1
OR { 2503}
(( segid " " and resid 69 and name HG3 ))
(( segid " " and resid 69 and name HE21))
ASSI { 2504}
(( segid " " and resid 69 and name HG2 ))
(( segid " " and resid 69 and name HE22))
3.400 1.400 1.400 peak 2504 spectrum 1 weight 0.10000E+01 volume 0.21054E-02 ppm1 2.479 ppm2 7.326 CV 1
OR { 2504}
(( segid " " and resid 69 and name HG3 ))
(( segid " " and resid 69 and name HE22))
ASSI { 2505}
(( segid " " and resid 74 and name HG3 ))
(( segid " " and resid 74 and name HN ))
3.500 1.500 1.500 peak 2505 spectrum 1 weight 0.10000E+01 volume 0.84521E-03 ppm1 2.315 ppm2 8.640 CV 1
ASSI { 2506}
(( segid " " and resid 74 and name HG2 ))
(( segid " " and resid 74 and name HN ))
3.200 1.300 1.300 peak 2506 spectrum 1 weight 0.10000E+01 volume 0.93630E-03 ppm1 2.197 ppm2 8.639 CV 1
ASSI { 2509}
(( segid " " and resid 74 and name HG2 ))
(( segid " " and resid 74 and name HE21))
3.100 1.200 1.200 peak 2509 spectrum 1 weight 0.10000E+01 volume 0.90284E-03 ppm1 2.193 ppm2 7.336 CV 1
ASSI { 2510}
(( segid " " and resid 74 and name HG3 ))
(( segid " " and resid 74 and name HE22))
4.300 2.300 1.700 peak 2510 spectrum 1 weight 0.10000E+01 volume 0.61928E-03 ppm1 2.309 ppm2 6.986 CV 1
ASSI { 2511}
(( segid " " and resid 74 and name HG2 ))
(( segid " " and resid 74 and name HE22))
4.300 2.300 1.700 peak 2511 spectrum 1 weight 0.10000E+01 volume 0.60146E-03 ppm1 2.195 ppm2 6.982 CV 1
ASSI { 2512}
(( segid " " and resid 7 and name HG2 ))
(( segid " " and resid 7 and name HE22))
4.400 2.500 1.600 peak 2512 spectrum 1 weight 0.10000E+01 volume 0.57626E-03 ppm1 2.404 ppm2 6.894 CV 1
OR { 2512}
(( segid " " and resid 7 and name HG3 ))
(( segid " " and resid 7 and name HE22))
ASSI { 2516}
(( segid " " and resid 43 and name HG2 ))
(( segid " " and resid 43 and name HA ))
3.900 1.900 1.900 peak 2516 spectrum 1 weight 0.10000E+01 volume 0.53578E-03 ppm1 2.926 ppm2 4.966 CV 1
ASSI { 2517}
(( segid " " and resid 43 and name HG2 ))
(( segid " " and resid 43 and name HB2 ))
3.800 1.800 1.800 peak 2517 spectrum 1 weight 0.10000E+01 volume 0.51717E-03 ppm1 2.925 ppm2 3.112 CV 1
ASSI { 2518}
(( segid " " and resid 43 and name HG2 ))
(( segid " " and resid 43 and name HG3 ))
2.200 0.600 0.600 peak 2518 spectrum 1 weight 0.10000E+01 volume 0.33895E-02 ppm1 2.924 ppm2 2.200 CV 1
ASSI { 2519}
(( segid " " and resid 43 and name HG2 ))
(( segid " " and resid 43 and name HB3 ))
3.200 1.300 1.300 peak 2519 spectrum 1 weight 0.10000E+01 volume 0.11806E-02 ppm1 2.923 ppm2 1.966 CV 1
ASSI { 2521}
(( segid " " and resid 43 and name HG2 ))
(( segid " " and resid 42 and name HG2 ))
3.100 1.200 1.200 peak 2521 spectrum 1 weight 0.10000E+01 volume 0.86766E-03 ppm1 2.924 ppm2 1.574 CV 1
OR { 2521}
(( segid " " and resid 43 and name HG2 ))
(( segid " " and resid 42 and name HG3 ))
ASSI { 2523}
(( segid " " and resid 44 and name HB ))
(( segid " " and resid 44 and name HG12))
2.800 1.000 1.000 peak 2523 spectrum 1 weight 0.10000E+01 volume 0.24148E-02 ppm1 2.110 ppm2 1.863 CV 1
ASSI { 2527}
(( segid " " and resid 47 and name HG2 ))
(( segid " " and resid 70 and name HG3 ))
2.500 2.500 3.500 peak 2527 spectrum 1 weight 0.10000E+01 volume 0.48480E-02 ppm1 1.944 ppm2 2.132 CV 1
ASSI { 2528}
(( segid " " and resid 47 and name HG2 ))
(( segid " " and resid 47 and name HG3 ))
1.800 0.400 0.400 peak 2528 spectrum 1 weight 0.10000E+01 volume 0.18155E-01 ppm1 1.942 ppm2 1.764 CV 1
OR { 2528}
(( segid " " and resid 47 and name HG2 ))
(( segid " " and resid 47 and name HB3 ))
ASSI { 2532}
(( segid " " and resid 47 and name HG3 ))
(( segid " " and resid 70 and name HG3 ))
2.600 2.600 3.400 peak 2532 spectrum 1 weight 0.10000E+01 volume 0.43989E-02 ppm1 1.758 ppm2 2.131 CV 1
ASSI { 2533}
(( segid " " and resid 47 and name HG3 ))
(( segid " " and resid 47 and name HG2 ))
1.800 0.400 0.400 peak 2533 spectrum 1 weight 0.10000E+01 volume 0.12916E-01 ppm1 1.758 ppm2 1.940 CV 1
ASSI { 2535}
(( segid " " and resid 70 and name HG2 ))
(( segid " " and resid 69 and name HA ))
4.900 3.000 1.100 peak 2535 spectrum 1 weight 0.10000E+01 volume 0.42727E-03 ppm1 2.426 ppm2 4.229 CV 1
ASSI { 2539}
(( segid " " and resid 70 and name HG2 ))
(( segid " " and resid 16 and name HG2 ))
4.200 2.200 1.800 peak 2539 spectrum 1 weight 0.10000E+01 volume 0.57836E-03 ppm1 2.432 ppm2 1.351 CV 1
ASSI { 2540}
(( segid " " and resid 70 and name HG2 ))
(( segid " " and resid 14 and name HE3 ))
4.200 2.200 1.800 peak 2540 spectrum 1 weight 0.10000E+01 volume 0.45592E-03 ppm1 2.435 ppm2 3.006 CV 1
OR { 2540}
(( segid " " and resid 70 and name HG2 ))
(( segid " " and resid 14 and name HE2 ))
ASSI { 2542}
(( segid " " and resid 61 and name HB ))
(( segid " " and resid 62 and name HA ))
4.500 2.500 1.500 peak 2542 spectrum 1 weight 0.10000E+01 volume 0.40779E-03 ppm1 1.708 ppm2 4.158 CV 1
ASSI { 2550}
(( segid " " and resid 21 and name HG2 ))
(( segid " " and resid 22 and name HD3 ))
4.600 2.600 1.400 peak 2550 spectrum 1 weight 0.10000E+01 volume 0.44932E-03 ppm1 2.346 ppm2 4.083 CV 1
OR { 2550}
(( segid " " and resid 21 and name HG3 ))
(( segid " " and resid 22 and name HD3 ))
ASSI { 2551}
(( segid " " and resid 21 and name HG2 ))
(( segid " " and resid 22 and name HB2 ))
4.400 2.400 1.600 peak 2551 spectrum 1 weight 0.10000E+01 volume 0.57755E-03 ppm1 2.351 ppm2 2.554 CV 1
OR { 2551}
(( segid " " and resid 21 and name HG3 ))
(( segid " " and resid 22 and name HB2 ))
ASSI { 2553}
(( segid " " and resid 21 and name HG2 ))
(( segid " " and resid 24 and name HG ))
3.100 1.200 1.200 peak 2553 spectrum 1 weight 0.10000E+01 volume 0.30158E-02 ppm1 2.351 ppm2 1.747 CV 1
OR { 2553}
(( segid " " and resid 21 and name HG3 ))
(( segid " " and resid 24 and name HG ))
ASSI { 2554}
(( segid " " and resid 21 and name HG2 ))
( segid " " and resid 24 and name HD1%)
3.400 1.400 1.400 peak 2554 spectrum 1 weight 0.10000E+01 volume 0.32750E-02 ppm1 2.350 ppm2 1.112 CV 1
OR { 2554}
(( segid " " and resid 21 and name HG3 ))
( segid " " and resid 24 and name HD1%)
ASSI { 2555}
(( segid " " and resid 21 and name HG2 ))
( segid " " and resid 24 and name HD2%)
3.700 1.700 1.700 peak 2555 spectrum 1 weight 0.10000E+01 volume 0.12370E-02 ppm1 2.350 ppm2 0.986 CV 1
OR { 2555}
(( segid " " and resid 21 and name HG3 ))
( segid " " and resid 24 and name HD2%)
ASSI { 2556}
(( segid " " and resid 43 and name HG3 ))
(( segid " " and resid 42 and name HE3 ))
3.300 1.400 1.400 peak 2556 spectrum 1 weight 0.10000E+01 volume 0.46097E-03 ppm1 2.205 ppm2 3.085 CV 1
OR { 2556}
(( segid " " and resid 43 and name HG3 ))
(( segid " " and resid 42 and name HE2 ))
ASSI { 2560}
(( segid " " and resid 43 and name HG3 ))
(( segid " " and resid 42 and name HB2 ))
4.600 2.700 1.400 peak 2560 spectrum 1 weight 0.10000E+01 volume 0.75220E-03 ppm1 2.210 ppm2 2.082 CV 1
ASSI { 2561}
(( segid " " and resid 43 and name HG3 ))
(( segid " " and resid 43 and name HB3 ))
3.300 1.400 1.400 peak 2561 spectrum 1 weight 0.10000E+01 volume 0.13701E-02 ppm1 2.196 ppm2 1.947 CV 1
ASSI { 2563}
(( segid " " and resid 43 and name HG3 ))
(( segid " " and resid 42 and name HG2 ))
4.100 2.100 1.900 peak 2563 spectrum 1 weight 0.10000E+01 volume 0.10529E-02 ppm1 2.198 ppm2 1.574 CV 1
OR { 2563}
(( segid " " and resid 43 and name HG3 ))
(( segid " " and resid 42 and name HG3 ))
ASSI { 2566}
(( segid " " and resid 67 and name HG2 ))
(( segid " " and resid 19 and name HA ))
2.700 0.900 0.900 peak 2566 spectrum 1 weight 0.10000E+01 volume 0.26169E-02 ppm1 2.260 ppm2 4.741 CV 1
OR { 2566}
(( segid " " and resid 67 and name HG3 ))
(( segid " " and resid 19 and name HA ))
ASSI { 2567}
(( segid " " and resid 67 and name HG3 ))
(( segid " " and resid 66 and name HA ))
4.100 2.100 1.900 peak 2567 spectrum 1 weight 0.10000E+01 volume 0.13504E-02 ppm1 2.260 ppm2 4.558 CV 1
OR { 2567}
(( segid " " and resid 67 and name HG2 ))
(( segid " " and resid 66 and name HA ))
ASSI { 2568}
(( segid " " and resid 67 and name HG2 ))
(( segid " " and resid 17 and name HA ))
4.300 2.300 1.700 peak 2568 spectrum 1 weight 0.10000E+01 volume 0.47532E-03 ppm1 2.261 ppm2 4.293 CV 1
OR { 2568}
(( segid " " and resid 67 and name HG3 ))
(( segid " " and resid 17 and name HA ))
ASSI { 2569}
(( segid " " and resid 67 and name HG2 ))
(( segid " " and resid 67 and name HA ))
2.500 0.800 0.800 peak 2569 spectrum 1 weight 0.10000E+01 volume 0.52322E-02 ppm1 2.260 ppm2 3.650 CV 1
OR { 2569}
(( segid " " and resid 67 and name HG3 ))
(( segid " " and resid 67 and name HA ))
ASSI { 2573}
(( segid " " and resid 67 and name HG2 ))
(( segid " " and resid 67 and name HB3 ))
1.900 0.500 0.500 peak 2573 spectrum 1 weight 0.10000E+01 volume 0.25156E-01 ppm1 2.260 ppm2 1.999 CV 1
OR { 2573}
(( segid " " and resid 67 and name HG3 ))
(( segid " " and resid 67 and name HB2 ))
OR { 2573}
(( segid " " and resid 67 and name HG2 ))
(( segid " " and resid 67 and name HB2 ))
OR { 2573}
(( segid " " and resid 67 and name HG3 ))
(( segid " " and resid 67 and name HB3 ))
ASSI { 2575}
(( segid " " and resid 67 and name HG3 ))
(( segid " " and resid 66 and name HG2 ))
4.300 2.300 1.700 peak 2575 spectrum 1 weight 0.10000E+01 volume 0.64958E-03 ppm1 2.258 ppm2 1.577 CV 1
OR { 2575}
(( segid " " and resid 67 and name HG3 ))
(( segid " " and resid 66 and name HG3 ))
OR { 2575}
(( segid " " and resid 67 and name HG2 ))
(( segid " " and resid 66 and name HG2 ))
OR { 2575}
(( segid " " and resid 67 and name HG2 ))
(( segid " " and resid 66 and name HG3 ))
ASSI { 2582}
(( segid " " and resid 47 and name HG3 ))
(( segid " " and resid 47 and name HN ))
4.200 2.200 1.800 peak 2582 spectrum 1 weight 0.10000E+01 volume 0.87512E-03 ppm1 1.757 ppm2 8.899 CV 1
ASSI { 2586}
(( segid " " and resid 47 and name HG3 ))
(( segid " " and resid 48 and name HN ))
3.900 1.900 1.900 peak 2586 spectrum 1 weight 0.10000E+01 volume 0.48103E-03 ppm1 1.762 ppm2 7.794 CV 1
ASSI { 2588}
(( segid " " and resid 70 and name HG3 ))
(( segid " " and resid 70 and name HN ))
3.700 1.700 1.700 peak 2588 spectrum 1 weight 0.10000E+01 volume 0.16783E-02 ppm1 2.144 ppm2 8.661 CV 1
ASSI { 2594}
(( segid " " and resid 70 and name HG2 ))
(( segid " " and resid 70 and name HN ))
2.700 0.900 0.900 peak 2594 spectrum 1 weight 0.10000E+01 volume 0.17879E-02 ppm1 2.429 ppm2 8.665 CV 1
ASSI { 2598}
(( segid " " and resid 21 and name HG2 ))
(( segid " " and resid 24 and name HN ))
3.300 1.300 1.300 peak 2598 spectrum 1 weight 0.10000E+01 volume 0.29336E-02 ppm1 2.349 ppm2 7.334 CV 1
OR { 2598}
(( segid " " and resid 21 and name HG3 ))
(( segid " " and resid 24 and name HN ))
ASSI { 2600}
(( segid " " and resid 21 and name HG3 ))
(( segid " " and resid 21 and name HA ))
2.900 1.100 1.100 peak 2600 spectrum 1 weight 0.10000E+01 volume 0.18161E-02 ppm1 2.350 ppm2 5.340 CV 1
OR { 2600}
(( segid " " and resid 21 and name HG2 ))
(( segid " " and resid 21 and name HA ))
ASSI { 2601}
(( segid " " and resid 43 and name HG3 ))
(( segid " " and resid 43 and name HA ))
4.300 2.300 1.700 peak 2601 spectrum 1 weight 0.10000E+01 volume 0.55063E-03 ppm1 2.195 ppm2 4.964 CV 1
ASSI { 2603}
(( segid " " and resid 67 and name HG2 ))
(( segid " " and resid 20 and name HN ))
3.200 1.200 1.200 peak 2603 spectrum 1 weight 0.10000E+01 volume 0.18699E-02 ppm1 2.260 ppm2 9.366 CV 1
OR { 2603}
(( segid " " and resid 67 and name HG3 ))
(( segid " " and resid 20 and name HN ))
ASSI { 2607}
(( segid " " and resid 67 and name HG2 ))
(( segid " " and resid 17 and name HN ))
4.000 2.000 2.000 peak 2607 spectrum 1 weight 0.10000E+01 volume 0.12242E-02 ppm1 2.259 ppm2 8.820 CV 1
OR { 2607}
(( segid " " and resid 67 and name HG3 ))
(( segid " " and resid 17 and name HN ))
ASSI { 2608}
(( segid " " and resid 67 and name HG2 ))
(( segid " " and resid 19 and name HN ))
3.700 1.700 1.700 peak 2608 spectrum 1 weight 0.10000E+01 volume 0.52642E-03 ppm1 2.259 ppm2 7.400 CV 1
OR { 2608}
(( segid " " and resid 67 and name HG3 ))
(( segid " " and resid 19 and name HN ))
ASSI { 2610}
(( segid " " and resid 73 and name HB ))
(( segid " " and resid 74 and name HN ))
2.900 1.100 1.100 peak 2610 spectrum 1 weight 0.10000E+01 volume 0.14998E-02 ppm1 1.947 ppm2 8.653 CV 1
ASSI { 2613}
(( segid " " and resid 34 and name HG3 ))
(( segid " " and resid 34 and name HN ))
4.300 2.300 1.700 peak 2613 spectrum 1 weight 0.10000E+01 volume 0.55503E-03 ppm1 2.254 ppm2 8.695 CV 1
ASSI { 2616}
(( segid " " and resid 79 and name HG2 ))
(( segid " " and resid 80 and name HN ))
4.300 2.300 1.700 peak 2616 spectrum 1 weight 0.10000E+01 volume 0.57524E-03 ppm1 2.342 ppm2 8.202 CV 1
OR { 2616}
(( segid " " and resid 79 and name HG3 ))
(( segid " " and resid 80 and name HN ))
ASSI { 2617}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 35 and name HN ))
4.200 2.200 1.800 peak 2617 spectrum 1 weight 0.10000E+01 volume 0.48065E-03 ppm1 2.320 ppm2 7.681 CV 1
ASSI { 2620}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 25 and name HN ))
3.000 1.200 1.200 peak 2620 spectrum 1 weight 0.10000E+01 volume 0.17243E-02 ppm1 2.309 ppm2 7.978 CV 1
OR { 2620}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 25 and name HN ))
ASSI { 2624}
(( segid " " and resid 6 and name HG3 ))
(( segid " " and resid 6 and name HA ))
2.900 1.100 1.100 peak 2624 spectrum 1 weight 0.10000E+01 volume 0.32203E-02 ppm1 2.312 ppm2 4.293 CV 1
OR { 2624}
(( segid " " and resid 6 and name HG2 ))
(( segid " " and resid 6 and name HA ))
ASSI { 2627}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 34 and name HA ))
3.000 1.100 1.100 peak 2627 spectrum 1 weight 0.10000E+01 volume 0.30506E-02 ppm1 2.323 ppm2 3.938 CV 1
ASSI { 2633}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 6 and name HN ))
2.600 0.800 0.800 peak 2633 spectrum 1 weight 0.11000E+01 volume 0.46136E-02 ppm1 4.363 ppm2 8.373 CV 1
ASSI { 2635}
(( segid " " and resid 12 and name HB ))
(( segid " " and resid 12 and name HA ))
3.000 1.200 1.200 peak 2635 spectrum 1 weight 0.11000E+01 volume 0.13441E-02 ppm1 1.546 ppm2 4.728 CV 1
ASSI { 2638}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 13 and name HA ))
3.500 1.500 1.500 peak 2638 spectrum 1 weight 0.11000E+01 volume 0.10401E-02 ppm1 2.432 ppm2 4.913 CV 1
ASSI { 2639}
(( segid " " and resid 13 and name HB3 ))
(( segid " " and resid 13 and name HA ))
3.000 1.100 1.100 peak 2639 spectrum 1 weight 0.11000E+01 volume 0.14415E-02 ppm1 3.306 ppm2 4.910 CV 1
ASSI { 2640}
(( segid " " and resid 13 and name HB3 ))
(( segid " " and resid 13 and name HB2 ))
2.300 0.700 0.700 peak 2640 spectrum 1 weight 0.11000E+01 volume 0.31629E-02 ppm1 3.309 ppm2 2.445 CV 1
ASSI { 2651}
(( segid " " and resid 15 and name HA1 ))
(( segid " " and resid 15 and name HA2 ))
2.100 0.500 0.500 peak 2651 spectrum 1 weight 0.11000E+01 volume 0.56117E-02 ppm1 5.014 ppm2 3.162 CV 1
ASSI { 2657}
(( segid " " and resid 15 and name HA2 ))
(( segid " " and resid 31 and name HA ))
3.300 1.400 1.400 peak 2657 spectrum 1 weight 0.11000E+01 volume 0.15319E-02 ppm1 3.161 ppm2 5.270 CV 1
ASSI { 2660}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 71 and name HN ))
3.600 1.600 1.600 peak 2660 spectrum 1 weight 0.11000E+01 volume 0.15640E-02 ppm1 5.260 ppm2 8.622 CV 1
ASSI { 2662}
(( segid " " and resid 17 and name HB ))
(( segid " " and resid 18 and name HN ))
3.600 1.600 1.600 peak 2662 spectrum 1 weight 0.11000E+01 volume 0.13524E-02 ppm1 2.387 ppm2 9.228 CV 1
ASSI { 2664}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 68 and name HN ))
2.900 1.100 1.100 peak 2664 spectrum 1 weight 0.11000E+01 volume 0.73270E-02 ppm1 0.773 ppm2 9.223 CV 1
ASSI { 2666}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HN ))
2.700 0.900 0.900 peak 2666 spectrum 1 weight 0.11000E+01 volume 0.23476E-02 ppm1 4.522 ppm2 9.224 CV 1
ASSI { 2672}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 27 and name HA ))
2.600 0.800 0.800 peak 2672 spectrum 1 weight 0.11000E+01 volume 0.28525E-02 ppm1 4.272 ppm2 5.006 CV 1
ASSI { 2674}
(( segid " " and resid 20 and name HB ))
(( segid " " and resid 20 and name HA ))
3.300 1.300 1.300 peak 2674 spectrum 1 weight 0.11000E+01 volume 0.95068E-03 ppm1 1.831 ppm2 4.276 CV 1
ASSI { 2677}
( segid " " and resid 20 and name HG2%)
( segid " " and resid 61 and name HG2%)
1.900 0.500 0.500 peak 2677 spectrum 1 weight 0.11000E+01 volume 0.16739E-01 ppm1 0.707 ppm2 0.884 CV 1
ASSI { 2679}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 21 and name HA ))
4.100 2.100 1.900 peak 2679 spectrum 1 weight 0.11000E+01 volume 0.48183E-03 ppm1 4.203 ppm2 5.342 CV 1
ASSI { 2680}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HB2 ))
2.600 0.900 0.900 peak 2680 spectrum 1 weight 0.11000E+01 volume 0.63680E-02 ppm1 4.203 ppm2 2.555 CV 1
ASSI { 2681}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HB3 ))
2.600 0.800 0.800 peak 2681 spectrum 1 weight 0.11000E+01 volume 0.28895E-02 ppm1 4.204 ppm2 2.192 CV 1
ASSI { 2682}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HG2 ))
3.600 1.700 1.700 peak 2682 spectrum 1 weight 0.11000E+01 volume 0.19168E-02 ppm1 4.205 ppm2 2.339 CV 1
ASSI { 2683}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HG3 ))
3.300 1.400 1.400 peak 2683 spectrum 1 weight 0.11000E+01 volume 0.18719E-02 ppm1 4.204 ppm2 1.893 CV 1
ASSI { 2685}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 26 and name HN ))
3.400 1.500 1.500 peak 2685 spectrum 1 weight 0.11000E+01 volume 0.11223E-02 ppm1 4.206 ppm2 7.316 CV 1
ASSI { 2688}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 22 and name HB2 ))
1.800 0.400 0.400 peak 2688 spectrum 1 weight 0.11000E+01 volume 0.11634E-01 ppm1 2.192 ppm2 2.552 CV 1
ASSI { 2689}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 22 and name HD2 ))
3.500 1.600 1.600 peak 2689 spectrum 1 weight 0.11000E+01 volume 0.10826E-02 ppm1 2.552 ppm2 3.898 CV 1
ASSI { 2690}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 22 and name HG3 ))
3.000 1.100 1.100 peak 2690 spectrum 1 weight 0.11000E+01 volume 0.35234E-02 ppm1 2.553 ppm2 1.892 CV 1
ASSI { 2695}
(( segid " " and resid 22 and name HD3 ))
(( segid " " and resid 22 and name HD2 ))
1.800 0.400 0.400 peak 2695 spectrum 1 weight 0.11000E+01 volume 0.10937E-01 ppm1 4.108 ppm2 3.905 CV 1
ASSI { 2697}
(( segid " " and resid 22 and name HD2 ))
(( segid " " and resid 22 and name HG2 ))
2.500 0.800 0.800 peak 2697 spectrum 1 weight 0.11000E+01 volume 0.26176E-02 ppm1 3.903 ppm2 2.343 CV 1
ASSI { 2698}
(( segid " " and resid 22 and name HD3 ))
(( segid " " and resid 22 and name HG2 ))
3.000 1.100 1.100 peak 2698 spectrum 1 weight 0.11000E+01 volume 0.29803E-02 ppm1 4.108 ppm2 2.345 CV 1
ASSI { 2699}
(( segid " " and resid 22 and name HD2 ))
(( segid " " and resid 22 and name HG3 ))
3.100 1.200 1.200 peak 2699 spectrum 1 weight 0.11000E+01 volume 0.29045E-02 ppm1 3.903 ppm2 1.885 CV 1
ASSI { 2700}
(( segid " " and resid 22 and name HD3 ))
(( segid " " and resid 22 and name HG3 ))
2.500 0.800 0.800 peak 2700 spectrum 1 weight 0.11000E+01 volume 0.23601E-02 ppm1 4.107 ppm2 1.881 CV 1
ASSI { 2707}
(( segid " " and resid 22 and name HG3 ))
(( segid " " and resid 22 and name HG2 ))
1.800 0.400 0.400 peak 2707 spectrum 1 weight 0.11000E+01 volume 0.94424E-02 ppm1 1.888 ppm2 2.340 CV 1
ASSI { 2709}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HB2 ))
2.400 0.700 0.700 peak 2709 spectrum 1 weight 0.11000E+01 volume 0.71614E-02 ppm1 4.368 ppm2 4.054 CV 1
OR { 2709}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HB3 ))
ASSI { 2711}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 24 and name HA ))
3.400 1.400 1.400 peak 2711 spectrum 1 weight 0.11000E+01 volume 0.10312E-02 ppm1 1.711 ppm2 4.649 CV 1
ASSI { 2712}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 24 and name HA ))
3.100 1.200 1.200 peak 2712 spectrum 1 weight 0.11000E+01 volume 0.11322E-02 ppm1 1.858 ppm2 4.648 CV 1
ASSI { 2714}
(( segid " " and resid 24 and name HB2 ))
( segid " " and resid 24 and name HD1%)
2.800 1.000 1.000 peak 2714 spectrum 1 weight 0.11000E+01 volume 0.16095E-02 ppm1 1.717 ppm2 1.111 CV 1
ASSI { 2715}
(( segid " " and resid 24 and name HB3 ))
( segid " " and resid 24 and name HD1%)
3.700 1.700 1.700 peak 2715 spectrum 1 weight 0.11000E+01 volume 0.16085E-02 ppm1 1.862 ppm2 1.111 CV 1
ASSI { 2716}
(( segid " " and resid 24 and name HB2 ))
( segid " " and resid 24 and name HD2%)
3.300 1.300 1.300 peak 2716 spectrum 1 weight 0.11000E+01 volume 0.13566E-02 ppm1 1.716 ppm2 0.980 CV 1
ASSI { 2720}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 24 and name HA ))
4.000 2.000 2.000 peak 2720 spectrum 1 weight 0.11000E+01 volume 0.92015E-03 ppm1 1.111 ppm2 4.652 CV 1
ASSI { 2721}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 24 and name HN ))
2.700 0.900 0.900 peak 2721 spectrum 1 weight 0.11000E+01 volume 0.28716E-02 ppm1 1.109 ppm2 7.319 CV 1
ASSI { 2722}
( segid " " and resid 24 and name HD2%)
(( segid " " and resid 24 and name HA ))
3.100 1.200 1.200 peak 2722 spectrum 1 weight 0.11000E+01 volume 0.92878E-02 ppm1 0.969 ppm2 4.660 CV 1
ASSI { 2723}
( segid " " and resid 24 and name HD2%)
(( segid " " and resid 24 and name HB3 ))
2.400 0.700 0.700 peak 2723 spectrum 1 weight 0.11000E+01 volume 0.51346E-02 ppm1 0.972 ppm2 1.856 CV 1
ASSI { 2724}
( segid " " and resid 24 and name HD2%)
(( segid " " and resid 24 and name HN ))
3.900 1.900 1.900 peak 2724 spectrum 1 weight 0.11000E+01 volume 0.20182E-02 ppm1 0.970 ppm2 7.295 CV 1
ASSI { 2725}
(( segid " " and resid 24 and name HG ))
(( segid " " and resid 24 and name HN ))
2.700 0.900 0.900 peak 2725 spectrum 1 weight 0.11000E+01 volume 0.11772E-02 ppm1 1.765 ppm2 7.308 CV 1
ASSI { 2727}
(( segid " " and resid 25 and name HA ))
( segid " " and resid 26 and name HB% )
4.000 2.000 2.000 peak 2727 spectrum 1 weight 0.11000E+01 volume 0.70231E-03 ppm1 3.790 ppm2 0.578 CV 1
ASSI { 2730}
( segid " " and resid 26 and name HB% )
(( segid " " and resid 26 and name HA ))
2.400 0.700 0.700 peak 2730 spectrum 1 weight 0.11000E+01 volume 0.52480E-02 ppm1 0.573 ppm2 4.651 CV 1
ASSI { 2732}
( segid " " and resid 26 and name HB% )
( segid " " and resid 38 and name HD% )
3.500 1.500 1.500 peak 2732 spectrum 1 weight 0.11000E+01 volume 0.86780E-03 ppm1 0.568 ppm2 6.860 CV 1
ASSI { 2733}
( segid " " and resid 26 and name HB% )
( segid " " and resid 38 and name HE% )
2.900 1.000 1.000 peak 2733 spectrum 1 weight 0.11000E+01 volume 0.23639E-02 ppm1 0.565 ppm2 7.176 CV 1
ASSI { 2734}
( segid " " and resid 26 and name HB% )
(( segid " " and resid 39 and name HN ))
3.400 1.400 1.400 peak 2734 spectrum 1 weight 0.11000E+01 volume 0.86314E-03 ppm1 0.572 ppm2 8.885 CV 1
ASSI { 2735}
( segid " " and resid 26 and name HB% )
(( segid " " and resid 40 and name HA ))
2.400 0.700 0.700 peak 2735 spectrum 1 weight 0.11000E+01 volume 0.39645E-02 ppm1 0.573 ppm2 4.428 CV 1
ASSI { 2741}
(( segid " " and resid 28 and name HA ))
( segid " " and resid 28 and name HD% )
3.400 1.500 1.500 peak 2741 spectrum 1 weight 0.11000E+01 volume 0.70519E-03 ppm1 5.614 ppm2 7.122 CV 1
ASSI { 2743}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 38 and name HA ))
2.800 1.000 1.000 peak 2743 spectrum 1 weight 0.11000E+01 volume 0.20469E-02 ppm1 5.610 ppm2 4.627 CV 1
ASSI { 2744}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 39 and name HN ))
3.600 1.600 1.600 peak 2744 spectrum 1 weight 0.11000E+01 volume 0.97613E-03 ppm1 5.610 ppm2 8.880 CV 1
ASSI { 2745}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HA ))
3.500 1.600 1.600 peak 2745 spectrum 1 weight 0.11000E+01 volume 0.79388E-03 ppm1 2.937 ppm2 5.601 CV 1
ASSI { 2747}
(( segid " " and resid 28 and name HB2 ))
( segid " " and resid 28 and name HD% )
3.400 1.400 1.400 peak 2747 spectrum 1 weight 0.11000E+01 volume 0.66769E-03 ppm1 2.933 ppm2 7.123 CV 1
ASSI { 2749}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 28 and name HN ))
3.900 1.900 1.900 peak 2749 spectrum 1 weight 0.11000E+01 volume 0.12684E-02 ppm1 2.997 ppm2 8.978 CV 1
ASSI { 2750}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 29 and name HN ))
3.900 1.900 1.900 peak 2750 spectrum 1 weight 0.11000E+01 volume 0.12305E-02 ppm1 2.933 ppm2 8.987 CV 1
ASSI { 2753}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HB2 ))
2.900 1.100 1.100 peak 2753 spectrum 1 weight 0.11000E+01 volume 0.15581E-02 ppm1 5.081 ppm2 2.137 CV 1
ASSI { 2754}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HB3 ))
3.400 1.400 1.400 peak 2754 spectrum 1 weight 0.11000E+01 volume 0.12308E-02 ppm1 5.077 ppm2 2.766 CV 1
ASSI { 2758}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 30 and name HB2 ))
2.100 0.600 0.600 peak 2758 spectrum 1 weight 0.11000E+01 volume 0.48083E-02 ppm1 2.772 ppm2 2.140 CV 1
ASSI { 2760}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 16 and name HN ))
3.700 1.700 1.700 peak 2760 spectrum 1 weight 0.11000E+01 volume 0.71716E-03 ppm1 5.275 ppm2 8.118 CV 1
ASSI { 2761}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HB2 ))
2.600 0.800 0.800 peak 2761 spectrum 1 weight 0.11000E+01 volume 0.41851E-02 ppm1 5.277 ppm2 3.149 CV 1
ASSI { 2762}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HB3 ))
2.600 0.900 0.900 peak 2762 spectrum 1 weight 0.11000E+01 volume 0.34478E-02 ppm1 5.277 ppm2 2.170 CV 1
ASSI { 2773}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 34 and name HA ))
4.100 2.100 1.900 peak 2773 spectrum 1 weight 0.11000E+01 volume 0.66095E-03 ppm1 4.478 ppm2 3.933 CV 1
ASSI { 2776}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HB3 ))
2.300 0.700 0.700 peak 2776 spectrum 1 weight 0.11000E+01 volume 0.90660E-02 ppm1 3.933 ppm2 2.038 CV 1
OR { 2776}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HB2 ))
ASSI { 2782}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HB3 ))
2.800 1.000 1.000 peak 2782 spectrum 1 weight 0.11000E+01 volume 0.18707E-02 ppm1 5.091 ppm2 3.333 CV 1
ASSI { 2786}
(( segid " " and resid 36 and name HB3 ))
(( segid " " and resid 36 and name HB2 ))
2.100 0.600 0.600 peak 2786 spectrum 1 weight 0.11000E+01 volume 0.48992E-02 ppm1 3.330 ppm2 3.114 CV 1
ASSI { 2789}
(( segid " " and resid 37 and name HA1 ))
(( segid " " and resid 37 and name HA2 ))
2.200 0.600 0.600 peak 2789 spectrum 1 weight 0.11000E+01 volume 0.36608E-02 ppm1 5.143 ppm2 3.624 CV 1
ASSI { 2792}
(( segid " " and resid 37 and name HA1 ))
(( segid " " and resid 37 and name HN ))
3.600 1.700 1.700 peak 2792 spectrum 1 weight 0.11000E+01 volume 0.68143E-03 ppm1 5.144 ppm2 9.792 CV 1
ASSI { 2798}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 39 and name HA ))
3.300 1.400 1.400 peak 2798 spectrum 1 weight 0.11000E+01 volume 0.55521E-03 ppm1 0.644 ppm2 4.984 CV 1
ASSI { 2799}
(( segid " " and resid 39 and name HB3 ))
(( segid " " and resid 39 and name HA ))
3.600 1.600 1.600 peak 2799 spectrum 1 weight 0.11000E+01 volume 0.60291E-03 ppm1 1.679 ppm2 4.982 CV 1
ASSI { 2800}
( segid " " and resid 39 and name HD2%)
(( segid " " and resid 39 and name HB3 ))
2.900 1.000 1.000 peak 2800 spectrum 1 weight 0.11000E+01 volume 0.20898E-02 ppm1 0.315 ppm2 1.691 CV 1
ASSI { 2803}
(( segid " " and resid 40 and name HB3 ))
( segid " " and resid 38 and name HE% )
3.200 3.200 2.800 peak 2803 spectrum 1 weight 0.11000E+01 volume 0.53501E-03 ppm1 2.567 ppm2 7.181 CV 1
ASSI { 2804}
(( segid " " and resid 40 and name HG3 ))
( segid " " and resid 38 and name HE% )
2.900 2.900 3.100 peak 2804 spectrum 1 weight 0.11000E+01 volume 0.10746E-02 ppm1 2.180 ppm2 7.181 CV 1
ASSI { 2810}
( segid " " and resid 44 and name HG2%)
( segid " " and resid 49 and name HD% )
3.000 3.000 3.000 peak 2810 spectrum 1 weight 0.11000E+01 volume 0.15622E-02 ppm1 0.827 ppm2 6.964 CV 1
ASSI { 2811}
( segid " " and resid 44 and name HG2%)
( segid " " and resid 49 and name HE% )
2.700 2.700 3.300 peak 2811 spectrum 1 weight 0.11000E+01 volume 0.20197E-02 ppm1 0.831 ppm2 7.066 CV 1
ASSI { 2813}
(( segid " " and resid 45 and name HA ))
( segid " " and resid 49 and name HE% )
4.000 2.000 2.000 peak 2813 spectrum 1 weight 0.11000E+01 volume 0.28692E-03 ppm1 4.107 ppm2 7.070 CV 1
ASSI { 2822}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 48 and name HN ))
3.500 1.500 1.500 peak 2822 spectrum 1 weight 0.11000E+01 volume 0.65489E-03 ppm1 3.380 ppm2 7.791 CV 1
ASSI { 2824}
(( segid " " and resid 46 and name HA ))
( segid " " and resid 49 and name HE% )
3.300 1.400 1.400 peak 2824 spectrum 1 weight 0.11000E+01 volume 0.77458E-03 ppm1 3.380 ppm2 7.076 CV 1
ASSI { 2825}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 49 and name HN ))
3.300 1.400 1.400 peak 2825 spectrum 1 weight 0.11000E+01 volume 0.79539E-03 ppm1 3.378 ppm2 7.910 CV 1
ASSI { 2826}
(( segid " " and resid 46 and name HD2 ))
( segid " " and resid 49 and name HD% )
4.500 2.500 1.500 peak 2826 spectrum 1 weight 0.11000E+01 volume 0.21420E-03 ppm1 2.971 ppm2 6.957 CV 1
OR { 2826}
(( segid " " and resid 46 and name HD3 ))
( segid " " and resid 49 and name HD% )
ASSI { 2827}
(( segid " " and resid 46 and name HD2 ))
( segid " " and resid 49 and name HE% )
4.000 2.000 2.000 peak 2827 spectrum 1 weight 0.11000E+01 volume 0.33599E-03 ppm1 2.971 ppm2 7.088 CV 1
OR { 2827}
(( segid " " and resid 46 and name HD3 ))
( segid " " and resid 49 and name HE% )
ASSI { 2828}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 49 and name HZ ))
4.400 2.400 1.600 peak 2828 spectrum 1 weight 0.11000E+01 volume 0.27636E-03 ppm1 2.977 ppm2 7.237 CV 1
OR { 2828}
(( segid " " and resid 46 and name HD3 ))
(( segid " " and resid 49 and name HZ ))
ASSI { 2829}
(( segid " " and resid 46 and name HG3 ))
( segid " " and resid 49 and name HD% )
4.100 2.100 1.900 peak 2829 spectrum 1 weight 0.11000E+01 volume 0.28667E-03 ppm1 1.568 ppm2 6.957 CV 1
OR { 2829}
(( segid " " and resid 46 and name HG2 ))
( segid " " and resid 49 and name HD% )
ASSI { 2830}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HG2 ))
3.700 1.700 1.700 peak 2830 spectrum 1 weight 0.11000E+01 volume 0.15899E-02 ppm1 4.078 ppm2 1.937 CV 1
ASSI { 2838}
(( segid " " and resid 49 and name HB3 ))
( segid " " and resid 49 and name HD% )
3.400 1.400 1.400 peak 2838 spectrum 1 weight 0.11000E+01 volume 0.71217E-03 ppm1 3.377 ppm2 6.954 CV 1
ASSI { 2840}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 52 and name HN ))
3.600 1.600 1.600 peak 2840 spectrum 1 weight 0.11000E+01 volume 0.99126E-03 ppm1 4.570 ppm2 8.528 CV 1
ASSI { 2842}
(( segid " " and resid 50 and name HD3 ))
(( segid " " and resid 50 and name HG2 ))
2.900 1.000 1.000 peak 2842 spectrum 1 weight 0.11000E+01 volume 0.19289E-02 ppm1 4.168 ppm2 2.194 CV 1
OR { 2842}
(( segid " " and resid 50 and name HD3 ))
(( segid " " and resid 50 and name HG3 ))
ASSI { 2843}
(( segid " " and resid 50 and name HG3 ))
(( segid " " and resid 50 and name HA ))
3.500 1.500 1.500 peak 2843 spectrum 1 weight 0.11000E+01 volume 0.10441E-02 ppm1 2.200 ppm2 4.571 CV 1
OR { 2843}
(( segid " " and resid 50 and name HG2 ))
(( segid " " and resid 50 and name HA ))
ASSI { 2850}
( segid " " and resid 51 and name HB% )
(( segid " " and resid 51 and name HA ))
2.200 0.600 0.600 peak 2850 spectrum 1 weight 0.11000E+01 volume 0.10386E-01 ppm1 1.467 ppm2 4.217 CV 1
ASSI { 2852}
( segid " " and resid 51 and name HB% )
(( segid " " and resid 52 and name HN ))
3.400 1.400 1.400 peak 2852 spectrum 1 weight 0.11000E+01 volume 0.11734E-02 ppm1 1.465 ppm2 8.526 CV 1
ASSI { 2853}
( segid " " and resid 51 and name HB% )
( segid " " and resid 55 and name HB% )
2.300 2.300 3.700 peak 2853 spectrum 1 weight 0.11000E+01 volume 0.22926E-01 ppm1 1.465 ppm2 1.283 CV 1
ASSI { 2855}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HB2 ))
2.500 0.800 0.800 peak 2855 spectrum 1 weight 0.11000E+01 volume 0.31846E-02 ppm1 4.428 ppm2 3.037 CV 1
ASSI { 2856}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HB3 ))
3.000 1.200 1.200 peak 2856 spectrum 1 weight 0.11000E+01 volume 0.28933E-02 ppm1 4.427 ppm2 3.207 CV 1
ASSI { 2859}
(( segid " " and resid 53 and name HB2 ))
( segid " " and resid 49 and name HD% )
4.500 2.500 1.500 peak 2859 spectrum 1 weight 0.11000E+01 volume 0.70970E-03 ppm1 3.035 ppm2 6.965 CV 1
ASSI { 2860}
(( segid " " and resid 53 and name HB3 ))
( segid " " and resid 49 and name HD% )
3.600 3.600 2.400 peak 2860 spectrum 1 weight 0.11000E+01 volume 0.39490E-03 ppm1 3.208 ppm2 6.973 CV 1
ASSI { 2870}
( segid " " and resid 55 and name HB% )
( segid " " and resid 53 and name HE% )
3.200 3.200 2.800 peak 2870 spectrum 1 weight 0.11000E+01 volume 0.22266E-02 ppm1 1.283 ppm2 6.738 CV 1
ASSI { 2872}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 56 and name HD2 ))
3.500 1.500 1.500 peak 2872 spectrum 1 weight 0.11000E+01 volume 0.81749E-03 ppm1 3.069 ppm2 7.098 CV 1
ASSI { 2873}
(( segid " " and resid 56 and name HB3 ))
(( segid " " and resid 56 and name HD2 ))
3.700 1.700 1.700 peak 2873 spectrum 1 weight 0.11000E+01 volume 0.90229E-03 ppm1 3.200 ppm2 7.108 CV 1
ASSI { 2874}
(( segid " " and resid 57 and name HA2 ))
(( segid " " and resid 56 and name HN ))
4.400 2.400 1.600 peak 2874 spectrum 1 weight 0.11000E+01 volume 0.44880E-03 ppm1 4.038 ppm2 8.199 CV 1
ASSI { 2875}
(( segid " " and resid 57 and name HA1 ))
(( segid " " and resid 56 and name HN ))
3.100 3.100 2.900 peak 2875 spectrum 1 weight 0.11000E+01 volume 0.60486E-03 ppm1 3.928 ppm2 8.163 CV 1
ASSI { 2876}
(( segid " " and resid 57 and name HA2 ))
(( segid " " and resid 58 and name HN ))
3.100 1.200 1.200 peak 2876 spectrum 1 weight 0.11000E+01 volume 0.10266E-02 ppm1 4.013 ppm2 8.391 CV 1
ASSI { 2877}
(( segid " " and resid 57 and name HA1 ))
(( segid " " and resid 58 and name HN ))
4.100 2.100 1.900 peak 2877 spectrum 1 weight 0.11000E+01 volume 0.94794E-03 ppm1 3.932 ppm2 8.403 CV 1
ASSI { 2879}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 58 and name HA ))
2.100 0.500 0.500 peak 2879 spectrum 1 weight 0.11000E+01 volume 0.71313E-02 ppm1 3.853 ppm2 4.649 CV 1
ASSI { 2880}
(( segid " " and resid 59 and name HD3 ))
(( segid " " and resid 58 and name HA ))
2.400 0.700 0.700 peak 2880 spectrum 1 weight 0.11000E+01 volume 0.79388E-02 ppm1 3.668 ppm2 4.648 CV 1
ASSI { 2881}
(( segid " " and resid 59 and name HG2 ))
(( segid " " and resid 58 and name HA ))
4.300 2.300 1.700 peak 2881 spectrum 1 weight 0.10000E+01 volume 0.13033E-02 ppm1 2.001 ppm2 4.644 CV 1
OR { 2881}
(( segid " " and resid 59 and name HG3 ))
(( segid " " and resid 58 and name HA ))
ASSI { 2882}
(( segid " " and resid 59 and name HG3 ))
(( segid " " and resid 59 and name HA ))
3.600 1.600 1.600 peak 2882 spectrum 1 weight 0.11000E+01 volume 0.17483E-02 ppm1 1.999 ppm2 4.538 CV 1
OR { 2882}
(( segid " " and resid 59 and name HG2 ))
(( segid " " and resid 59 and name HA ))
ASSI { 2890}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 64 and name HN ))
3.400 1.400 1.400 peak 2890 spectrum 1 weight 0.11000E+01 volume 0.89853E-03 ppm1 3.791 ppm2 7.176 CV 1
ASSI { 2894}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 64 and name HN ))
3.500 1.500 1.500 peak 2894 spectrum 1 weight 0.11000E+01 volume 0.82564E-03 ppm1 4.176 ppm2 7.171 CV 1
ASSI { 2895}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 64 and name HN ))
2.900 1.000 1.000 peak 2895 spectrum 1 weight 0.11000E+01 volume 0.21336E-02 ppm1 3.844 ppm2 7.170 CV 1
ASSI { 2898}
( segid " " and resid 64 and name HG1%)
( segid " " and resid 53 and name HE% )
3.200 3.200 2.800 peak 2898 spectrum 1 weight 0.11000E+01 volume 0.53585E-03 ppm1 0.109 ppm2 6.740 CV 1
ASSI { 2901}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 59 and name HG2 ))
2.800 1.000 1.000 peak 2901 spectrum 1 weight 0.11000E+01 volume 0.12991E-02 ppm1 0.362 ppm2 2.000 CV 1
OR { 2901}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 59 and name HG3 ))
ASSI { 2903}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 65 and name HB3 ))
2.900 1.100 1.100 peak 2903 spectrum 1 weight 0.11000E+01 volume 0.11689E-02 ppm1 5.119 ppm2 1.189 CV 1
ASSI { 2905}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 65 and name HA ))
3.500 1.500 1.500 peak 2905 spectrum 1 weight 0.11000E+01 volume 0.90044E-03 ppm1 1.373 ppm2 5.115 CV 1
ASSI { 2907}
( segid " " and resid 65 and name HD2%)
(( segid " " and resid 69 and name HE21))
3.200 1.200 1.200 peak 2907 spectrum 1 weight 0.11000E+01 volume 0.93411E-03 ppm1 0.622 ppm2 7.552 CV 1
ASSI { 2908}
( segid " " and resid 65 and name HD2%)
(( segid " " and resid 69 and name HE22))
3.100 1.200 1.200 peak 2908 spectrum 1 weight 0.11000E+01 volume 0.16696E-02 ppm1 0.622 ppm2 7.319 CV 1
ASSI { 2912}
(( segid " " and resid 68 and name HA2 ))
(( segid " " and resid 68 and name HN ))
2.800 1.000 1.000 peak 2912 spectrum 1 weight 0.11000E+01 volume 0.36669E-02 ppm1 3.597 ppm2 9.228 CV 1
ASSI { 2914}
(( segid " " and resid 68 and name HA2 ))
(( segid " " and resid 69 and name HN ))
3.400 1.500 1.500 peak 2914 spectrum 1 weight 0.11000E+01 volume 0.10863E-02 ppm1 3.594 ppm2 7.716 CV 1
ASSI { 2917}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 17 and name HN ))
4.000 2.000 2.000 peak 2917 spectrum 1 weight 0.11000E+01 volume 0.10354E-02 ppm1 5.231 ppm2 8.818 CV 1
ASSI { 2920}
( segid " " and resid 71 and name HG1%)
( segid " " and resid 48 and name HD% )
2.900 1.000 1.000 peak 2920 spectrum 1 weight 0.11000E+01 volume 0.20630E-02 ppm1 0.315 ppm2 7.307 CV 1
ASSI { 2929}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 13 and name HB2 ))
2.700 0.900 0.900 peak 2929 spectrum 1 weight 0.11000E+01 volume 0.28248E-02 ppm1 0.587 ppm2 2.438 CV 1
ASSI { 2930}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 13 and name HB3 ))
3.300 1.400 1.400 peak 2930 spectrum 1 weight 0.11000E+01 volume 0.16848E-02 ppm1 0.588 ppm2 3.304 CV 1
ASSI { 2933}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 77 and name HA ))
4.000 2.000 2.000 peak 2933 spectrum 1 weight 0.10000E+01 volume 0.92617E-03 ppm1 3.947 ppm2 4.530 CV 1
ASSI { 2934}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 74 and name HB2 ))
3.000 3.000 3.000 peak 2934 spectrum 1 weight 0.11000E+01 volume 0.78239E-03 ppm1 3.942 ppm2 1.955 CV 1
OR { 2934}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 74 and name HB3 ))
ASSI { 2938}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 87 and name HA ))
3.000 1.100 1.100 peak 2938 spectrum 1 weight 0.11000E+01 volume 0.10354E-02 ppm1 3.943 ppm2 5.165 CV 1
ASSI { 2940}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 76 and name HN ))
3.000 1.200 1.200 peak 2940 spectrum 1 weight 0.11000E+01 volume 0.26995E-02 ppm1 0.844 ppm2 9.260 CV 1
ASSI { 2955}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 37 and name HA2 ))
3.200 1.200 1.200 peak 2955 spectrum 1 weight 0.11000E+01 volume 0.12662E-02 ppm1 0.542 ppm2 3.617 CV 1
ASSI { 2956}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 37 and name HA1 ))
3.400 1.400 1.400 peak 2956 spectrum 1 weight 0.11000E+01 volume 0.22071E-02 ppm1 0.543 ppm2 5.130 CV 1
ASSI { 2958}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 37 and name HA2 ))
3.500 1.500 1.500 peak 2958 spectrum 1 weight 0.11000E+01 volume 0.47367E-03 ppm1 0.182 ppm2 3.618 CV 1
ASSI { 2959}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 38 and name HN ))
4.100 2.100 1.900 peak 2959 spectrum 1 weight 0.11000E+01 volume 0.44634E-03 ppm1 0.181 ppm2 9.131 CV 1
ASSI { 2962}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 74 and name HN ))
3.200 1.300 1.300 peak 2962 spectrum 1 weight 0.11000E+01 volume 0.11529E-02 ppm1 1.139 ppm2 8.646 CV 1
ASSI { 2963}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 88 and name HA ))
3.700 1.700 1.700 peak 2963 spectrum 1 weight 0.11000E+01 volume 0.88874E-03 ppm1 1.138 ppm2 4.935 CV 1
ASSI { 2965}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 90 and name HN ))
3.000 1.100 1.100 peak 2965 spectrum 1 weight 0.11000E+01 volume 0.17315E-02 ppm1 1.143 ppm2 9.027 CV 1
ASSI { 2966}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 73 and name HA ))
3.200 1.300 1.300 peak 2966 spectrum 1 weight 0.11000E+01 volume 0.15748E-02 ppm1 5.178 ppm2 5.316 CV 1
ASSI { 2967}
(( segid " " and resid 89 and name HA ))
( segid " " and resid 89 and name HG2%)
2.900 1.000 1.000 peak 2967 spectrum 1 weight 0.11000E+01 volume 0.21013E-02 ppm1 5.176 ppm2 0.978 CV 1
ASSI { 2972}
( segid " " and resid 89 and name HG2%)
(( segid " " and resid 90 and name HN ))
3.100 1.200 1.200 peak 2972 spectrum 1 weight 0.11000E+01 volume 0.63285E-03 ppm1 0.969 ppm2 9.028 CV 1
ASSI { 2979}
( segid " " and resid 91 and name HD1%)
(( segid " " and resid 74 and name HN ))
3.100 1.200 1.200 peak 2979 spectrum 1 weight 0.10000E+01 volume 0.14228E-02 ppm1 0.703 ppm2 8.655 CV 1
ASSI { 2980}
( segid " " and resid 91 and name HD1%)
(( segid " " and resid 73 and name HA ))
2.900 1.000 1.000 peak 2980 spectrum 1 weight 0.11000E+01 volume 0.17747E-02 ppm1 0.704 ppm2 5.321 CV 1
ASSI { 2981}
( segid " " and resid 91 and name HD1%)
(( segid " " and resid 89 and name HA ))
2.900 1.100 1.100 peak 2981 spectrum 1 weight 0.11000E+01 volume 0.17349E-02 ppm1 0.704 ppm2 5.169 CV 1
ASSI { 2982}
( segid " " and resid 91 and name HD1%)
( segid " " and resid 91 and name HG2%)
2.200 0.600 0.600 peak 2982 spectrum 1 weight 0.11000E+01 volume 0.31668E-01 ppm1 0.705 ppm2 0.856 CV 1
ASSI { 2983}
( segid " " and resid 91 and name HD1%)
(( segid " " and resid 92 and name HN ))
4.000 2.000 2.000 peak 2983 spectrum 1 weight 0.11000E+01 volume 0.14501E-02 ppm1 0.703 ppm2 9.051 CV 1
ASSI { 2985}
( segid " " and resid 93 and name HD1%)
( segid " " and resid 48 and name HD% )
4.000 2.000 2.000 peak 2985 spectrum 1 weight 0.11000E+01 volume 0.68162E-03 ppm1 0.937 ppm2 7.307 CV 1
ASSI { 6}
( segid " " and resid 31 and name HE% )
(( segid " " and resid 33 and name HN ))
3.400 3.400 2.600 peak 6 spectrum 1 weight 0.10000E+01 volume 0.22309E-02 ppm1 6.378 ppm2 6.831 CV 1
ASSI { 7}
( segid " " and resid 31 and name HE% )
( segid " " and resid 13 and name HD% )
3.400 3.400 2.600 peak 7 spectrum 1 weight 0.10000E+01 volume 0.91338E-03 ppm1 6.384 ppm2 7.106 CV 1
ASSI { 10}
( segid " " and resid 31 and name HE% )
(( segid " " and resid 31 and name HB2 ))
4.300 2.300 1.700 peak 10 spectrum 1 weight 0.10000E+01 volume 0.68760E-03 ppm1 6.380 ppm2 3.135 CV 1
ASSI { 11}
( segid " " and resid 31 and name HE% )
(( segid " " and resid 31 and name HB3 ))
4.500 2.500 1.500 peak 11 spectrum 1 weight 0.10000E+01 volume 0.55988E-03 ppm1 6.384 ppm2 2.180 CV 1
ASSI { 18}
(( segid " " and resid 36 and name HE1 ))
(( segid " " and resid 30 and name HN ))
3.600 1.600 1.600 peak 18 spectrum 1 weight 0.10000E+01 volume 0.26524E-03 ppm1 7.847 ppm2 8.959 CV 1
ASSI { 21}
( segid " " and resid 31 and name HD% )
(( segid " " and resid 29 and name HB ))
3.500 1.600 1.600 peak 21 spectrum 1 weight 0.10000E+01 volume 0.72805E-03 ppm1 6.560 ppm2 1.677 CV 1
ASSI { 23}
( segid " " and resid 31 and name HD% )
(( segid " " and resid 13 and name HB2 ))
3.700 3.700 2.300 peak 23 spectrum 1 weight 0.10000E+01 volume 0.70608E-03 ppm1 6.572 ppm2 2.413 CV 1
ASSI { 24}
( segid " " and resid 31 and name HE% )
(( segid " " and resid 37 and name HA2 ))
3.000 1.100 1.100 peak 24 spectrum 1 weight 0.10000E+01 volume 0.15173E-02 ppm1 6.381 ppm2 3.621 CV 1
ASSI { 27}
( segid " " and resid 31 and name HD% )
(( segid " " and resid 30 and name HA ))
3.700 1.700 1.700 peak 27 spectrum 1 weight 0.10000E+01 volume 0.14935E-02 ppm1 6.565 ppm2 5.074 CV 1
ASSI { 31}
(( segid " " and resid 49 and name HZ ))
(( segid " " and resid 59 and name HG3 ))
3.600 1.600 1.600 peak 31 spectrum 1 weight 0.10000E+01 volume 0.84117E-03 ppm1 7.244 ppm2 2.006 CV 1
OR { 31}
(( segid " " and resid 49 and name HZ ))
(( segid " " and resid 59 and name HG2 ))
ASSI { 32}
(( segid " " and resid 49 and name HZ ))
(( segid " " and resid 46 and name HB2 ))
3.500 1.500 1.500 peak 32 spectrum 1 weight 0.10000E+01 volume 0.76966E-03 ppm1 7.240 ppm2 1.785 CV 1
ASSI { 36}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 39 and name HN ))
4.200 2.200 1.800 peak 36 spectrum 1 weight 0.10000E+01 volume 0.51906E-03 ppm1 6.850 ppm2 8.897 CV 1
ASSI { 42}
(( segid " " and resid 36 and name HE1 ))
(( segid " " and resid 18 and name HB ))
3.200 1.200 1.200 peak 42 spectrum 1 weight 0.10000E+01 volume 0.12331E-02 ppm1 7.845 ppm2 4.212 CV 1
ASSI { 43}
(( segid " " and resid 36 and name HE1 ))
(( segid " " and resid 30 and name HB2 ))
3.700 1.800 1.800 peak 43 spectrum 1 weight 0.10000E+01 volume 0.49587E-03 ppm1 7.845 ppm2 2.128 CV 1
ASSI { 56}
( segid " " and resid 28 and name HD% )
(( segid " " and resid 28 and name HB3 ))
2.700 0.900 0.900 peak 56 spectrum 1 weight 0.10000E+01 volume 0.22897E-02 ppm1 7.115 ppm2 2.979 CV 1
ASSI { 57}
( segid " " and resid 38 and name HE% )
(( segid " " and resid 38 and name HA ))
3.200 3.200 2.800 peak 57 spectrum 1 weight 0.10000E+01 volume 0.51906E-03 ppm1 7.165 ppm2 4.602 CV 1
ASSI { 58}
( segid " " and resid 38 and name HE% )
(( segid " " and resid 38 and name HB2 ))
4.300 2.300 1.700 peak 58 spectrum 1 weight 0.10000E+01 volume 0.73646E-03 ppm1 7.169 ppm2 2.826 CV 1
ASSI { 60}
( segid " " and resid 48 and name HD% )
(( segid " " and resid 47 and name HB2 ))
3.800 1.800 1.800 peak 60 spectrum 1 weight 0.10000E+01 volume 0.45932E-03 ppm1 7.301 ppm2 1.777 CV 1
OR { 60}
( segid " " and resid 48 and name HD% )
(( segid " " and resid 47 and name HB3 ))
OR { 60}
( segid " " and resid 48 and name HD% )
(( segid " " and resid 47 and name HG3 ))
ASSI { 63}
( segid " " and resid 48 and name HD% )
( segid " " and resid 44 and name HG2%)
2.900 1.100 1.100 peak 63 spectrum 1 weight 0.10000E+01 volume 0.14505E-02 ppm1 7.302 ppm2 0.837 CV 1
ASSI { 66}
( segid " " and resid 48 and name HD% )
(( segid " " and resid 47 and name HG2 ))
4.300 2.300 1.700 peak 66 spectrum 1 weight 0.10000E+01 volume 0.42948E-03 ppm1 7.298 ppm2 1.937 CV 1
ASSI { 68}
( segid " " and resid 48 and name HD% )
(( segid " " and resid 45 and name HN ))
3.200 1.300 1.300 peak 68 spectrum 1 weight 0.10000E+01 volume 0.94315E-03 ppm1 7.303 ppm2 7.831 CV 1
ASSI { 72}
( segid " " and resid 90 and name HD% )
(( segid " " and resid 90 and name HB2 ))
2.800 1.000 1.000 peak 72 spectrum 1 weight 0.10000E+01 volume 0.25566E-02 ppm1 7.362 ppm2 3.075 CV 1
OR { 72}
( segid " " and resid 90 and name HD% )
(( segid " " and resid 90 and name HB3 ))
ASSI { 80}
( segid " " and resid 53 and name HE% )
(( segid " " and resid 55 and name HA ))
3.400 1.500 1.500 peak 80 spectrum 1 weight 0.10000E+01 volume 0.86793E-03 ppm1 6.723 ppm2 4.183 CV 1
ASSI { 81}
( segid " " and resid 53 and name HE% )
(( segid " " and resid 54 and name HB2 ))
4.100 2.100 1.900 peak 81 spectrum 1 weight 0.10000E+01 volume 0.52767E-03 ppm1 6.725 ppm2 3.685 CV 1
ASSI { 82}
( segid " " and resid 53 and name HE% )
(( segid " " and resid 49 and name HB3 ))
4.100 2.100 1.900 peak 82 spectrum 1 weight 0.10000E+01 volume 0.49099E-03 ppm1 6.724 ppm2 3.397 CV 1
ASSI { 83}
( segid " " and resid 53 and name HE% )
(( segid " " and resid 53 and name HB3 ))
4.400 2.400 1.600 peak 83 spectrum 1 weight 0.10000E+01 volume 0.75029E-03 ppm1 6.721 ppm2 3.195 CV 1
ASSI { 84}
( segid " " and resid 53 and name HE% )
(( segid " " and resid 53 and name HB2 ))
4.000 2.000 2.000 peak 84 spectrum 1 weight 0.10000E+01 volume 0.11294E-02 ppm1 6.726 ppm2 3.017 CV 1
ASSI { 85}
( segid " " and resid 53 and name HE% )
(( segid " " and resid 49 and name HB2 ))
3.000 3.000 3.000 peak 85 spectrum 1 weight 0.10000E+01 volume 0.27318E-02 ppm1 6.723 ppm2 2.839 CV 1
ASSI { 94}
( segid " " and resid 48 and name HE% )
(( segid " " and resid 47 and name HB2 ))
3.600 1.600 1.600 peak 94 spectrum 1 weight 0.10000E+01 volume 0.82892E-03 ppm1 7.012 ppm2 1.750 CV 1
OR { 94}
( segid " " and resid 48 and name HE% )
(( segid " " and resid 47 and name HG3 ))
OR { 94}
( segid " " and resid 48 and name HE% )
(( segid " " and resid 47 and name HB3 ))
ASSI { 98}
( segid " " and resid 48 and name HE% )
(( segid " " and resid 45 and name HN ))
3.500 1.500 1.500 peak 98 spectrum 1 weight 0.10000E+01 volume 0.58706E-03 ppm1 7.008 ppm2 7.832 CV 1
ASSI { 101}
( segid " " and resid 13 and name HE% )
(( segid " " and resid 75 and name HG13))
3.100 1.200 1.200 peak 101 spectrum 1 weight 0.10000E+01 volume 0.19308E-02 ppm1 6.874 ppm2 1.521 CV 1
ASSI { 102}
( segid " " and resid 28 and name HD% )
(( segid " " and resid 27 and name HA ))
3.500 1.600 1.600 peak 102 spectrum 1 weight 0.10000E+01 volume 0.66501E-03 ppm1 7.113 ppm2 5.003 CV 1
ASSI { 105}
( segid " " and resid 13 and name HE% )
(( segid " " and resid 11 and name HB3 ))
3.400 1.400 1.400 peak 105 spectrum 1 weight 0.10000E+01 volume 0.98510E-03 ppm1 6.874 ppm2 2.817 CV 1
ASSI { 112}
(( segid " " and resid 38 and name HZ ))
(( segid " " and resid 19 and name HD3 ))
2.800 2.800 3.200 peak 112 spectrum 1 weight 0.10000E+01 volume 0.11347E-02 ppm1 7.237 ppm2 3.073 CV 1
ASSI { 114}
( segid " " and resid 13 and name HE% )
(( segid " " and resid 75 and name HN ))
3.900 1.900 1.900 peak 114 spectrum 1 weight 0.10000E+01 volume 0.47385E-03 ppm1 6.874 ppm2 8.619 CV 1
ASSI { 116}
( segid " " and resid 13 and name HD% )
( segid " " and resid 13 and name HE% )
2.000 0.500 0.500 peak 116 spectrum 1 weight 0.10000E+01 volume 0.18245E-01 ppm1 7.086 ppm2 6.869 CV 1
ASSI { 119}
( segid " " and resid 49 and name HE% )
(( segid " " and resid 44 and name HB ))
4.100 2.100 1.900 peak 119 spectrum 1 weight 0.10000E+01 volume 0.66784E-03 ppm1 7.070 ppm2 2.121 CV 1
ASSI { 120}
( segid " " and resid 49 and name HE% )
(( segid " " and resid 49 and name HB2 ))
4.200 2.200 1.800 peak 120 spectrum 1 weight 0.10000E+01 volume 0.71888E-03 ppm1 7.068 ppm2 2.817 CV 1
ASSI { 124}
( segid " " and resid 49 and name HE% )
(( segid " " and resid 59 and name HB3 ))
3.300 1.300 1.300 peak 124 spectrum 1 weight 0.10000E+01 volume 0.68409E-03 ppm1 7.074 ppm2 1.744 CV 1
ASSI { 130}
( segid " " and resid 49 and name HE% )
( segid " " and resid 64 and name HG2%)
4.000 2.000 2.000 peak 130 spectrum 1 weight 0.10000E+01 volume 0.63936E-03 ppm1 7.066 ppm2 0.356 CV 1
ASSI { 133}
( segid " " and resid 49 and name HD% )
(( segid " " and resid 49 and name HB2 ))
2.800 1.000 1.000 peak 133 spectrum 1 weight 0.10000E+01 volume 0.13946E-02 ppm1 6.939 ppm2 2.811 CV 1
ASSI { 137}
( segid " " and resid 13 and name HD% )
(( segid " " and resid 13 and name HA ))
2.800 2.800 3.200 peak 137 spectrum 1 weight 0.11000E+01 volume 0.27072E-02 ppm1 7.086 ppm2 4.897 CV 1
ASSI { 138}
( segid " " and resid 13 and name HD% )
(( segid " " and resid 13 and name HB2 ))
2.500 0.800 0.800 peak 138 spectrum 1 weight 0.11000E+01 volume 0.40526E-02 ppm1 7.087 ppm2 2.432 CV 1
ASSI { 139}
( segid " " and resid 13 and name HD% )
(( segid " " and resid 13 and name HB3 ))
2.700 0.900 0.900 peak 139 spectrum 1 weight 0.11000E+01 volume 0.42690E-02 ppm1 7.087 ppm2 3.285 CV 1
ASSI { 141}
( segid " " and resid 13 and name HD% )
( segid " " and resid 31 and name HD% )
3.100 3.100 2.900 peak 141 spectrum 1 weight 0.11000E+01 volume 0.14510E-02 ppm1 7.093 ppm2 6.575 CV 1
ASSI { 143}
( segid " " and resid 13 and name HD% )
(( segid " " and resid 74 and name HA ))
3.200 1.300 1.300 peak 143 spectrum 1 weight 0.11000E+01 volume 0.11257E-02 ppm1 7.086 ppm2 5.119 CV 1
ASSI { 144}
( segid " " and resid 13 and name HD% )
(( segid " " and resid 74 and name HB2 ))
3.700 3.700 2.300 peak 144 spectrum 1 weight 0.11000E+01 volume 0.10339E-02 ppm1 7.088 ppm2 1.958 CV 1
OR { 144}
( segid " " and resid 13 and name HD% )
(( segid " " and resid 74 and name HB3 ))
ASSI { 145}
( segid " " and resid 13 and name HD% )
( segid " " and resid 75 and name HD1%)
3.100 1.200 1.200 peak 145 spectrum 1 weight 0.11000E+01 volume 0.18703E-02 ppm1 7.086 ppm2 0.797 CV 1
ASSI { 147}
( segid " " and resid 13 and name HE% )
(( segid " " and resid 13 and name HB2 ))
4.300 2.300 1.700 peak 147 spectrum 1 weight 0.11000E+01 volume 0.75501E-03 ppm1 6.874 ppm2 2.426 CV 1
ASSI { 148}
( segid " " and resid 13 and name HE% )
(( segid " " and resid 13 and name HB3 ))
3.000 3.000 3.000 peak 148 spectrum 1 weight 0.11000E+01 volume 0.75125E-03 ppm1 6.873 ppm2 3.269 CV 1
ASSI { 150}
( segid " " and resid 13 and name HE% )
(( segid " " and resid 31 and name HB3 ))
3.300 3.300 2.700 peak 150 spectrum 1 weight 0.11000E+01 volume 0.49050E-03 ppm1 6.871 ppm2 2.168 CV 1
ASSI { 153}
( segid " " and resid 28 and name HD% )
(( segid " " and resid 19 and name HB3 ))
2.700 0.900 0.900 peak 153 spectrum 1 weight 0.11000E+01 volume 0.14408E-02 ppm1 7.112 ppm2 1.887 CV 1
ASSI { 155}
( segid " " and resid 28 and name HD% )
( segid " " and resid 24 and name HD1%)
3.400 3.400 2.600 peak 155 spectrum 1 weight 0.11000E+01 volume 0.74228E-03 ppm1 7.115 ppm2 1.110 CV 1
ASSI { 157}
( segid " " and resid 28 and name HD% )
( segid " " and resid 28 and name HE% )
1.900 0.500 0.500 peak 157 spectrum 1 weight 0.11000E+01 volume 0.19196E-01 ppm1 7.115 ppm2 7.326 CV 1
ASSI { 158}
( segid " " and resid 28 and name HD% )
(( segid " " and resid 29 and name HN ))
3.900 1.900 1.900 peak 158 spectrum 1 weight 0.11000E+01 volume 0.58788E-03 ppm1 7.119 ppm2 9.002 CV 1
ASSI { 159}
( segid " " and resid 28 and name HD% )
(( segid " " and resid 39 and name HN ))
3.900 3.900 2.100 peak 159 spectrum 1 weight 0.11000E+01 volume 0.76801E-03 ppm1 7.119 ppm2 8.879 CV 1
ASSI { 160}
( segid " " and resid 28 and name HE% )
(( segid " " and resid 21 and name HB3 ))
2.900 2.900 3.100 peak 160 spectrum 1 weight 0.11000E+01 volume 0.92002E-03 ppm1 7.349 ppm2 1.867 CV 1
ASSI { 161}
( segid " " and resid 28 and name HE% )
( segid " " and resid 26 and name HB% )
3.800 3.800 2.200 peak 161 spectrum 1 weight 0.11000E+01 volume 0.61950E-03 ppm1 7.353 ppm2 0.575 CV 1
ASSI { 164}
( segid " " and resid 31 and name HD% )
( segid " " and resid 29 and name HG1%)
2.600 0.800 0.800 peak 164 spectrum 1 weight 0.11000E+01 volume 0.35601E-02 ppm1 6.566 ppm2 0.561 CV 1
ASSI { 166}
( segid " " and resid 31 and name HD% )
(( segid " " and resid 31 and name HB2 ))
2.600 0.800 0.800 peak 166 spectrum 1 weight 0.11000E+01 volume 0.34977E-02 ppm1 6.566 ppm2 3.127 CV 1
ASSI { 167}
( segid " " and resid 31 and name HD% )
(( segid " " and resid 31 and name HB3 ))
2.700 0.900 0.900 peak 167 spectrum 1 weight 0.11000E+01 volume 0.29009E-02 ppm1 6.566 ppm2 2.166 CV 1
ASSI { 168}
( segid " " and resid 31 and name HD% )
( segid " " and resid 31 and name HE% )
2.200 0.600 0.600 peak 168 spectrum 1 weight 0.11000E+01 volume 0.76623E-02 ppm1 6.566 ppm2 6.378 CV 1
ASSI { 171}
( segid " " and resid 31 and name HD% )
(( segid " " and resid 37 and name HA2 ))
3.900 1.900 1.900 peak 171 spectrum 1 weight 0.11000E+01 volume 0.74379E-03 ppm1 6.567 ppm2 3.631 CV 1
ASSI { 173}
( segid " " and resid 31 and name HD% )
( segid " " and resid 75 and name HD1%)
3.600 1.600 1.600 peak 173 spectrum 1 weight 0.11000E+01 volume 0.91769E-03 ppm1 6.572 ppm2 0.791 CV 1
ASSI { 175}
( segid " " and resid 31 and name HE% )
( segid " " and resid 29 and name HG1%)
3.500 1.600 1.600 peak 175 spectrum 1 weight 0.11000E+01 volume 0.15313E-02 ppm1 6.380 ppm2 0.555 CV 1
ASSI { 177}
( segid " " and resid 31 and name HE% )
(( segid " " and resid 31 and name HN ))
4.300 2.300 1.700 peak 177 spectrum 1 weight 0.11000E+01 volume 0.68069E-03 ppm1 6.374 ppm2 9.014 CV 1
ASSI { 182}
( segid " " and resid 31 and name HE% )
( segid " " and resid 85 and name HB% )
3.300 1.400 1.400 peak 182 spectrum 1 weight 0.11000E+01 volume 0.13308E-02 ppm1 6.379 ppm2 1.479 CV 1
ASSI { 183}
( segid " " and resid 31 and name HE% )
( segid " " and resid 87 and name HD2%)
3.400 1.400 1.400 peak 183 spectrum 1 weight 0.11000E+01 volume 0.85691E-03 ppm1 6.383 ppm2 0.192 CV 1
ASSI { 184}
(( segid " " and resid 36 and name HD2 ))
( segid " " and resid 18 and name HG2%)
4.100 4.100 1.900 peak 184 spectrum 1 weight 0.11000E+01 volume 0.39357E-03 ppm1 6.939 ppm2 1.047 CV 1
ASSI { 185}
(( segid " " and resid 36 and name HD2 ))
(( segid " " and resid 29 and name HN ))
4.100 2.100 1.900 peak 185 spectrum 1 weight 0.11000E+01 volume 0.53542E-03 ppm1 6.944 ppm2 8.992 CV 1
ASSI { 186}
(( segid " " and resid 36 and name HD2 ))
(( segid " " and resid 30 and name HB2 ))
4.000 2.000 2.000 peak 186 spectrum 1 weight 0.11000E+01 volume 0.57493E-03 ppm1 6.939 ppm2 2.123 CV 1
ASSI { 187}
(( segid " " and resid 36 and name HD2 ))
(( segid " " and resid 30 and name HB3 ))
4.800 2.800 1.200 peak 187 spectrum 1 weight 0.11000E+01 volume 0.38961E-03 ppm1 6.942 ppm2 2.773 CV 1
ASSI { 188}
(( segid " " and resid 36 and name HD2 ))
(( segid " " and resid 35 and name HA ))
3.300 3.300 2.700 peak 188 spectrum 1 weight 0.11000E+01 volume 0.41734E-03 ppm1 6.940 ppm2 4.540 CV 1
ASSI { 189}
(( segid " " and resid 36 and name HD2 ))
(( segid " " and resid 36 and name HA ))
2.700 0.900 0.900 peak 189 spectrum 1 weight 0.11000E+01 volume 0.26486E-02 ppm1 6.941 ppm2 5.075 CV 1
ASSI { 190}
(( segid " " and resid 36 and name HD2 ))
(( segid " " and resid 36 and name HB2 ))
3.700 1.700 1.700 peak 190 spectrum 1 weight 0.11000E+01 volume 0.66292E-03 ppm1 6.944 ppm2 3.091 CV 1
ASSI { 191}
(( segid " " and resid 36 and name HD2 ))
(( segid " " and resid 36 and name HB3 ))
4.000 2.000 2.000 peak 191 spectrum 1 weight 0.11000E+01 volume 0.56553E-03 ppm1 6.946 ppm2 3.307 CV 1
ASSI { 192}
(( segid " " and resid 36 and name HE1 ))
( segid " " and resid 18 and name HG2%)
3.000 1.100 1.100 peak 192 spectrum 1 weight 0.11000E+01 volume 0.19781E-02 ppm1 7.843 ppm2 1.015 CV 1
ASSI { 194}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 38 and name HA ))
3.200 1.300 1.300 peak 194 spectrum 1 weight 0.11000E+01 volume 0.94869E-03 ppm1 6.851 ppm2 4.620 CV 1
ASSI { 195}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 38 and name HB2 ))
3.100 1.200 1.200 peak 195 spectrum 1 weight 0.11000E+01 volume 0.16622E-02 ppm1 6.851 ppm2 2.797 CV 1
ASSI { 196}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 38 and name HB3 ))
2.900 1.100 1.100 peak 196 spectrum 1 weight 0.11000E+01 volume 0.17444E-02 ppm1 6.854 ppm2 2.976 CV 1
ASSI { 197}
( segid " " and resid 38 and name HD% )
( segid " " and resid 38 and name HE% )
2.100 0.600 0.600 peak 197 spectrum 1 weight 0.11000E+01 volume 0.12767E-01 ppm1 6.851 ppm2 7.183 CV 1
ASSI { 198}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 40 and name HG2 ))
3.600 3.600 2.400 peak 198 spectrum 1 weight 0.11000E+01 volume 0.73564E-03 ppm1 6.853 ppm2 2.162 CV 1
OR { 198}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 40 and name HG3 ))
ASSI { 199}
( segid " " and resid 38 and name HE% )
(( segid " " and resid 24 and name HB2 ))
3.600 1.600 1.600 peak 199 spectrum 1 weight 0.11000E+01 volume 0.74652E-03 ppm1 7.169 ppm2 1.713 CV 1
ASSI { 200}
( segid " " and resid 38 and name HE% )
(( segid " " and resid 24 and name HB3 ))
4.200 4.200 1.800 peak 200 spectrum 1 weight 0.11000E+01 volume 0.74365E-03 ppm1 7.167 ppm2 1.845 CV 1
ASSI { 206}
(( segid " " and resid 38 and name HZ ))
( segid " " and resid 38 and name HD% )
3.100 1.200 1.200 peak 206 spectrum 1 weight 0.11000E+01 volume 0.40537E-02 ppm1 7.215 ppm2 6.877 CV 1
ASSI { 207}
( segid " " and resid 48 and name HD% )
( segid " " and resid 45 and name HB% )
3.100 1.200 1.200 peak 207 spectrum 1 weight 0.11000E+01 volume 0.12207E-02 ppm1 7.302 ppm2 1.154 CV 1
ASSI { 209}
( segid " " and resid 48 and name HD% )
(( segid " " and resid 48 and name HB2 ))
2.900 1.000 1.000 peak 209 spectrum 1 weight 0.11000E+01 volume 0.19167E-02 ppm1 7.301 ppm2 2.714 CV 1
ASSI { 210}
( segid " " and resid 48 and name HD% )
(( segid " " and resid 48 and name HB3 ))
2.800 1.000 1.000 peak 210 spectrum 1 weight 0.11000E+01 volume 0.14806E-02 ppm1 7.299 ppm2 3.068 CV 1
ASSI { 213}
( segid " " and resid 48 and name HE% )
( segid " " and resid 45 and name HB% )
2.900 1.000 1.000 peak 213 spectrum 1 weight 0.11000E+01 volume 0.19857E-02 ppm1 7.009 ppm2 1.151 CV 1
ASSI { 214}
( segid " " and resid 48 and name HE% )
( segid " " and resid 48 and name HD% )
2.100 0.500 0.500 peak 214 spectrum 1 weight 0.11000E+01 volume 0.10550E-01 ppm1 7.010 ppm2 7.306 CV 1
ASSI { 215}
( segid " " and resid 48 and name HE% )
( segid " " and resid 71 and name HG1%)
3.100 1.200 1.200 peak 215 spectrum 1 weight 0.11000E+01 volume 0.13609E-02 ppm1 7.009 ppm2 0.324 CV 1
ASSI { 216}
( segid " " and resid 48 and name HE% )
( segid " " and resid 93 and name HD1%)
2.900 1.000 1.000 peak 216 spectrum 1 weight 0.11000E+01 volume 0.21818E-02 ppm1 7.010 ppm2 0.942 CV 1
ASSI { 218}
( segid " " and resid 49 and name HD% )
(( segid " " and resid 46 and name HA ))
2.900 1.100 1.100 peak 218 spectrum 1 weight 0.11000E+01 volume 0.20491E-02 ppm1 6.939 ppm2 3.373 CV 1
ASSI { 219}
( segid " " and resid 49 and name HD% )
( segid " " and resid 64 and name HG1%)
3.500 1.500 1.500 peak 219 spectrum 1 weight 0.11000E+01 volume 0.47617E-03 ppm1 6.940 ppm2 0.109 CV 1
ASSI { 222}
(( segid " " and resid 49 and name HZ ))
( segid " " and resid 49 and name HE% )
2.200 0.600 0.600 peak 222 spectrum 1 weight 0.11000E+01 volume 0.88929E-02 ppm1 7.238 ppm2 7.064 CV 1
ASSI { 223}
( segid " " and resid 53 and name HD% )
(( segid " " and resid 53 and name HA ))
2.700 0.900 0.900 peak 223 spectrum 1 weight 0.11000E+01 volume 0.32258E-02 ppm1 7.092 ppm2 4.414 CV 1
ASSI { 224}
( segid " " and resid 53 and name HD% )
(( segid " " and resid 53 and name HB2 ))
2.400 0.700 0.700 peak 224 spectrum 1 weight 0.11000E+01 volume 0.69773E-02 ppm1 7.091 ppm2 3.026 CV 1
ASSI { 225}
( segid " " and resid 53 and name HD% )
(( segid " " and resid 53 and name HB3 ))
2.400 0.700 0.700 peak 225 spectrum 1 weight 0.11000E+01 volume 0.47101E-02 ppm1 7.091 ppm2 3.213 CV 1
ASSI { 226}
( segid " " and resid 53 and name HD% )
( segid " " and resid 53 and name HE% )
1.900 0.500 0.500 peak 226 spectrum 1 weight 0.11000E+01 volume 0.22512E-01 ppm1 7.091 ppm2 6.745 CV 1
ASSI { 230}
( segid " " and resid 53 and name HE% )
( segid " " and resid 64 and name HG2%)
3.600 1.600 1.600 peak 230 spectrum 1 weight 0.11000E+01 volume 0.75036E-03 ppm1 6.721 ppm2 0.357 CV 1
ASSI { 15}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 17 and name HN ))
3.100 3.100 2.900 peak 15 spectrum 1 weight 0.10000E+01 volume 0.10172E-02 ppm1 8.979 ppm2 8.824 CV 1
OR { 15}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 36 and name HN ))
ASSI { 40}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 17 and name HN ))
4.700 2.700 1.300 peak 40 spectrum 1 weight 0.10000E+01 volume 0.53544E-03 ppm1 7.402 ppm2 8.812 CV 1
OR { 40}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 21 and name HN ))
ASSI { 44}
(( segid " " and resid 61 and name HN ))
( segid " " and resid 61 and name HD1%)
4.100 2.100 1.900 peak 44 spectrum 1 weight 0.10000E+01 volume 0.90510E-03 ppm1 9.567 ppm2 0.572 CV 1
OR { 44}
(( segid " " and resid 61 and name HN ))
( segid " " and resid 44 and name HD1%)
ASSI { 58}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 21 and name HN ))
2.600 2.600 3.400 peak 58 spectrum 1 weight 0.10000E+01 volume 0.25727E-02 ppm1 8.985 ppm2 8.809 CV 1
OR { 58}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 36 and name HN ))
ASSI { 61}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 85 and name HN ))
2.600 2.600 3.400 peak 61 spectrum 1 weight 0.10000E+01 volume 0.54409E-02 ppm1 8.697 ppm2 8.440 CV 1
OR { 61}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 84 and name HN ))
ASSI { 105}
(( segid " " and resid 49 and name HN ))
( segid " " and resid 49 and name HE% )
4.100 2.100 1.900 peak 105 spectrum 1 weight 0.10000E+01 volume 0.11624E-02 ppm1 7.908 ppm2 7.066 CV 1
OR { 105}
(( segid " " and resid 49 and name HN ))
( segid " " and resid 53 and name HD% )
ASSI { 128}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 87 and name HA ))
3.400 1.400 1.400 peak 128 spectrum 1 weight 0.10000E+01 volume 0.16568E-02 ppm1 8.652 ppm2 5.159 CV 1
OR { 128}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 89 and name HA ))
ASSI { 168}
(( segid " " and resid 90 and name HN ))
( segid " " and resid 89 and name HG2%)
3.500 1.500 1.500 peak 168 spectrum 1 weight 0.10000E+01 volume 0.53733E-03 ppm1 9.026 ppm2 0.954 CV 1
OR { 168}
(( segid " " and resid 90 and name HN ))
( segid " " and resid 93 and name HD1%)
ASSI { 170}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 91 and name HB ))
4.700 2.700 1.300 peak 170 spectrum 1 weight 0.10000E+01 volume 0.30729E-03 ppm1 9.032 ppm2 1.937 CV 1
OR { 170}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 73 and name HB ))
ASSI { 176}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 73 and name HB ))
4.000 2.000 2.000 peak 176 spectrum 1 weight 0.10000E+01 volume 0.49374E-03 ppm1 7.952 ppm2 1.926 CV 1
OR { 176}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 91 and name HB ))
ASSI { 201}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 83 and name HD2 ))
3.200 3.200 2.800 peak 201 spectrum 1 weight 0.10000E+01 volume 0.76671E-03 ppm1 8.427 ppm2 1.618 CV 1
OR { 201}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 83 and name HD3 ))
OR { 201}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 35 and name HB2 ))
ASSI { 211}
(( segid " " and resid 80 and name HN ))
( segid " " and resid 85 and name HB% )
4.500 2.600 1.500 peak 211 spectrum 1 weight 0.10000E+01 volume 0.33735E-03 ppm1 8.199 ppm2 1.465 CV 1
OR { 211}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 83 and name HG2 ))
OR { 211}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 83 and name HG3 ))
ASSI { 219}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 78 and name HA ))
4.400 2.400 1.600 peak 219 spectrum 1 weight 0.10000E+01 volume 0.49564E-03 ppm1 8.194 ppm2 4.244 CV 1
OR { 219}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 85 and name HA ))
ASSI { 223}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 79 and name HB2 ))
2.300 0.700 0.700 peak 223 spectrum 1 weight 0.10000E+01 volume 0.68260E-02 ppm1 8.696 ppm2 2.024 CV 1
OR { 223}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 78 and name HB3 ))
ASSI { 240}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 77 and name HG2 ))
4.300 2.300 1.700 peak 240 spectrum 1 weight 0.10000E+01 volume 0.59388E-03 ppm1 9.259 ppm2 1.485 CV 1
OR { 240}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 77 and name HG3 ))
OR { 240}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 87 and name HB2 ))
ASSI { 242}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 75 and name HB ))
4.200 2.200 1.800 peak 242 spectrum 1 weight 0.10000E+01 volume 0.56071E-03 ppm1 9.273 ppm2 1.939 CV 1
OR { 242}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 77 and name HB3 ))
ASSI { 263}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 75 and name HB ))
2.600 0.800 0.800 peak 263 spectrum 1 weight 0.10000E+01 volume 0.49905E-02 ppm1 8.636 ppm2 1.943 CV 1
OR { 263}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 74 and name HB2 ))
OR { 263}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 74 and name HB3 ))
ASSI { 270}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 72 and name HG2%)
3.600 1.600 1.600 peak 270 spectrum 1 weight 0.10000E+01 volume 0.10658E-02 ppm1 8.652 ppm2 0.844 CV 1
OR { 270}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 91 and name HG2%)
OR { 270}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 75 and name HG2%)
ASSI { 271}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 89 and name HG2%)
4.300 2.300 1.700 peak 271 spectrum 1 weight 0.10000E+01 volume 0.44900E-03 ppm1 8.644 ppm2 0.976 CV 1
OR { 271}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 75 and name HG12))
ASSI { 272}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 73 and name HB ))
2.600 0.800 0.800 peak 272 spectrum 1 weight 0.10000E+01 volume 0.45178E-02 ppm1 8.652 ppm2 1.943 CV 1
OR { 272}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 74 and name HB3 ))
OR { 272}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 74 and name HB2 ))
ASSI { 278}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 73 and name HB ))
3.800 1.800 1.800 peak 278 spectrum 1 weight 0.10000E+01 volume 0.82961E-03 ppm1 9.067 ppm2 1.929 CV 1
OR { 278}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 72 and name HB ))
ASSI { 281}
(( segid " " and resid 72 and name HN ))
( segid " " and resid 93 and name HD2%)
3.300 1.300 1.300 peak 281 spectrum 1 weight 0.10000E+01 volume 0.20930E-02 ppm1 7.288 ppm2 0.854 CV 1
OR { 281}
(( segid " " and resid 72 and name HN ))
( segid " " and resid 72 and name HG2%)
ASSI { 294}
(( segid " " and resid 71 and name HN ))
( segid " " and resid 17 and name HD1%)
3.800 1.800 1.800 peak 294 spectrum 1 weight 0.10000E+01 volume 0.82098E-03 ppm1 8.607 ppm2 0.556 CV 1
OR { 294}
(( segid " " and resid 71 and name HN ))
( segid " " and resid 29 and name HG1%)
OR { 294}
(( segid " " and resid 71 and name HN ))
( segid " " and resid 29 and name HG2%)
OR { 294}
(( segid " " and resid 71 and name HN ))
( segid " " and resid 73 and name HG1%)
ASSI { 296}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 16 and name HB3 ))
3.700 1.700 1.700 peak 296 spectrum 1 weight 0.10000E+01 volume 0.34769E-03 ppm1 8.607 ppm2 1.685 CV 1
OR { 296}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 16 and name HB2 ))
OR { 296}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 16 and name HD3 ))
OR { 296}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 29 and name HB ))
ASSI { 303}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 70 and name HG2 ))
2.400 0.700 0.700 peak 303 spectrum 1 weight 0.10000E+01 volume 0.48499E-02 ppm1 8.674 ppm2 2.453 CV 1
OR { 303}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 69 and name HG3 ))
ASSI { 334}
(( segid " " and resid 60 and name HD21))
(( segid " " and resid 64 and name HN ))
3.000 1.200 1.200 peak 334 spectrum 1 weight 0.10000E+01 volume 0.23447E-02 ppm1 7.717 ppm2 7.159 CV 1
OR { 334}
(( segid " " and resid 60 and name HD21))
(( segid " " and resid 65 and name HN ))
ASSI { 339}
(( segid " " and resid 60 and name HD22))
(( segid " " and resid 64 and name HN ))
3.500 1.600 1.600 peak 339 spectrum 1 weight 0.10000E+01 volume 0.24506E-02 ppm1 6.823 ppm2 7.158 CV 1
OR { 339}
(( segid " " and resid 60 and name HD22))
(( segid " " and resid 65 and name HN ))
ASSI { 348}
(( segid " " and resid 60 and name HD22))
(( segid " " and resid 60 and name HN ))
4.300 2.300 1.700 peak 348 spectrum 1 weight 0.10000E+01 volume 0.47467E-03 ppm1 6.825 ppm2 8.298 CV 1
OR { 348}
(( segid " " and resid 60 and name HD22))
(( segid " " and resid 62 and name HN ))
ASSI { 349}
(( segid " " and resid 60 and name HD21))
(( segid " " and resid 60 and name HN ))
3.700 1.700 1.700 peak 349 spectrum 1 weight 0.10000E+01 volume 0.51492E-03 ppm1 7.717 ppm2 8.297 CV 1
OR { 349}
(( segid " " and resid 60 and name HD21))
(( segid " " and resid 62 and name HN ))
ASSI { 363}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HA ))
3.000 1.100 1.100 peak 363 spectrum 1 weight 0.10000E+01 volume 0.17942E-02 ppm1 7.179 ppm2 3.818 CV 1
OR { 363}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 61 and name HA ))
ASSI { 365}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 69 and name HB2 ))
3.600 1.700 1.700 peak 365 spectrum 1 weight 0.10000E+01 volume 0.24960E-02 ppm1 9.228 ppm2 2.265 CV 1
OR { 365}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 67 and name HG2 ))
OR { 365}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 67 and name HG3 ))
ASSI { 367}
(( segid " " and resid 67 and name HN ))
( segid " " and resid 17 and name HD1%)
4.500 2.500 1.500 peak 367 spectrum 1 weight 0.10000E+01 volume 0.45520E-03 ppm1 9.039 ppm2 0.561 CV 1
OR { 367}
(( segid " " and resid 67 and name HN ))
( segid " " and resid 65 and name HD1%)
ASSI { 386}
(( segid " " and resid 65 and name HN ))
( segid " " and resid 44 and name HD1%)
3.500 1.600 1.600 peak 386 spectrum 1 weight 0.10000E+01 volume 0.14338E-02 ppm1 7.143 ppm2 0.581 CV 1
OR { 386}
(( segid " " and resid 65 and name HN ))
( segid " " and resid 61 and name HD1%)
ASSI { 396}
(( segid " " and resid 64 and name HN ))
( segid " " and resid 44 and name HD1%)
4.600 2.600 1.400 peak 396 spectrum 1 weight 0.10000E+01 volume 0.42829E-03 ppm1 7.183 ppm2 0.585 CV 1
OR { 396}
(( segid " " and resid 64 and name HN ))
( segid " " and resid 61 and name HD1%)
ASSI { 403}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HB3 ))
2.500 0.800 0.800 peak 403 spectrum 1 weight 0.10000E+01 volume 0.87642E-02 ppm1 8.376 ppm2 2.028 CV 1
OR { 403}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 7 and name HB3 ))
OR { 403}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 6 and name HB3 ))
ASSI { 405}
(( segid " " and resid 62 and name HN ))
( segid " " and resid 61 and name HD1%)
4.600 2.600 1.400 peak 405 spectrum 1 weight 0.10000E+01 volume 0.58413E-03 ppm1 8.295 ppm2 0.570 CV 1
OR { 405}
(( segid " " and resid 62 and name HN ))
( segid " " and resid 44 and name HD1%)
ASSI { 406}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 7 and name HA ))
2.200 0.600 0.600 peak 406 spectrum 1 weight 0.10000E+01 volume 0.13339E-01 ppm1 8.379 ppm2 4.345 CV 1
OR { 406}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 5 and name HA ))
ASSI { 415}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 8 and name HA ))
2.200 0.600 0.600 peak 415 spectrum 1 weight 0.10000E+01 volume 0.13021E-01 ppm1 8.351 ppm2 4.347 CV 1
OR { 415}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 9 and name HA ))
OR { 415}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 7 and name HA ))
OR { 415}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 8 and name HA ))
ASSI { 416}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 7 and name HB2 ))
3.900 1.900 1.900 peak 416 spectrum 1 weight 0.10000E+01 volume 0.59796E-03 ppm1 8.347 ppm2 2.128 CV 1
OR { 416}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 7 and name HB2 ))
ASSI { 417}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 7 and name HB3 ))
3.600 1.600 1.600 peak 417 spectrum 1 weight 0.10000E+01 volume 0.72161E-03 ppm1 8.354 ppm2 2.033 CV 1
OR { 417}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 7 and name HB3 ))
ASSI { 419}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 9 and name HG2 ))
3.000 1.100 1.100 peak 419 spectrum 1 weight 0.10000E+01 volume 0.26895E-02 ppm1 8.350 ppm2 1.487 CV 1
OR { 419}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 8 and name HG2 ))
OR { 419}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 8 and name HG3 ))
OR { 419}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 9 and name HG3 ))
ASSI { 428}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 12 and name HD1%)
4.400 2.400 1.600 peak 428 spectrum 1 weight 0.10000E+01 volume 0.35697E-03 ppm1 8.294 ppm2 0.831 CV 1
OR { 428}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 75 and name HG2%)
ASSI { 440}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 74 and name HB3 ))
4.600 2.600 1.400 peak 440 spectrum 1 weight 0.10000E+01 volume 0.29338E-03 ppm1 9.225 ppm2 1.935 CV 1
OR { 440}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 73 and name HB ))
OR { 440}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 74 and name HB2 ))
ASSI { 443}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 73 and name HG2%)
3.900 1.900 1.900 peak 443 spectrum 1 weight 0.10000E+01 volume 0.65723E-03 ppm1 8.746 ppm2 0.575 CV 1
OR { 443}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 29 and name HG1%)
ASSI { 459}
(( segid " " and resid 15 and name HN ))
( segid " " and resid 29 and name HG1%)
3.100 1.200 1.200 peak 459 spectrum 1 weight 0.10000E+01 volume 0.19916E-02 ppm1 9.052 ppm2 0.571 CV 1
OR { 459}
(( segid " " and resid 15 and name HN ))
( segid " " and resid 73 and name HG2%)
OR { 459}
(( segid " " and resid 15 and name HN ))
( segid " " and resid 29 and name HG2%)
ASSI { 468}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 69 and name HB3 ))
3.600 1.700 1.700 peak 468 spectrum 1 weight 0.10000E+01 volume 0.60136E-03 ppm1 8.820 ppm2 2.092 CV 1
OR { 468}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 70 and name HB3 ))
ASSI { 470}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HG13))
3.300 1.400 1.400 peak 470 spectrum 1 weight 0.10000E+01 volume 0.25776E-02 ppm1 8.817 ppm2 1.333 CV 1
OR { 470}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HG3 ))
ASSI { 476}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 29 and name HB ))
4.600 2.600 1.400 peak 476 spectrum 1 weight 0.10000E+01 volume 0.38009E-03 ppm1 9.223 ppm2 1.673 CV 1
OR { 476}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 16 and name HB3 ))
OR { 476}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 19 and name HG2 ))
ASSI { 482}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 29 and name HG2%)
3.600 1.600 1.600 peak 482 spectrum 1 weight 0.10000E+01 volume 0.19708E-02 ppm1 9.219 ppm2 0.558 CV 1
OR { 482}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 17 and name HD1%)
OR { 482}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 29 and name HG1%)
ASSI { 485}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 19 and name HG2 ))
3.600 1.600 1.600 peak 485 spectrum 1 weight 0.10000E+01 volume 0.11692E-02 ppm1 7.398 ppm2 1.665 CV 1
OR { 485}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 29 and name HB ))
ASSI { 490}
(( segid " " and resid 19 and name HN ))
( segid " " and resid 29 and name HG2%)
4.100 2.100 1.900 peak 490 spectrum 1 weight 0.10000E+01 volume 0.12556E-02 ppm1 7.401 ppm2 0.559 CV 1
OR { 490}
(( segid " " and resid 19 and name HN ))
( segid " " and resid 17 and name HD1%)
OR { 490}
(( segid " " and resid 19 and name HN ))
( segid " " and resid 61 and name HD1%)
OR { 490}
(( segid " " and resid 19 and name HN ))
( segid " " and resid 29 and name HG1%)
ASSI { 497}
(( segid " " and resid 20 and name HN ))
( segid " " and resid 61 and name HD1%)
4.500 2.500 1.500 peak 497 spectrum 1 weight 0.10000E+01 volume 0.55115E-03 ppm1 9.368 ppm2 0.569 CV 1
OR { 497}
(( segid " " and resid 20 and name HN ))
( segid " " and resid 65 and name HD1%)
OR { 497}
(( segid " " and resid 20 and name HN ))
( segid " " and resid 26 and name HB% )
ASSI { 519}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 36 and name HA ))
3.700 1.700 1.700 peak 519 spectrum 1 weight 0.10000E+01 volume 0.69903E-03 ppm1 8.997 ppm2 5.094 CV 1
OR { 519}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 30 and name HA ))
ASSI { 520}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HA ))
3.000 1.100 1.100 peak 520 spectrum 1 weight 0.10000E+01 volume 0.17019E-02 ppm1 8.995 ppm2 4.636 CV 1
OR { 520}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 38 and name HA ))
ASSI { 534}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 29 and name HB ))
4.100 2.100 1.900 peak 534 spectrum 1 weight 0.10000E+01 volume 0.51325E-03 ppm1 8.972 ppm2 1.706 CV 1
OR { 534}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 39 and name HB3 ))
ASSI { 536}
(( segid " " and resid 28 and name HN ))
( segid " " and resid 29 and name HG2%)
3.400 1.400 1.400 peak 536 spectrum 1 weight 0.10000E+01 volume 0.11580E-02 ppm1 8.983 ppm2 0.567 CV 1
OR { 536}
(( segid " " and resid 28 and name HN ))
( segid " " and resid 61 and name HD1%)
OR { 536}
(( segid " " and resid 28 and name HN ))
( segid " " and resid 26 and name HB% )
OR { 536}
(( segid " " and resid 28 and name HN ))
( segid " " and resid 29 and name HG1%)
ASSI { 539}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 39 and name HB3 ))
3.400 1.400 1.400 peak 539 spectrum 1 weight 0.10000E+01 volume 0.13053E-02 ppm1 8.173 ppm2 1.679 CV 1
OR { 539}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 61 and name HB ))
OR { 539}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 24 and name HB2 ))
ASSI { 542}
(( segid " " and resid 27 and name HN ))
( segid " " and resid 61 and name HG2%)
4.400 2.400 1.600 peak 542 spectrum 1 weight 0.10000E+01 volume 0.61602E-03 ppm1 8.171 ppm2 0.897 CV 1
OR { 542}
(( segid " " and resid 27 and name HN ))
( segid " " and resid 41 and name HD2%)
ASSI { 547}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 21 and name HB3 ))
3.900 1.900 1.900 peak 547 spectrum 1 weight 0.10000E+01 volume 0.16635E-02 ppm1 7.327 ppm2 1.857 CV 1
OR { 547}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 24 and name HB3 ))
ASSI { 551}
(( segid " " and resid 26 and name HN ))
( segid " " and resid 26 and name HB% )
2.400 0.700 0.700 peak 551 spectrum 1 weight 0.10000E+01 volume 0.77958E-02 ppm1 7.327 ppm2 0.572 CV 1
OR { 551}
(( segid " " and resid 26 and name HN ))
( segid " " and resid 61 and name HD1%)
ASSI { 553}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 24 and name HB2 ))
3.400 1.500 1.500 peak 553 spectrum 1 weight 0.10000E+01 volume 0.17536E-02 ppm1 7.326 ppm2 1.711 CV 1
OR { 553}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 61 and name HB ))
ASSI { 557}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 41 and name HB3 ))
4.800 2.800 1.200 peak 557 spectrum 1 weight 0.10000E+01 volume 0.30222E-03 ppm1 7.991 ppm2 1.993 CV 1
OR { 557}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 67 and name HB2 ))
OR { 557}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 67 and name HB3 ))
ASSI { 570}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 21 and name HG2 ))
3.700 1.700 1.700 peak 570 spectrum 1 weight 0.10000E+01 volume 0.14006E-02 ppm1 7.303 ppm2 2.344 CV 1
OR { 570}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 21 and name HG3 ))
OR { 570}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 25 and name HG3 ))
OR { 570}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 25 and name HG2 ))
ASSI { 571}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 21 and name HB2 ))
4.400 2.500 1.600 peak 571 spectrum 1 weight 0.10000E+01 volume 0.10091E-02 ppm1 7.303 ppm2 2.205 CV 1
OR { 571}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 25 and name HB3 ))
ASSI { 584}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 61 and name HG2%)
3.800 1.800 1.800 peak 584 spectrum 1 weight 0.10000E+01 volume 0.89770E-03 ppm1 8.835 ppm2 0.849 CV 1
OR { 584}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HG13))
ASSI { 586}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 61 and name HD1%)
4.000 2.000 2.000 peak 586 spectrum 1 weight 0.10000E+01 volume 0.94233E-03 ppm1 8.834 ppm2 0.572 CV 1
OR { 586}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 26 and name HB% )
ASSI { 595}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 31 and name HB3 ))
3.500 1.500 1.500 peak 595 spectrum 1 weight 0.10000E+01 volume 0.10410E-02 ppm1 9.024 ppm2 2.138 CV 1
OR { 595}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HB2 ))
ASSI { 615}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 18 and name HG2%)
4.000 2.000 2.000 peak 615 spectrum 1 weight 0.10000E+01 volume 0.31591E-03 ppm1 9.795 ppm2 0.990 CV 1
OR { 615}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 75 and name HG12))
ASSI { 616}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 29 and name HG1%)
3.400 1.400 1.400 peak 616 spectrum 1 weight 0.10000E+01 volume 0.16957E-02 ppm1 9.796 ppm2 0.561 CV 1
OR { 616}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 87 and name HD1%)
OR { 616}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 29 and name HG2%)
ASSI { 620}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 87 and name HG ))
3.200 1.300 1.300 peak 620 spectrum 1 weight 0.10000E+01 volume 0.18604E-02 ppm1 9.133 ppm2 1.491 CV 1
OR { 620}
(( segid " " and resid 38 and name HN ))
( segid " " and resid 85 and name HB% )
ASSI { 621}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 75 and name HD1%)
4.200 2.200 1.800 peak 621 spectrum 1 weight 0.10000E+01 volume 0.39868E-03 ppm1 8.891 ppm2 0.787 CV 1
OR { 621}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 41 and name HD1%)
ASSI { 627}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 26 and name HB% )
2.800 1.000 1.000 peak 627 spectrum 1 weight 0.10000E+01 volume 0.38608E-02 ppm1 8.887 ppm2 0.589 CV 1
OR { 627}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 39 and name HD1%)
OR { 627}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 29 and name HG2%)
ASSI { 634}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 25 and name HB2 ))
3.100 1.200 1.200 peak 634 spectrum 1 weight 0.10000E+01 volume 0.14743E-02 ppm1 8.454 ppm2 2.343 CV 1
OR { 634}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 79 and name HG2 ))
OR { 634}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 79 and name HG3 ))
ASSI { 635}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 79 and name HB3 ))
3.700 1.700 1.700 peak 635 spectrum 1 weight 0.10000E+01 volume 0.74468E-03 ppm1 8.471 ppm2 2.112 CV 1
OR { 635}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 44 and name HB ))
ASSI { 638}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 25 and name HB3 ))
4.100 2.100 1.900 peak 638 spectrum 1 weight 0.10000E+01 volume 0.99133E-03 ppm1 8.476 ppm2 2.200 CV 1
OR { 638}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HG2 ))
OR { 638}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HG3 ))
ASSI { 647}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 40 and name HB2 ))
2.600 0.900 0.900 peak 647 spectrum 1 weight 0.10000E+01 volume 0.37505E-02 ppm1 8.756 ppm2 2.019 CV 1
OR { 647}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HB3 ))
ASSI { 652}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 44 and name HD1%)
4.100 2.100 1.900 peak 652 spectrum 1 weight 0.10000E+01 volume 0.50823E-03 ppm1 8.755 ppm2 0.582 CV 1
OR { 652}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 61 and name HD1%)
ASSI { 661}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 44 and name HD1%)
4.000 2.000 2.000 peak 661 spectrum 1 weight 0.10000E+01 volume 0.94068E-03 ppm1 7.884 ppm2 0.593 CV 1
OR { 661}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 61 and name HD1%)
ASSI { 662}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 45 and name HB% )
4.900 2.900 1.100 peak 662 spectrum 1 weight 0.10000E+01 volume 0.32581E-03 ppm1 7.693 ppm2 1.168 CV 1
OR { 662}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 27 and name HB% )
ASSI { 663}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 39 and name HD2%)
4.300 2.300 1.700 peak 663 spectrum 1 weight 0.10000E+01 volume 0.34396E-03 ppm1 7.677 ppm2 0.346 CV 1
OR { 663}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 64 and name HG2%)
ASSI { 669}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 59 and name HB3 ))
4.900 3.000 1.100 peak 669 spectrum 1 weight 0.10000E+01 volume 0.50051E-03 ppm1 7.679 ppm2 1.724 CV 1
OR { 669}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 61 and name HB ))
ASSI { 674}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 41 and name HD1%)
3.600 1.600 1.600 peak 674 spectrum 1 weight 0.10000E+01 volume 0.14210E-02 ppm1 7.686 ppm2 0.825 CV 1
OR { 674}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 44 and name HG2%)
ASSI { 679}
(( segid " " and resid 45 and name HN ))
( segid " " and resid 94 and name HB% )
4.500 2.500 1.500 peak 679 spectrum 1 weight 0.10000E+01 volume 0.75111E-03 ppm1 7.834 ppm2 1.409 CV 1
OR { 679}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 65 and name HG ))
ASSI { 681}
(( segid " " and resid 45 and name HN ))
( segid " " and resid 89 and name HG2%)
3.500 1.600 1.600 peak 681 spectrum 1 weight 0.10000E+01 volume 0.96074E-03 ppm1 7.833 ppm2 0.946 CV 1
OR { 681}
(( segid " " and resid 45 and name HN ))
( segid " " and resid 93 and name HD1%)
ASSI { 683}
(( segid " " and resid 45 and name HN ))
( segid " " and resid 44 and name HD1%)
4.700 2.700 1.300 peak 683 spectrum 1 weight 0.10000E+01 volume 0.44187E-03 ppm1 7.835 ppm2 0.574 CV 1
OR { 683}
(( segid " " and resid 45 and name HN ))
( segid " " and resid 65 and name HD1%)
ASSI { 702}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 49 and name HB3 ))
2.300 0.700 0.700 peak 702 spectrum 1 weight 0.10000E+01 volume 0.86656E-02 ppm1 7.905 ppm2 3.368 CV 1
OR { 702}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 46 and name HA ))
ASSI { 707}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 59 and name HB3 ))
3.600 1.600 1.600 peak 707 spectrum 1 weight 0.10000E+01 volume 0.87916E-03 ppm1 7.907 ppm2 1.758 CV 1
OR { 707}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 46 and name HB2 ))
ASSI { 725}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 60 and name HB2 ))
3.500 1.600 1.600 peak 725 spectrum 1 weight 0.10000E+01 volume 0.11652E-02 ppm1 8.293 ppm2 2.836 CV 1
OR { 725}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 63 and name HB3 ))
OR { 725}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 63 and name HB2 ))
ASSI { 726}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 50 and name HD2 ))
4.200 2.200 1.800 peak 726 spectrum 1 weight 0.10000E+01 volume 0.49091E-03 ppm1 7.767 ppm2 3.379 CV 1
OR { 726}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 49 and name HB3 ))
ASSI { 738}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 44 and name HG12))
4.500 2.600 1.500 peak 738 spectrum 1 weight 0.10000E+01 volume 0.61043E-03 ppm1 8.474 ppm2 1.849 CV 1
OR { 738}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 42 and name HD2 ))
ASSI { 739}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 62 and name HA ))
4.400 2.400 1.600 peak 739 spectrum 1 weight 0.10000E+01 volume 0.41526E-03 ppm1 9.553 ppm2 4.179 CV 1
OR { 739}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 22 and name HA ))
ASSI { 777}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 28 and name HN ))
3.300 1.400 1.400 peak 777 spectrum 1 weight 0.10000E+01 volume 0.16786E-02 ppm1 9.222 ppm2 8.990 CV 1
OR { 777}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 30 and name HN ))
ASSI { 908}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 62 and name HN ))
3.000 1.100 1.100 peak 908 spectrum 1 weight 0.10000E+01 volume 0.16183E-02 ppm1 9.567 ppm2 8.305 CV 1
OR { 908}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 60 and name HN ))
ASSI { 2}
( segid " " and resid 44 and name HG2%)
( segid " " and resid 48 and name HD% )
2.700 0.900 0.900 peak 2 spectrum 1 weight 0.10000E+01 volume 0.29670E-02 ppm1 0.835 ppm2 7.305 CV 1
OR { 2}
( segid " " and resid 72 and name HG2%)
(( segid " " and resid 72 and name HN ))
ASSI { 8}
(( segid " " and resid 74 and name HB2 ))
( segid " " and resid 75 and name HG2%)
3.500 1.600 1.600 peak 8 spectrum 1 weight 0.10000E+01 volume 0.11495E-02 ppm1 1.939 ppm2 0.847 CV 1
OR { 8}
(( segid " " and resid 74 and name HB3 ))
( segid " " and resid 91 and name HG2%)
OR { 8}
(( segid " " and resid 74 and name HB3 ))
( segid " " and resid 75 and name HG2%)
OR { 8}
(( segid " " and resid 74 and name HB2 ))
( segid " " and resid 91 and name HG2%)
ASSI { 23}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 11 and name HN ))
2.600 0.900 0.900 peak 23 spectrum 1 weight 0.10000E+01 volume 0.37882E-02 ppm1 4.377 ppm2 8.295 CV 1
OR { 23}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 10 and name HN ))
ASSI { 24}
(( segid " " and resid 71 and name HB ))
( segid " " and resid 93 and name HD2%)
3.900 1.900 1.900 peak 24 spectrum 1 weight 0.10000E+01 volume 0.66448E-03 ppm1 1.433 ppm2 0.849 CV 1
OR { 24}
(( segid " " and resid 71 and name HB ))
( segid " " and resid 72 and name HG2%)
ASSI { 25}
(( segid " " and resid 71 and name HB ))
( segid " " and resid 93 and name HD1%)
3.300 1.400 1.400 peak 25 spectrum 1 weight 0.10000E+01 volume 0.11652E-02 ppm1 1.428 ppm2 0.970 CV 1
OR { 25}
(( segid " " and resid 71 and name HB ))
( segid " " and resid 89 and name HG2%)
ASSI { 38}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 21 and name HN ))
3.700 1.700 1.700 peak 38 spectrum 1 weight 0.10000E+01 volume 0.27647E-03 ppm1 0.574 ppm2 8.844 CV 1
OR { 38}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 17 and name HN ))
ASSI { 39}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 25 and name HN ))
4.400 2.400 1.600 peak 39 spectrum 1 weight 0.10000E+01 volume 0.23007E-03 ppm1 0.572 ppm2 7.989 CV 1
OR { 39}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 66 and name HN ))
ASSI { 65}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 39 and name HA ))
4.500 2.500 1.500 peak 65 spectrum 1 weight 0.10000E+01 volume 0.38167E-03 ppm1 1.504 ppm2 4.976 CV 1
OR { 65}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 86 and name HA ))
ASSI { 68}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 73 and name HB ))
4.000 2.000 2.000 peak 68 spectrum 1 weight 0.10000E+01 volume 0.52450E-03 ppm1 5.174 ppm2 1.941 CV 1
OR { 68}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 91 and name HB ))
ASSI { 79}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 30 and name HN ))
3.900 1.900 1.900 peak 79 spectrum 1 weight 0.10000E+01 volume 0.70498E-03 ppm1 4.294 ppm2 8.994 CV 1
OR { 79}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 28 and name HN ))
ASSI { 88}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 15 and name HN ))
3.200 1.300 1.300 peak 88 spectrum 1 weight 0.10000E+01 volume 0.13956E-02 ppm1 0.374 ppm2 9.056 CV 1
OR { 88}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 73 and name HN ))
ASSI { 95}
(( segid " " and resid 40 and name HD3 ))
( segid " " and resid 39 and name HD1%)
2.900 2.900 3.100 peak 95 spectrum 1 weight 0.10000E+01 volume 0.12666E-02 ppm1 3.813 ppm2 0.605 CV 1
OR { 95}
(( segid " " and resid 40 and name HD3 ))
( segid " " and resid 44 and name HD1%)
ASSI { 108}
(( segid " " and resid 94 and name HA ))
( segid " " and resid 93 and name HD2%)
3.400 1.500 1.500 peak 108 spectrum 1 weight 0.10000E+01 volume 0.56671E-03 ppm1 4.382 ppm2 0.868 CV 1
OR { 108}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 12 and name HG12))
OR { 108}
(( segid " " and resid 10 and name HA ))
( segid " " and resid 75 and name HG2%)
ASSI { 146}
(( segid " " and resid 96 and name HA ))
(( segid " " and resid 95 and name HN ))
3.500 3.500 2.500 peak 146 spectrum 1 weight 0.10000E+01 volume 0.43405E-03 ppm1 4.363 ppm2 8.411 CV 1
OR { 146}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 95 and name HN ))
ASSI { 152}
(( segid " " and resid 95 and name HA2 ))
( segid " " and resid 51 and name HB% )
2.900 1.000 1.000 peak 152 spectrum 1 weight 0.10000E+01 volume 0.10560E-02 ppm1 4.020 ppm2 1.442 CV 1
OR { 152}
(( segid " " and resid 95 and name HA1 ))
( segid " " and resid 51 and name HB% )
OR { 152}
(( segid " " and resid 95 and name HA2 ))
( segid " " and resid 94 and name HB% )
ASSI { 175}
(( segid " " and resid 16 and name HE2 ))
(( segid " " and resid 16 and name HA ))
4.000 2.000 2.000 peak 175 spectrum 1 weight 0.10000E+01 volume 0.93719E-03 ppm1 3.012 ppm2 5.255 CV 1
OR { 175}
(( segid " " and resid 16 and name HE3 ))
(( segid " " and resid 16 and name HA ))
OR { 175}
(( segid " " and resid 16 and name HE2 ))
(( segid " " and resid 70 and name HA ))
ASSI { 200}
(( segid " " and resid 66 and name HD3 ))
(( segid " " and resid 50 and name HD2 ))
2.600 2.600 3.400 peak 200 spectrum 1 weight 0.10000E+01 volume 0.18399E-02 ppm1 3.224 ppm2 3.389 CV 1
OR { 200}
(( segid " " and resid 66 and name HD2 ))
(( segid " " and resid 50 and name HD2 ))
OR { 200}
(( segid " " and resid 66 and name HD2 ))
(( segid " " and resid 49 and name HB3 ))
ASSI { 201}
(( segid " " and resid 19 and name HD3 ))
(( segid " " and resid 19 and name HG3 ))
2.500 0.800 0.800 peak 201 spectrum 1 weight 0.10000E+01 volume 0.59265E-02 ppm1 3.076 ppm2 1.599 CV 1
OR { 201}
(( segid " " and resid 35 and name HD2 ))
(( segid " " and resid 35 and name HG2 ))
ASSI { 219}
(( segid " " and resid 83 and name HE2 ))
(( segid " " and resid 83 and name HG3 ))
2.700 0.900 0.900 peak 219 spectrum 1 weight 0.10000E+01 volume 0.39009E-02 ppm1 2.970 ppm2 1.476 CV 1
OR { 219}
(( segid " " and resid 83 and name HE3 ))
(( segid " " and resid 83 and name HG3 ))
OR { 219}
(( segid " " and resid 83 and name HE2 ))
(( segid " " and resid 83 and name HG2 ))
OR { 219}
(( segid " " and resid 83 and name HE3 ))
(( segid " " and resid 83 and name HG2 ))
OR { 219}
(( segid " " and resid 14 and name HE3 ))
(( segid " " and resid 14 and name HG2 ))
ASSI { 221}
(( segid " " and resid 22 and name HD3 ))
(( segid " " and resid 22 and name HB3 ))
3.500 1.500 1.500 peak 221 spectrum 1 weight 0.10000E+01 volume 0.17214E-02 ppm1 4.106 ppm2 2.202 CV 1
OR { 221}
(( segid " " and resid 22 and name HD3 ))
(( segid " " and resid 21 and name HB2 ))
ASSI { 225}
(( segid " " and resid 14 and name HE2 ))
(( segid " " and resid 14 and name HB2 ))
3.100 1.200 1.200 peak 225 spectrum 1 weight 0.10000E+01 volume 0.30761E-02 ppm1 2.971 ppm2 1.888 CV 1
OR { 225}
(( segid " " and resid 14 and name HE3 ))
(( segid " " and resid 14 and name HB2 ))
OR { 225}
(( segid " " and resid 83 and name HE2 ))
(( segid " " and resid 83 and name HB3 ))
OR { 225}
(( segid " " and resid 83 and name HE3 ))
(( segid " " and resid 83 and name HB3 ))
ASSI { 227}
(( segid " " and resid 14 and name HE3 ))
(( segid " " and resid 70 and name HG3 ))
3.200 1.300 1.300 peak 227 spectrum 1 weight 0.10000E+01 volume 0.16156E-02 ppm1 3.007 ppm2 2.134 CV 1
OR { 227}
(( segid " " and resid 14 and name HE2 ))
(( segid " " and resid 70 and name HG3 ))
OR { 227}
(( segid " " and resid 16 and name HE2 ))
(( segid " " and resid 70 and name HG3 ))
ASSI { 228}
(( segid " " and resid 22 and name HD2 ))
(( segid " " and resid 62 and name HD2 ))
4.600 2.600 1.400 peak 228 spectrum 1 weight 0.10000E+01 volume 0.42398E-03 ppm1 3.903 ppm2 1.755 CV 1
OR { 228}
(( segid " " and resid 22 and name HD2 ))
(( segid " " and resid 62 and name HD3 ))
OR { 228}
(( segid " " and resid 22 and name HD2 ))
(( segid " " and resid 24 and name HG ))
ASSI { 231}
(( segid " " and resid 40 and name HD2 ))
(( segid " " and resid 40 and name HG2 ))
2.700 0.900 0.900 peak 231 spectrum 1 weight 0.10000E+01 volume 0.33972E-02 ppm1 3.888 ppm2 2.191 CV 1
OR { 231}
(( segid " " and resid 40 and name HD2 ))
(( segid " " and resid 40 and name HG3 ))
OR { 231}
(( segid " " and resid 22 and name HD2 ))
(( segid " " and resid 22 and name HB3 ))
ASSI { 232}
(( segid " " and resid 40 and name HD2 ))
( segid " " and resid 26 and name HB% )
3.600 1.600 1.600 peak 232 spectrum 1 weight 0.10000E+01 volume 0.13848E-02 ppm1 3.877 ppm2 0.599 CV 1
OR { 232}
(( segid " " and resid 40 and name HD2 ))
( segid " " and resid 39 and name HD1%)
ASSI { 241}
(( segid " " and resid 8 and name HE2 ))
(( segid " " and resid 8 and name HG3 ))
2.300 0.600 0.600 peak 241 spectrum 1 weight 0.10000E+01 volume 0.11840E-01 ppm1 3.050 ppm2 1.485 CV 1
OR { 241}
(( segid " " and resid 9 and name HE3 ))
(( segid " " and resid 9 and name HG3 ))
OR { 241}
(( segid " " and resid 77 and name HE3 ))
(( segid " " and resid 77 and name HG2 ))
OR { 241}
(( segid " " and resid 77 and name HE3 ))
(( segid " " and resid 77 and name HG3 ))
OR { 241}
(( segid " " and resid 9 and name HE3 ))
(( segid " " and resid 9 and name HG2 ))
OR { 241}
(( segid " " and resid 8 and name HE3 ))
(( segid " " and resid 8 and name HG3 ))
OR { 241}
(( segid " " and resid 8 and name HE2 ))
(( segid " " and resid 8 and name HG2 ))
OR { 241}
(( segid " " and resid 77 and name HE2 ))
(( segid " " and resid 77 and name HG2 ))
OR { 241}
(( segid " " and resid 77 and name HE2 ))
(( segid " " and resid 77 and name HG3 ))
OR { 241}
(( segid " " and resid 9 and name HE2 ))
(( segid " " and resid 9 and name HG3 ))
ASSI { 259}
(( segid " " and resid 9 and name HE2 ))
(( segid " " and resid 9 and name HD3 ))
1.900 0.500 0.500 peak 259 spectrum 1 weight 0.10000E+01 volume 0.22231E-01 ppm1 3.053 ppm2 1.747 CV 1
OR { 259}
(( segid " " and resid 77 and name HE2 ))
(( segid " " and resid 77 and name HD2 ))
OR { 259}
(( segid " " and resid 62 and name HE3 ))
(( segid " " and resid 62 and name HD3 ))
OR { 259}
(( segid " " and resid 77 and name HE3 ))
(( segid " " and resid 77 and name HD3 ))
OR { 259}
(( segid " " and resid 9 and name HE3 ))
(( segid " " and resid 9 and name HD2 ))
OR { 259}
(( segid " " and resid 9 and name HE2 ))
(( segid " " and resid 9 and name HD2 ))
OR { 259}
(( segid " " and resid 9 and name HE3 ))
(( segid " " and resid 9 and name HD3 ))
OR { 259}
(( segid " " and resid 62 and name HE2 ))
(( segid " " and resid 62 and name HD3 ))
OR { 259}
(( segid " " and resid 77 and name HE3 ))
(( segid " " and resid 77 and name HD2 ))
OR { 259}
(( segid " " and resid 77 and name HE2 ))
(( segid " " and resid 77 and name HD3 ))
ASSI { 262}
(( segid " " and resid 62 and name HE3 ))
(( segid " " and resid 22 and name HG2 ))
3.300 1.400 1.400 peak 262 spectrum 1 weight 0.10000E+01 volume 0.43260E-03 ppm1 3.056 ppm2 2.320 CV 1
OR { 262}
(( segid " " and resid 62 and name HE2 ))
(( segid " " and resid 22 and name HG2 ))
OR { 262}
(( segid " " and resid 9 and name HE3 ))
(( segid " " and resid 6 and name HG2 ))
OR { 262}
(( segid " " and resid 9 and name HE3 ))
(( segid " " and resid 6 and name HG3 ))
OR { 262}
(( segid " " and resid 9 and name HE2 ))
(( segid " " and resid 6 and name HG2 ))
OR { 262}
(( segid " " and resid 9 and name HE2 ))
(( segid " " and resid 6 and name HG3 ))
OR { 262}
(( segid " " and resid 77 and name HE3 ))
(( segid " " and resid 76 and name HB2 ))
OR { 262}
(( segid " " and resid 77 and name HE2 ))
(( segid " " and resid 76 and name HB2 ))
ASSI { 269}
(( segid " " and resid 35 and name HD3 ))
(( segid " " and resid 35 and name HG2 ))
2.300 0.600 0.600 peak 269 spectrum 1 weight 0.10000E+01 volume 0.79005E-02 ppm1 2.982 ppm2 1.579 CV 1
OR { 269}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 46 and name HG3 ))
OR { 269}
(( segid " " and resid 46 and name HD3 ))
(( segid " " and resid 46 and name HG3 ))
OR { 269}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 46 and name HG2 ))
ASSI { 273}
( segid " " and resid 64 and name HG1%)
( segid " " and resid 65 and name HD2%)
2.700 0.900 0.900 peak 273 spectrum 1 weight 0.10000E+01 volume 0.39506E-02 ppm1 0.106 ppm2 0.613 CV 1
OR { 273}
( segid " " and resid 64 and name HG1%)
( segid " " and resid 44 and name HD1%)
ASSI { 274}
( segid " " and resid 61 and name HG2%)
(( segid " " and resid 22 and name HB3 ))
3.300 1.400 1.400 peak 274 spectrum 1 weight 0.10000E+01 volume 0.97997E-03 ppm1 0.875 ppm2 2.206 CV 1
OR { 274}
( segid " " and resid 61 and name HG2%)
(( segid " " and resid 25 and name HB3 ))
OR { 274}
( segid " " and resid 61 and name HG2%)
(( segid " " and resid 59 and name HB2 ))
ASSI { 275}
( segid " " and resid 61 and name HG2%)
(( segid " " and resid 25 and name HB2 ))
3.200 1.200 1.200 peak 275 spectrum 1 weight 0.10000E+01 volume 0.97333E-03 ppm1 0.874 ppm2 2.333 CV 1
OR { 275}
( segid " " and resid 61 and name HG2%)
(( segid " " and resid 22 and name HG2 ))
OR { 275}
( segid " " and resid 61 and name HG2%)
(( segid " " and resid 25 and name HG2 ))
ASSI { 277}
( segid " " and resid 61 and name HG2%)
(( segid " " and resid 62 and name HA ))
2.500 0.800 0.800 peak 277 spectrum 1 weight 0.10000E+01 volume 0.51940E-02 ppm1 0.873 ppm2 4.200 CV 1
OR { 277}
( segid " " and resid 61 and name HG2%)
(( segid " " and resid 22 and name HA ))
ASSI { 280}
( segid " " and resid 61 and name HG2%)
(( segid " " and resid 25 and name HA ))
2.600 0.900 0.900 peak 280 spectrum 1 weight 0.10000E+01 volume 0.35768E-02 ppm1 0.874 ppm2 3.788 CV 1
OR { 280}
( segid " " and resid 61 and name HG2%)
(( segid " " and resid 61 and name HA ))
ASSI { 282}
( segid " " and resid 61 and name HG2%)
(( segid " " and resid 62 and name HB2 ))
3.500 1.500 1.500 peak 282 spectrum 1 weight 0.10000E+01 volume 0.19977E-02 ppm1 0.871 ppm2 1.834 CV 1
OR { 282}
( segid " " and resid 61 and name HG2%)
(( segid " " and resid 62 and name HB3 ))
OR { 282}
( segid " " and resid 61 and name HG2%)
(( segid " " and resid 20 and name HB ))
ASSI { 314}
( segid " " and resid 55 and name HB% )
( segid " " and resid 53 and name HD% )
2.900 1.000 1.000 peak 314 spectrum 1 weight 0.10000E+01 volume 0.13061E-02 ppm1 1.284 ppm2 7.101 CV 1
OR { 314}
( segid " " and resid 55 and name HB% )
(( segid " " and resid 56 and name HD2 ))
ASSI { 320}
( segid " " and resid 71 and name HG1%)
(( segid " " and resid 70 and name HA ))
3.600 1.600 1.600 peak 320 spectrum 1 weight 0.10000E+01 volume 0.70806E-03 ppm1 0.313 ppm2 5.246 CV 1
OR { 320}
( segid " " and resid 71 and name HG1%)
(( segid " " and resid 16 and name HA ))
ASSI { 338}
(( segid " " and resid 19 and name HD2 ))
(( segid " " and resid 19 and name HE ))
3.800 1.800 1.800 peak 338 spectrum 1 weight 0.10000E+01 volume 0.45399E-03 ppm1 3.247 ppm2 7.369 CV 1
OR { 338}
(( segid " " and resid 19 and name HD2 ))
( segid " " and resid 28 and name HE% )
ASSI { 352}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 8 and name HN ))
2.500 0.800 0.800 peak 352 spectrum 1 weight 0.10000E+01 volume 0.55484E-02 ppm1 4.352 ppm2 8.332 CV 1
OR { 352}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HN ))
OR { 352}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HN ))
OR { 352}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 8 and name HN ))
ASSI { 379}
(( segid " " and resid 62 and name HE2 ))
( segid " " and resid 61 and name HG2%)
3.200 1.300 1.300 peak 379 spectrum 1 weight 0.10000E+01 volume 0.56401E-03 ppm1 3.042 ppm2 0.862 CV 1
OR { 379}
(( segid " " and resid 62 and name HE3 ))
( segid " " and resid 61 and name HG2%)
OR { 379}
(( segid " " and resid 9 and name HE3 ))
(( segid " " and resid 12 and name HG12))
OR { 379}
(( segid " " and resid 9 and name HE2 ))
(( segid " " and resid 12 and name HG12))
OR { 379}
(( segid " " and resid 77 and name HE3 ))
( segid " " and resid 75 and name HG2%)
OR { 379}
(( segid " " and resid 16 and name HE2 ))
( segid " " and resid 72 and name HD1%)
OR { 379}
(( segid " " and resid 16 and name HE3 ))
( segid " " and resid 72 and name HD1%)
ASSI { 389}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 50 and name HA ))
3.200 3.200 2.800 peak 389 spectrum 1 weight 0.10000E+01 volume 0.64250E-03 ppm1 3.041 ppm2 4.550 CV 1
OR { 389}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 59 and name HA ))
ASSI { 398}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 50 and name HD2 ))
3.400 1.400 1.400 peak 398 spectrum 1 weight 0.10000E+01 volume 0.11808E-02 ppm1 3.039 ppm2 3.390 CV 1
OR { 398}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 49 and name HB3 ))
ASSI { 415}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 44 and name HG12))
4.400 2.500 1.600 peak 415 spectrum 1 weight 0.10000E+01 volume 0.44804E-03 ppm1 3.801 ppm2 1.821 CV 1
OR { 415}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 62 and name HB2 ))
OR { 415}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 62 and name HB3 ))
OR { 415}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 20 and name HB ))
ASSI { 417}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 20 and name HG12))
4.600 2.600 1.400 peak 417 spectrum 1 weight 0.10000E+01 volume 0.41383E-03 ppm1 3.786 ppm2 1.476 CV 1
OR { 417}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 62 and name HG3 ))
ASSI { 418}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 65 and name HG ))
3.900 1.900 1.900 peak 418 spectrum 1 weight 0.10000E+01 volume 0.58223E-03 ppm1 3.789 ppm2 1.394 CV 1
OR { 418}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 41 and name HB2 ))
OR { 418}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 65 and name HB2 ))
ASSI { 421}
(( segid " " and resid 61 and name HA ))
( segid " " and resid 61 and name HG2%)
3.200 1.200 1.200 peak 421 spectrum 1 weight 0.10000E+01 volume 0.23904E-02 ppm1 3.791 ppm2 0.893 CV 1
OR { 421}
(( segid " " and resid 61 and name HA ))
( segid " " and resid 41 and name HD2%)
ASSI { 424}
(( segid " " and resid 61 and name HA ))
( segid " " and resid 44 and name HD1%)
3.300 1.400 1.400 peak 424 spectrum 1 weight 0.10000E+01 volume 0.23546E-02 ppm1 3.791 ppm2 0.583 CV 1
OR { 424}
(( segid " " and resid 61 and name HA ))
( segid " " and resid 61 and name HD1%)
ASSI { 426}
(( segid " " and resid 61 and name HB ))
(( segid " " and resid 44 and name HG12))
4.000 2.000 2.000 peak 426 spectrum 1 weight 0.10000E+01 volume 0.11710E-02 ppm1 1.699 ppm2 1.824 CV 1
OR { 426}
(( segid " " and resid 61 and name HB ))
(( segid " " and resid 62 and name HB3 ))
OR { 426}
(( segid " " and resid 61 and name HB ))
(( segid " " and resid 20 and name HB ))
ASSI { 434}
(( segid " " and resid 61 and name HB ))
( segid " " and resid 61 and name HG2%)
2.400 0.700 0.700 peak 434 spectrum 1 weight 0.10000E+01 volume 0.39159E-02 ppm1 1.707 ppm2 0.890 CV 1
OR { 434}
(( segid " " and resid 61 and name HB ))
( segid " " and resid 41 and name HD2%)
ASSI { 451}
(( segid " " and resid 64 and name HB ))
( segid " " and resid 44 and name HD1%)
3.800 1.800 1.800 peak 451 spectrum 1 weight 0.10000E+01 volume 0.63771E-03 ppm1 1.622 ppm2 0.597 CV 1
OR { 451}
(( segid " " and resid 64 and name HB ))
( segid " " and resid 65 and name HD2%)
ASSI { 456}
(( segid " " and resid 66 and name HB3 ))
(( segid " " and resid 69 and name HB2 ))
4.500 2.500 1.500 peak 456 spectrum 1 weight 0.10000E+01 volume 0.80059E-03 ppm1 1.693 ppm2 2.280 CV 1
OR { 456}
(( segid " " and resid 66 and name HB3 ))
(( segid " " and resid 67 and name HG3 ))
ASSI { 464}
(( segid " " and resid 64 and name HB ))
(( segid " " and resid 65 and name HN ))
2.800 1.000 1.000 peak 464 spectrum 1 weight 0.10000E+01 volume 0.21759E-02 ppm1 1.625 ppm2 7.174 CV 1
OR { 464}
(( segid " " and resid 64 and name HB ))
(( segid " " and resid 64 and name HN ))
ASSI { 465}
(( segid " " and resid 63 and name HB3 ))
(( segid " " and resid 62 and name HN ))
4.200 2.200 1.800 peak 465 spectrum 1 weight 0.10000E+01 volume 0.67657E-03 ppm1 2.846 ppm2 8.306 CV 1
OR { 465}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 62 and name HN ))
OR { 465}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 60 and name HN ))
ASSI { 476}
(( segid " " and resid 42 and name HB3 ))
(( segid " " and resid 43 and name HG3 ))
3.400 1.500 1.500 peak 476 spectrum 1 weight 0.10000E+01 volume 0.29996E-02 ppm1 1.899 ppm2 2.205 CV 1
OR { 476}
(( segid " " and resid 42 and name HB3 ))
(( segid " " and resid 40 and name HG3 ))
OR { 476}
(( segid " " and resid 42 and name HB3 ))
(( segid " " and resid 40 and name HG2 ))
ASSI { 482}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 66 and name HB3 ))
3.700 1.700 1.700 peak 482 spectrum 1 weight 0.10000E+01 volume 0.62705E-03 ppm1 1.371 ppm2 1.708 CV 1
OR { 482}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 61 and name HB ))
ASSI { 491}
(( segid " " and resid 65 and name HB3 ))
( segid " " and resid 65 and name HD1%)
2.900 1.100 1.100 peak 491 spectrum 1 weight 0.10000E+01 volume 0.21582E-02 ppm1 1.192 ppm2 0.566 CV 1
OR { 491}
(( segid " " and resid 65 and name HB3 ))
( segid " " and resid 17 and name HD1%)
ASSI { 499}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 65 and name HN ))
3.100 1.200 1.200 peak 499 spectrum 1 weight 0.10000E+01 volume 0.10017E-02 ppm1 1.373 ppm2 7.156 CV 1
OR { 499}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 64 and name HN ))
ASSI { 500}
(( segid " " and resid 65 and name HB3 ))
(( segid " " and resid 65 and name HN ))
4.200 2.200 1.800 peak 500 spectrum 1 weight 0.10000E+01 volume 0.59755E-03 ppm1 1.185 ppm2 7.159 CV 1
OR { 500}
(( segid " " and resid 65 and name HB3 ))
(( segid " " and resid 64 and name HN ))
ASSI { 540}
(( segid " " and resid 69 and name HB2 ))
(( segid " " and resid 66 and name HB3 ))
3.800 1.800 1.800 peak 540 spectrum 1 weight 0.10000E+01 volume 0.10650E-02 ppm1 2.290 ppm2 1.698 CV 1
OR { 540}
(( segid " " and resid 69 and name HB2 ))
(( segid " " and resid 16 and name HD2 ))
ASSI { 550}
(( segid " " and resid 78 and name HA ))
( segid " " and resid 85 and name HB% )
3.300 1.400 1.400 peak 550 spectrum 1 weight 0.10000E+01 volume 0.18720E-02 ppm1 4.255 ppm2 1.479 CV 1
OR { 550}
(( segid " " and resid 78 and name HA ))
(( segid " " and resid 77 and name HG2 ))
ASSI { 556}
(( segid " " and resid 70 and name HA ))
( segid " " and resid 17 and name HD1%)
4.200 2.200 1.800 peak 556 spectrum 1 weight 0.10000E+01 volume 0.42743E-03 ppm1 5.229 ppm2 0.543 CV 1
OR { 556}
(( segid " " and resid 70 and name HA ))
( segid " " and resid 29 and name HG1%)
ASSI { 565}
(( segid " " and resid 70 and name HB3 ))
(( segid " " and resid 70 and name HA ))
2.900 1.100 1.100 peak 565 spectrum 1 weight 0.10000E+01 volume 0.15902E-02 ppm1 2.082 ppm2 5.238 CV 1
OR { 565}
(( segid " " and resid 70 and name HB3 ))
(( segid " " and resid 16 and name HA ))
ASSI { 566}
(( segid " " and resid 70 and name HB2 ))
(( segid " " and resid 70 and name HA ))
2.900 1.000 1.000 peak 566 spectrum 1 weight 0.10000E+01 volume 0.16917E-02 ppm1 2.031 ppm2 5.238 CV 1
OR { 566}
(( segid " " and resid 70 and name HB2 ))
(( segid " " and resid 16 and name HA ))
ASSI { 570}
(( segid " " and resid 70 and name HB3 ))
(( segid " " and resid 16 and name HD3 ))
3.400 1.400 1.400 peak 570 spectrum 1 weight 0.10000E+01 volume 0.10352E-02 ppm1 2.100 ppm2 1.735 CV 1
OR { 570}
(( segid " " and resid 70 and name HB3 ))
(( segid " " and resid 16 and name HD2 ))
OR { 570}
(( segid " " and resid 70 and name HB3 ))
(( segid " " and resid 14 and name HD3 ))
ASSI { 572}
(( segid " " and resid 72 and name HB ))
(( segid " " and resid 71 and name HA ))
4.600 2.600 1.400 peak 572 spectrum 1 weight 0.10000E+01 volume 0.60428E-03 ppm1 1.920 ppm2 4.663 CV 1
OR { 572}
(( segid " " and resid 91 and name HB ))
(( segid " " and resid 90 and name HA ))
ASSI { 579}
(( segid " " and resid 73 and name HA ))
( segid " " and resid 88 and name HG2%)
4.200 2.200 1.800 peak 579 spectrum 1 weight 0.10000E+01 volume 0.50863E-03 ppm1 5.323 ppm2 1.122 CV 1
OR { 579}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 87 and name HB3 ))
ASSI { 581}
(( segid " " and resid 73 and name HA ))
( segid " " and resid 12 and name HD1%)
3.600 1.600 1.600 peak 581 spectrum 1 weight 0.10000E+01 volume 0.65638E-03 ppm1 5.336 ppm2 0.827 CV 1
OR { 581}
(( segid " " and resid 73 and name HA ))
( segid " " and resid 72 and name HG2%)
ASSI { 589}
(( segid " " and resid 73 and name HB ))
( segid " " and resid 88 and name HG2%)
3.700 1.700 1.700 peak 589 spectrum 1 weight 0.10000E+01 volume 0.12179E-02 ppm1 1.948 ppm2 1.128 CV 1
OR { 589}
(( segid " " and resid 47 and name HG2 ))
( segid " " and resid 45 and name HB% )
ASSI { 590}
(( segid " " and resid 73 and name HB ))
( segid " " and resid 89 and name HG2%)
3.900 1.900 1.900 peak 590 spectrum 1 weight 0.10000E+01 volume 0.81311E-03 ppm1 1.944 ppm2 0.953 CV 1
OR { 590}
(( segid " " and resid 47 and name HG2 ))
( segid " " and resid 93 and name HD1%)
ASSI { 595}
(( segid " " and resid 71 and name HB ))
(( segid " " and resid 70 and name HB2 ))
3.800 3.800 2.200 peak 595 spectrum 1 weight 0.10000E+01 volume 0.10461E-02 ppm1 1.421 ppm2 2.068 CV 1
OR { 595}
(( segid " " and resid 71 and name HB ))
(( segid " " and resid 69 and name HB3 ))
ASSI { 596}
(( segid " " and resid 71 and name HB ))
(( segid " " and resid 72 and name HG13))
4.800 2.900 1.200 peak 596 spectrum 1 weight 0.10000E+01 volume 0.43391E-03 ppm1 1.442 ppm2 1.659 CV 1
OR { 596}
(( segid " " and resid 71 and name HB ))
(( segid " " and resid 93 and name HB2 ))
OR { 596}
(( segid " " and resid 71 and name HB ))
(( segid " " and resid 93 and name HB3 ))
ASSI { 598}
(( segid " " and resid 71 and name HB ))
( segid " " and resid 73 and name HG1%)
3.200 1.300 1.300 peak 598 spectrum 1 weight 0.10000E+01 volume 0.15076E-02 ppm1 1.427 ppm2 0.547 CV 1
OR { 598}
(( segid " " and resid 71 and name HB ))
( segid " " and resid 17 and name HD1%)
ASSI { 602}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 28 and name HB2 ))
3.700 1.700 1.700 peak 602 spectrum 1 weight 0.10000E+01 volume 0.11502E-02 ppm1 2.002 ppm2 2.934 CV 1
OR { 602}
(( segid " " and resid 83 and name HB2 ))
(( segid " " and resid 83 and name HE2 ))
ASSI { 607}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 19 and name HB2 ))
1.500 0.300 0.700 peak 607 spectrum 1 weight 0.10000E+01 volume 0.27956E-01 ppm1 1.901 ppm2 1.979 CV 1
OR { 607}
(( segid " " and resid 83 and name HB3 ))
(( segid " " and resid 83 and name HB2 ))
ASSI { 616}
(( segid " " and resid 74 and name HB3 ))
(( segid " " and resid 74 and name HN ))
3.400 1.400 1.400 peak 616 spectrum 1 weight 0.10000E+01 volume 0.13521E-02 ppm1 1.940 ppm2 8.641 CV 1
OR { 616}
(( segid " " and resid 74 and name HB2 ))
(( segid " " and resid 75 and name HN ))
OR { 616}
(( segid " " and resid 74 and name HB2 ))
(( segid " " and resid 74 and name HN ))
OR { 616}
(( segid " " and resid 74 and name HB3 ))
(( segid " " and resid 75 and name HN ))
ASSI { 617}
(( segid " " and resid 83 and name HB2 ))
(( segid " " and resid 84 and name HN ))
4.000 2.000 2.000 peak 617 spectrum 1 weight 0.10000E+01 volume 0.46422E-03 ppm1 1.978 ppm2 8.427 CV 1
OR { 617}
(( segid " " and resid 74 and name HB3 ))
(( segid " " and resid 88 and name HN ))
ASSI { 625}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 75 and name HG13))
3.900 1.900 1.900 peak 625 spectrum 1 weight 0.10000E+01 volume 0.62671E-03 ppm1 3.946 ppm2 1.516 CV 1
OR { 625}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 87 and name HB2 ))
ASSI { 629}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 86 and name HA ))
4.100 2.100 1.900 peak 629 spectrum 1 weight 0.10000E+01 volume 0.66224E-03 ppm1 2.805 ppm2 4.961 CV 1
OR { 629}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 39 and name HA ))
ASSI { 663}
(( segid " " and resid 77 and name HB2 ))
(( segid " " and resid 78 and name HN ))
3.600 1.600 1.600 peak 663 spectrum 1 weight 0.10000E+01 volume 0.10364E-02 ppm1 1.826 ppm2 8.630 CV 1
OR { 663}
(( segid " " and resid 77 and name HB2 ))
(( segid " " and resid 86 and name HN ))
ASSI { 668}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 80 and name HB2 ))
4.400 2.400 1.600 peak 668 spectrum 1 weight 0.10000E+01 volume 0.49584E-03 ppm1 4.116 ppm2 1.918 CV 1
OR { 668}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 83 and name HB3 ))
ASSI { 683}
(( segid " " and resid 78 and name HB3 ))
(( segid " " and resid 78 and name HN ))
2.700 0.900 0.900 peak 683 spectrum 1 weight 0.10000E+01 volume 0.35118E-02 ppm1 2.009 ppm2 8.657 CV 1
OR { 683}
(( segid " " and resid 79 and name HB2 ))
(( segid " " and resid 79 and name HN ))
OR { 683}
(( segid " " and resid 78 and name HB3 ))
(( segid " " and resid 79 and name HN ))
ASSI { 704}
( segid " " and resid 85 and name HB% )
(( segid " " and resid 35 and name HA ))
3.400 1.400 1.400 peak 704 spectrum 1 weight 0.10000E+01 volume 0.10299E-02 ppm1 1.473 ppm2 4.537 CV 1
OR { 704}
( segid " " and resid 85 and name HB% )
(( segid " " and resid 77 and name HA ))
ASSI { 708}
( segid " " and resid 85 and name HB% )
(( segid " " and resid 84 and name HA2 ))
3.200 1.300 1.300 peak 708 spectrum 1 weight 0.10000E+01 volume 0.12109E-02 ppm1 1.473 ppm2 3.947 CV 1
OR { 708}
( segid " " and resid 85 and name HB% )
(( segid " " and resid 75 and name HA ))
ASSI { 709}
( segid " " and resid 86 and name HB% )
(( segid " " and resid 87 and name HA ))
4.100 2.100 1.900 peak 709 spectrum 1 weight 0.10000E+01 volume 0.46997E-03 ppm1 1.662 ppm2 5.161 CV 1
OR { 709}
( segid " " and resid 86 and name HB% )
(( segid " " and resid 37 and name HA1 ))
ASSI { 722}
( segid " " and resid 86 and name HB% )
(( segid " " and resid 87 and name HB3 ))
4.000 2.000 2.000 peak 722 spectrum 1 weight 0.10000E+01 volume 0.82249E-03 ppm1 1.665 ppm2 1.120 CV 1
OR { 722}
( segid " " and resid 86 and name HB% )
( segid " " and resid 88 and name HG2%)
ASSI { 727}
( segid " " and resid 85 and name HB% )
( segid " " and resid 87 and name HD1%)
3.900 1.900 1.900 peak 727 spectrum 1 weight 0.10000E+01 volume 0.71881E-03 ppm1 1.470 ppm2 0.555 CV 1
OR { 727}
( segid " " and resid 85 and name HB% )
( segid " " and resid 29 and name HG2%)
ASSI { 728}
( segid " " and resid 85 and name HB% )
(( segid " " and resid 79 and name HG2 ))
2.700 0.900 0.900 peak 728 spectrum 1 weight 0.10000E+01 volume 0.16328E-02 ppm1 1.472 ppm2 2.348 CV 1
OR { 728}
( segid " " and resid 85 and name HB% )
(( segid " " and resid 79 and name HG3 ))
OR { 728}
( segid " " and resid 85 and name HB% )
(( segid " " and resid 78 and name HG2 ))
ASSI { 730}
( segid " " and resid 85 and name HB% )
(( segid " " and resid 79 and name HB2 ))
2.800 1.000 1.000 peak 730 spectrum 1 weight 0.10000E+01 volume 0.11171E-02 ppm1 1.471 ppm2 2.019 CV 1
OR { 730}
( segid " " and resid 85 and name HB% )
(( segid " " and resid 78 and name HB3 ))
OR { 730}
( segid " " and resid 85 and name HB% )
(( segid " " and resid 34 and name HB3 ))
ASSI { 741}
( segid " " and resid 86 and name HB% )
(( segid " " and resid 85 and name HN ))
3.500 1.500 1.500 peak 741 spectrum 1 weight 0.10000E+01 volume 0.65200E-03 ppm1 1.670 ppm2 8.423 CV 1
OR { 741}
( segid " " and resid 86 and name HB% )
(( segid " " and resid 88 and name HN ))
ASSI { 745}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 79 and name HG2 ))
3.400 1.500 1.500 peak 745 spectrum 1 weight 0.10000E+01 volume 0.35524E-03 ppm1 4.283 ppm2 2.356 CV 1
OR { 745}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 78 and name HG2 ))
OR { 745}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 79 and name HG3 ))
OR { 745}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 78 and name HG3 ))
ASSI { 747}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 78 and name HB3 ))
3.200 1.300 1.300 peak 747 spectrum 1 weight 0.10000E+01 volume 0.56479E-03 ppm1 4.274 ppm2 2.013 CV 1
OR { 747}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 79 and name HB2 ))
ASSI { 776}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 39 and name HB3 ))
3.400 1.500 1.500 peak 776 spectrum 1 weight 0.10000E+01 volume 0.12909E-02 ppm1 1.503 ppm2 1.664 CV 1
OR { 776}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 29 and name HB ))
ASSI { 779}
(( segid " " and resid 87 and name HB2 ))
( segid " " and resid 87 and name HD1%)
2.900 1.000 1.000 peak 779 spectrum 1 weight 0.10000E+01 volume 0.17636E-02 ppm1 1.506 ppm2 0.571 CV 1
OR { 779}
(( segid " " and resid 87 and name HB2 ))
( segid " " and resid 73 and name HG1%)
OR { 779}
(( segid " " and resid 87 and name HB2 ))
( segid " " and resid 73 and name HG2%)
ASSI { 782}
(( segid " " and resid 87 and name HB3 ))
(( segid " " and resid 39 and name HB3 ))
3.700 1.800 1.800 peak 782 spectrum 1 weight 0.10000E+01 volume 0.10136E-02 ppm1 1.101 ppm2 1.665 CV 1
OR { 782}
(( segid " " and resid 87 and name HB3 ))
(( segid " " and resid 29 and name HB ))
ASSI { 784}
(( segid " " and resid 87 and name HB3 ))
( segid " " and resid 73 and name HG2%)
3.300 1.300 1.300 peak 784 spectrum 1 weight 0.10000E+01 volume 0.16112E-02 ppm1 1.095 ppm2 0.568 CV 1
OR { 784}
(( segid " " and resid 87 and name HB3 ))
( segid " " and resid 87 and name HD1%)
OR { 784}
(( segid " " and resid 87 and name HB3 ))
( segid " " and resid 73 and name HG1%)
ASSI { 793}
(( segid " " and resid 89 and name HA ))
( segid " " and resid 91 and name HG2%)
3.900 1.900 1.900 peak 793 spectrum 1 weight 0.10000E+01 volume 0.76719E-03 ppm1 5.175 ppm2 0.849 CV 1
OR { 793}
(( segid " " and resid 89 and name HA ))
( segid " " and resid 93 and name HD2%)
ASSI { 838}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 40 and name HB3 ))
1.900 0.500 0.500 peak 838 spectrum 1 weight 0.10000E+01 volume 0.78259E-02 ppm1 2.003 ppm2 2.570 CV 1
OR { 838}
(( segid " " and resid 4 and name HB3 ))
(( segid " " and resid 4 and name HG2 ))
ASSI { 856}
( segid " " and resid 94 and name HB% )
(( segid " " and resid 94 and name HA ))
2.000 0.500 0.500 peak 856 spectrum 1 weight 0.10000E+01 volume 0.19677E-01 ppm1 1.417 ppm2 4.371 CV 1
OR { 856}
( segid " " and resid 10 and name HB% )
(( segid " " and resid 10 and name HA ))
ASSI { 857}
( segid " " and resid 10 and name HB% )
( segid " " and resid 12 and name HD1%)
2.700 2.700 3.300 peak 857 spectrum 1 weight 0.10000E+01 volume 0.46114E-02 ppm1 1.414 ppm2 0.807 CV 1
OR { 857}
( segid " " and resid 10 and name HB% )
( segid " " and resid 12 and name HG2%)
OR { 857}
( segid " " and resid 10 and name HB% )
( segid " " and resid 75 and name HD1%)
ASSI { 863}
(( segid " " and resid 11 and name HB3 ))
( segid " " and resid 12 and name HD1%)
4.300 2.300 1.700 peak 863 spectrum 1 weight 0.10000E+01 volume 0.47253E-03 ppm1 2.850 ppm2 0.815 CV 1
OR { 863}
(( segid " " and resid 11 and name HB3 ))
( segid " " and resid 75 and name HD1%)
ASSI { 864}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 74 and name HB2 ))
3.900 1.900 1.900 peak 864 spectrum 1 weight 0.10000E+01 volume 0.56397E-03 ppm1 2.839 ppm2 1.943 CV 1
OR { 864}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 74 and name HB3 ))
OR { 864}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 75 and name HB ))
ASSI { 865}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 74 and name HB2 ))
3.900 1.900 1.900 peak 865 spectrum 1 weight 0.10000E+01 volume 0.46166E-03 ppm1 2.708 ppm2 1.934 CV 1
OR { 865}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 74 and name HB3 ))
OR { 865}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 75 and name HB ))
ASSI { 886}
(( segid " " and resid 19 and name HD2 ))
(( segid " " and resid 20 and name HA ))
4.100 2.100 1.900 peak 886 spectrum 1 weight 0.10000E+01 volume 0.44266E-03 ppm1 3.242 ppm2 4.265 CV 1
OR { 886}
(( segid " " and resid 80 and name HD2 ))
(( segid " " and resid 85 and name HA ))
OR { 886}
(( segid " " and resid 80 and name HD3 ))
(( segid " " and resid 85 and name HA ))
OR { 886}
(( segid " " and resid 19 and name HD2 ))
(( segid " " and resid 17 and name HA ))
ASSI { 888}
(( segid " " and resid 80 and name HD3 ))
(( segid " " and resid 83 and name HA ))
4.300 2.300 1.700 peak 888 spectrum 1 weight 0.10000E+01 volume 0.40936E-03 ppm1 3.225 ppm2 4.448 CV 1
OR { 888}
(( segid " " and resid 80 and name HD2 ))
(( segid " " and resid 83 and name HA ))
OR { 888}
(( segid " " and resid 66 and name HD2 ))
(( segid " " and resid 68 and name HA1 ))
OR { 888}
(( segid " " and resid 66 and name HD3 ))
(( segid " " and resid 68 and name HA1 ))
ASSI { 889}
(( segid " " and resid 66 and name HD3 ))
(( segid " " and resid 66 and name HA ))
3.300 1.400 1.400 peak 889 spectrum 1 weight 0.10000E+01 volume 0.24450E-02 ppm1 3.228 ppm2 4.564 CV 1
OR { 889}
(( segid " " and resid 80 and name HD2 ))
(( segid " " and resid 80 and name HA ))
OR { 889}
(( segid " " and resid 80 and name HD3 ))
(( segid " " and resid 80 and name HA ))
OR { 889}
(( segid " " and resid 66 and name HD2 ))
(( segid " " and resid 66 and name HA ))
ASSI { 898}
(( segid " " and resid 80 and name HD2 ))
(( segid " " and resid 80 and name HB3 ))
2.600 0.800 0.800 peak 898 spectrum 1 weight 0.10000E+01 volume 0.64645E-02 ppm1 3.230 ppm2 1.828 CV 1
OR { 898}
(( segid " " and resid 80 and name HD3 ))
(( segid " " and resid 80 and name HB3 ))
OR { 898}
(( segid " " and resid 66 and name HD3 ))
(( segid " " and resid 66 and name HB2 ))
OR { 898}
(( segid " " and resid 66 and name HD2 ))
(( segid " " and resid 66 and name HB2 ))
ASSI { 900}
(( segid " " and resid 80 and name HD2 ))
(( segid " " and resid 78 and name HB2 ))
3.500 3.500 2.500 peak 900 spectrum 1 weight 0.10000E+01 volume 0.41378E-03 ppm1 3.239 ppm2 2.130 CV 1
OR { 900}
(( segid " " and resid 80 and name HD3 ))
(( segid " " and resid 78 and name HB2 ))
OR { 900}
(( segid " " and resid 66 and name HD3 ))
(( segid " " and resid 70 and name HG3 ))
OR { 900}
(( segid " " and resid 19 and name HD2 ))
(( segid " " and resid 30 and name HB2 ))
ASSI { 901}
(( segid " " and resid 19 and name HD2 ))
(( segid " " and resid 21 and name HG3 ))
3.800 1.800 1.800 peak 901 spectrum 1 weight 0.10000E+01 volume 0.94246E-03 ppm1 3.242 ppm2 2.327 CV 1
OR { 901}
(( segid " " and resid 80 and name HD2 ))
(( segid " " and resid 79 and name HG2 ))
OR { 901}
(( segid " " and resid 80 and name HD2 ))
(( segid " " and resid 79 and name HG3 ))
OR { 901}
(( segid " " and resid 80 and name HD3 ))
(( segid " " and resid 79 and name HG2 ))
OR { 901}
(( segid " " and resid 19 and name HD2 ))
(( segid " " and resid 21 and name HG2 ))
ASSI { 906}
( segid " " and resid 73 and name HG2%)
( segid " " and resid 72 and name HG2%)
2.500 2.500 3.500 peak 906 spectrum 1 weight 0.10000E+01 volume 0.64335E-02 ppm1 0.594 ppm2 0.845 CV 1
OR { 906}
( segid " " and resid 73 and name HG2%)
( segid " " and resid 75 and name HG2%)
OR { 906}
( segid " " and resid 73 and name HG2%)
( segid " " and resid 93 and name HD2%)
OR { 906}
( segid " " and resid 73 and name HG2%)
( segid " " and resid 91 and name HG2%)
ASSI { 909}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 31 and name HB3 ))
3.300 3.300 2.700 peak 909 spectrum 1 weight 0.10000E+01 volume 0.13711E-02 ppm1 0.587 ppm2 2.167 CV 1
OR { 909}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 74 and name HG2 ))
ASSI { 910}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 70 and name HB2 ))
2.700 2.700 3.300 peak 910 spectrum 1 weight 0.10000E+01 volume 0.14141E-02 ppm1 0.599 ppm2 2.058 CV 1
OR { 910}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 69 and name HB3 ))
ASSI { 912}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 29 and name HB ))
4.500 2.500 1.500 peak 912 spectrum 1 weight 0.10000E+01 volume 0.27730E-03 ppm1 0.579 ppm2 1.673 CV 1
OR { 912}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 39 and name HB3 ))
ASSI { 915}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 15 and name HA2 ))
2.700 2.700 3.300 peak 915 spectrum 1 weight 0.10000E+01 volume 0.14607E-02 ppm1 0.586 ppm2 3.132 CV 1
OR { 915}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 31 and name HB2 ))
ASSI { 923}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 74 and name HA ))
3.900 1.900 1.900 peak 923 spectrum 1 weight 0.10000E+01 volume 0.74529E-03 ppm1 0.585 ppm2 5.137 CV 1
OR { 923}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 87 and name HA ))
ASSI { 926}
( segid " " and resid 87 and name HD2%)
( segid " " and resid 87 and name HD1%)
2.300 0.700 0.700 peak 926 spectrum 1 weight 0.10000E+01 volume 0.80983E-02 ppm1 0.182 ppm2 0.566 CV 1
OR { 926}
( segid " " and resid 87 and name HD2%)
( segid " " and resid 73 and name HG2%)
OR { 926}
( segid " " and resid 87 and name HD2%)
( segid " " and resid 29 and name HG2%)
ASSI { 933}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 37 and name HA1 ))
3.100 1.200 1.200 peak 933 spectrum 1 weight 0.10000E+01 volume 0.34121E-02 ppm1 0.183 ppm2 5.160 CV 1
OR { 933}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 87 and name HA ))
ASSI { 934}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 86 and name HA ))
3.200 1.300 1.300 peak 934 spectrum 1 weight 0.10000E+01 volume 0.53476E-03 ppm1 0.184 ppm2 4.974 CV 1
OR { 934}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 39 and name HA ))
ASSI { 935}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 38 and name HA ))
3.400 1.400 1.400 peak 935 spectrum 1 weight 0.10000E+01 volume 0.40028E-03 ppm1 0.179 ppm2 4.637 CV 1
OR { 935}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 29 and name HA ))
ASSI { 937}
(( segid " " and resid 19 and name HD2 ))
(( segid " " and resid 19 and name HB3 ))
2.300 0.600 0.600 peak 937 spectrum 1 weight 0.10000E+01 volume 0.58849E-02 ppm1 3.260 ppm2 1.885 CV 1
OR { 937}
(( segid " " and resid 80 and name HD2 ))
(( segid " " and resid 80 and name HB2 ))
OR { 937}
(( segid " " and resid 80 and name HD3 ))
(( segid " " and resid 80 and name HB2 ))
ASSI { 938}
(( segid " " and resid 93 and name HB2 ))
( segid " " and resid 73 and name HG1%)
3.000 3.000 3.000 peak 938 spectrum 1 weight 0.10000E+01 volume 0.78601E-03 ppm1 1.664 ppm2 0.573 CV 1
OR { 938}
(( segid " " and resid 93 and name HB3 ))
( segid " " and resid 73 and name HG1%)
OR { 938}
(( segid " " and resid 93 and name HB2 ))
( segid " " and resid 73 and name HG2%)
OR { 938}
(( segid " " and resid 93 and name HB2 ))
( segid " " and resid 44 and name HD1%)
OR { 938}
(( segid " " and resid 93 and name HB3 ))
( segid " " and resid 44 and name HD1%)
OR { 938}
(( segid " " and resid 93 and name HB2 ))
( segid " " and resid 65 and name HD1%)
OR { 938}
(( segid " " and resid 93 and name HB3 ))
( segid " " and resid 73 and name HG2%)
OR { 938}
(( segid " " and resid 93 and name HB3 ))
( segid " " and resid 65 and name HD1%)
ASSI { 940}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 75 and name HN ))
2.900 1.000 1.000 peak 940 spectrum 1 weight 0.10000E+01 volume 0.98469E-03 ppm1 0.184 ppm2 8.638 CV 1
OR { 940}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 74 and name HN ))
OR { 940}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 86 and name HN ))
ASSI { 950}
(( segid " " and resid 14 and name HB3 ))
( segid " " and resid 72 and name HD1%)
3.800 1.800 1.800 peak 950 spectrum 1 weight 0.10000E+01 volume 0.13025E-02 ppm1 1.728 ppm2 0.895 CV 1
OR { 950}
(( segid " " and resid 59 and name HB3 ))
( segid " " and resid 41 and name HD2%)
ASSI { 957}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 64 and name HB ))
2.800 2.800 3.200 peak 957 spectrum 1 weight 0.10000E+01 volume 0.12037E-01 ppm1 1.742 ppm2 1.641 CV 1
OR { 957}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 41 and name HG ))
ASSI { 958}
(( segid " " and resid 59 and name HB3 ))
( segid " " and resid 55 and name HB% )
3.800 1.800 1.800 peak 958 spectrum 1 weight 0.10000E+01 volume 0.50152E-03 ppm1 1.733 ppm2 1.283 CV 1
OR { 958}
(( segid " " and resid 14 and name HB3 ))
(( segid " " and resid 72 and name HG12))
OR { 958}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 61 and name HG12))
ASSI { 979}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 17 and name HB ))
4.400 2.400 1.600 peak 979 spectrum 1 weight 0.10000E+01 volume 0.81811E-03 ppm1 5.255 ppm2 2.404 CV 1
OR { 979}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 70 and name HG2 ))
ASSI { 985}
(( segid " " and resid 16 and name HA ))
( segid " " and resid 29 and name HG1%)
3.600 1.600 1.600 peak 985 spectrum 1 weight 0.10000E+01 volume 0.78855E-03 ppm1 5.258 ppm2 0.568 CV 1
OR { 985}
(( segid " " and resid 16 and name HA ))
( segid " " and resid 29 and name HG2%)
OR { 985}
(( segid " " and resid 16 and name HA ))
( segid " " and resid 65 and name HD1%)
ASSI { 990}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 30 and name HB2 ))
3.800 1.800 1.800 peak 990 spectrum 1 weight 0.10000E+01 volume 0.13976E-02 ppm1 1.669 ppm2 2.124 CV 1
OR { 990}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 70 and name HB3 ))
OR { 990}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 70 and name HB3 ))
OR { 990}
(( segid " " and resid 29 and name HB ))
(( segid " " and resid 30 and name HB2 ))
ASSI { 994}
(( segid " " and resid 29 and name HB ))
( segid " " and resid 27 and name HB% )
4.200 2.200 1.800 peak 994 spectrum 1 weight 0.10000E+01 volume 0.39938E-03 ppm1 1.665 ppm2 1.178 CV 1
OR { 994}
(( segid " " and resid 29 and name HB ))
(( segid " " and resid 39 and name HG ))
OR { 994}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 65 and name HB3 ))
OR { 994}
(( segid " " and resid 16 and name HB3 ))
( segid " " and resid 27 and name HB% )
OR { 994}
(( segid " " and resid 16 and name HB2 ))
( segid " " and resid 27 and name HB% )
ASSI { 995}
(( segid " " and resid 29 and name HB ))
( segid " " and resid 75 and name HD1%)
3.900 1.900 1.900 peak 995 spectrum 1 weight 0.10000E+01 volume 0.10147E-02 ppm1 1.683 ppm2 0.771 CV 1
OR { 995}
(( segid " " and resid 16 and name HB3 ))
( segid " " and resid 17 and name HG2%)
OR { 995}
(( segid " " and resid 16 and name HB2 ))
( segid " " and resid 17 and name HG2%)
ASSI { 999}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 16 and name HA ))
2.500 0.800 0.800 peak 999 spectrum 1 weight 0.10000E+01 volume 0.40581E-02 ppm1 1.660 ppm2 5.254 CV 1
OR { 999}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HA ))
OR { 999}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 70 and name HA ))
ASSI { 1005}
(( segid " " and resid 17 and name HA ))
( segid " " and resid 17 and name HD1%)
2.700 0.900 0.900 peak 1005 spectrum 1 weight 0.10000E+01 volume 0.31944E-02 ppm1 4.291 ppm2 0.559 CV 1
OR { 1005}
(( segid " " and resid 17 and name HA ))
( segid " " and resid 29 and name HG2%)
ASSI { 1028}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 21 and name HB3 ))
3.700 1.700 1.700 peak 1028 spectrum 1 weight 0.10000E+01 volume 0.12215E-02 ppm1 4.267 ppm2 1.859 CV 1
OR { 1028}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 19 and name HB3 ))
ASSI { 1033}
(( segid " " and resid 20 and name HA ))
( segid " " and resid 61 and name HD1%)
3.600 1.600 1.600 peak 1033 spectrum 1 weight 0.10000E+01 volume 0.11650E-02 ppm1 4.274 ppm2 0.588 CV 1
OR { 1033}
(( segid " " and resid 20 and name HA ))
( segid " " and resid 26 and name HB% )
ASSI { 1038}
(( segid " " and resid 20 and name HB ))
( segid " " and resid 61 and name HD1%)
4.200 2.200 1.800 peak 1038 spectrum 1 weight 0.10000E+01 volume 0.10511E-02 ppm1 1.816 ppm2 0.568 CV 1
OR { 1038}
(( segid " " and resid 20 and name HB ))
( segid " " and resid 65 and name HD1%)
ASSI { 1039}
(( segid " " and resid 20 and name HB ))
(( segid " " and resid 61 and name HB ))
3.900 3.900 2.100 peak 1039 spectrum 1 weight 0.10000E+01 volume 0.13361E-02 ppm1 1.816 ppm2 1.701 CV 1
OR { 1039}
(( segid " " and resid 20 and name HB ))
(( segid " " and resid 66 and name HB3 ))
ASSI { 1042}
(( segid " " and resid 93 and name HB2 ))
( segid " " and resid 93 and name HD1%)
2.300 0.700 0.700 peak 1042 spectrum 1 weight 0.10000E+01 volume 0.89086E-02 ppm1 1.648 ppm2 0.949 CV 1
OR { 1042}
(( segid " " and resid 5 and name HB2 ))
( segid " " and resid 5 and name HD1%)
OR { 1042}
(( segid " " and resid 5 and name HB3 ))
( segid " " and resid 5 and name HD1%)
ASSI { 1045}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 19 and name HG2 ))
4.100 2.100 1.900 peak 1045 spectrum 1 weight 0.10000E+01 volume 0.41654E-03 ppm1 5.346 ppm2 1.693 CV 1
OR { 1045}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 24 and name HB2 ))
ASSI { 1046}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HG3 ))
3.000 1.100 1.100 peak 1046 spectrum 1 weight 0.10000E+01 volume 0.19690E-02 ppm1 5.341 ppm2 2.349 CV 1
OR { 1046}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HG2 ))
OR { 1046}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 22 and name HG2 ))
ASSI { 1048}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HB3 ))
3.100 1.200 1.200 peak 1048 spectrum 1 weight 0.10000E+01 volume 0.19482E-02 ppm1 5.341 ppm2 1.880 CV 1
OR { 1048}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 22 and name HG3 ))
ASSI { 1049}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 24 and name HG ))
4.600 2.600 1.400 peak 1049 spectrum 1 weight 0.10000E+01 volume 0.46118E-03 ppm1 5.342 ppm2 1.733 CV 1
OR { 1049}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 62 and name HD2 ))
ASSI { 1052}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 24 and name HN ))
4.200 2.300 1.800 peak 1052 spectrum 1 weight 0.10000E+01 volume 0.10559E-02 ppm1 2.201 ppm2 7.324 CV 1
OR { 1052}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 26 and name HN ))
ASSI { 1054}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 24 and name HN ))
3.300 1.400 1.400 peak 1054 spectrum 1 weight 0.10000E+01 volume 0.13852E-02 ppm1 1.871 ppm2 7.334 CV 1
OR { 1054}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 26 and name HN ))
ASSI { 1070}
(( segid " " and resid 93 and name HB2 ))
(( segid " " and resid 92 and name HB3 ))
3.300 1.400 1.400 peak 1070 spectrum 1 weight 0.10000E+01 volume 0.51073E-03 ppm1 1.643 ppm2 3.908 CV 1
OR { 1070}
(( segid " " and resid 93 and name HB2 ))
(( segid " " and resid 92 and name HB2 ))
OR { 1070}
(( segid " " and resid 93 and name HB3 ))
(( segid " " and resid 92 and name HB3 ))
OR { 1070}
(( segid " " and resid 93 and name HB3 ))
(( segid " " and resid 92 and name HB2 ))
OR { 1070}
(( segid " " and resid 93 and name HB3 ))
(( segid " " and resid 96 and name HB2 ))
ASSI { 1076}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 8 and name HN ))
3.400 3.400 2.600 peak 1076 spectrum 1 weight 0.10000E+01 volume 0.12138E-02 ppm1 1.660 ppm2 8.324 CV 1
OR { 1076}
(( segid " " and resid 5 and name HB3 ))
(( segid " " and resid 8 and name HN ))
OR { 1076}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 9 and name HN ))
OR { 1076}
(( segid " " and resid 5 and name HB3 ))
(( segid " " and resid 9 and name HN ))
ASSI { 1077}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 21 and name HG2 ))
4.700 2.800 1.300 peak 1077 spectrum 1 weight 0.10000E+01 volume 0.41045E-03 ppm1 1.863 ppm2 2.343 CV 1
OR { 1077}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 25 and name HG2 ))
OR { 1077}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 25 and name HG3 ))
OR { 1077}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 21 and name HG3 ))
ASSI { 1102}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 21 and name HG2 ))
3.400 1.500 1.500 peak 1102 spectrum 1 weight 0.10000E+01 volume 0.25342E-02 ppm1 1.109 ppm2 2.349 CV 1
OR { 1102}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 21 and name HG3 ))
OR { 1102}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 25 and name HB2 ))
ASSI { 1103}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 21 and name HB3 ))
2.600 0.900 0.900 peak 1103 spectrum 1 weight 0.10000E+01 volume 0.42674E-02 ppm1 1.111 ppm2 1.863 CV 1
OR { 1103}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 24 and name HB3 ))
ASSI { 1131}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 22 and name HB3 ))
1.800 0.400 0.400 peak 1131 spectrum 1 weight 0.10000E+01 volume 0.14161E-01 ppm1 2.547 ppm2 2.197 CV 1
OR { 1131}
(( segid " " and resid 50 and name HB3 ))
(( segid " " and resid 50 and name HG3 ))
OR { 1131}
(( segid " " and resid 50 and name HB3 ))
(( segid " " and resid 50 and name HG2 ))
ASSI { 1144}
(( segid " " and resid 22 and name HB3 ))
( segid " " and resid 61 and name HG2%)
3.800 1.800 1.800 peak 1144 spectrum 1 weight 0.10000E+01 volume 0.83693E-03 ppm1 2.201 ppm2 0.897 CV 1
OR { 1144}
(( segid " " and resid 59 and name HB2 ))
( segid " " and resid 41 and name HD2%)
ASSI { 1149}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 42 and name HA ))
4.100 2.100 1.900 peak 1149 spectrum 1 weight 0.10000E+01 volume 0.56902E-03 ppm1 2.196 ppm2 4.339 CV 1
OR { 1149}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 48 and name HA ))
ASSI { 1152}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 22 and name HD2 ))
3.800 1.800 1.800 peak 1152 spectrum 1 weight 0.10000E+01 volume 0.13510E-02 ppm1 2.202 ppm2 3.880 CV 1
OR { 1152}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 59 and name HD2 ))
ASSI { 1170}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HB3 ))
1.800 0.400 0.400 peak 1170 spectrum 1 weight 0.10000E+01 volume 0.15074E-01 ppm1 2.330 ppm2 2.215 CV 1
OR { 1170}
(( segid " " and resid 22 and name HG2 ))
(( segid " " and resid 22 and name HB3 ))
ASSI { 1171}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 42 and name HB2 ))
3.200 3.200 2.800 peak 1171 spectrum 1 weight 0.10000E+01 volume 0.35813E-02 ppm1 2.331 ppm2 2.087 CV 1
OR { 1171}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 44 and name HB ))
ASSI { 1174}
(( segid " " and resid 22 and name HG2 ))
(( segid " " and resid 62 and name HD2 ))
4.100 2.100 1.900 peak 1174 spectrum 1 weight 0.10000E+01 volume 0.87799E-03 ppm1 2.339 ppm2 1.760 CV 1
OR { 1174}
(( segid " " and resid 22 and name HG2 ))
(( segid " " and resid 62 and name HD3 ))
OR { 1174}
(( segid " " and resid 22 and name HG2 ))
(( segid " " and resid 24 and name HG ))
ASSI { 1176}
(( segid " " and resid 22 and name HG2 ))
( segid " " and resid 20 and name HG2%)
4.500 2.500 1.500 peak 1176 spectrum 1 weight 0.10000E+01 volume 0.56707E-03 ppm1 2.343 ppm2 0.713 CV 1
OR { 1176}
(( segid " " and resid 25 and name HB2 ))
( segid " " and resid 20 and name HG2%)
ASSI { 1197}
( segid " " and resid 26 and name HB% )
(( segid " " and resid 40 and name HG2 ))
3.800 1.800 1.800 peak 1197 spectrum 1 weight 0.10000E+01 volume 0.10611E-02 ppm1 0.571 ppm2 2.198 CV 1
OR { 1197}
( segid " " and resid 26 and name HB% )
(( segid " " and resid 25 and name HB3 ))
OR { 1197}
( segid " " and resid 26 and name HB% )
(( segid " " and resid 40 and name HG3 ))
ASSI { 1198}
( segid " " and resid 26 and name HB% )
(( segid " " and resid 41 and name HB3 ))
4.500 2.500 1.500 peak 1198 spectrum 1 weight 0.10000E+01 volume 0.64983E-03 ppm1 0.573 ppm2 1.994 CV 1
OR { 1198}
( segid " " and resid 26 and name HB% )
(( segid " " and resid 40 and name HB2 ))
ASSI { 1205}
( segid " " and resid 26 and name HB% )
(( segid " " and resid 27 and name HA ))
4.000 2.000 2.000 peak 1205 spectrum 1 weight 0.10000E+01 volume 0.51924E-03 ppm1 0.571 ppm2 4.991 CV 1
OR { 1205}
( segid " " and resid 26 and name HB% )
(( segid " " and resid 39 and name HA ))
ASSI { 1208}
( segid " " and resid 26 and name HB% )
(( segid " " and resid 20 and name HA ))
4.400 2.400 1.600 peak 1208 spectrum 1 weight 0.10000E+01 volume 0.59081E-03 ppm1 0.568 ppm2 4.300 CV 1
OR { 1208}
( segid " " and resid 26 and name HB% )
(( segid " " and resid 42 and name HA ))
ASSI { 1214}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name HB2 ))
3.100 1.200 1.200 peak 1214 spectrum 1 weight 0.10000E+01 volume 0.23405E-02 ppm1 4.427 ppm2 2.006 CV 1
OR { 1214}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 41 and name HB3 ))
ASSI { 1215}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 25 and name HB3 ))
4.500 2.500 1.500 peak 1215 spectrum 1 weight 0.10000E+01 volume 0.50007E-03 ppm1 1.383 ppm2 2.211 CV 1
OR { 1215}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 59 and name HB2 ))
ASSI { 1221}
(( segid " " and resid 41 and name HB2 ))
( segid " " and resid 41 and name HD2%)
3.000 1.100 1.100 peak 1221 spectrum 1 weight 0.10000E+01 volume 0.18491E-02 ppm1 1.384 ppm2 0.907 CV 1
OR { 1221}
(( segid " " and resid 41 and name HB2 ))
( segid " " and resid 61 and name HG2%)
ASSI { 1224}
(( segid " " and resid 41 and name HB2 ))
( segid " " and resid 61 and name HD1%)
3.000 1.100 1.100 peak 1224 spectrum 1 weight 0.10000E+01 volume 0.10582E-02 ppm1 1.381 ppm2 0.581 CV 1
OR { 1224}
(( segid " " and resid 41 and name HB2 ))
( segid " " and resid 44 and name HD1%)
ASSI { 1225}
(( segid " " and resid 65 and name HG ))
( segid " " and resid 65 and name HD1%)
2.100 0.500 0.500 peak 1225 spectrum 1 weight 0.10000E+01 volume 0.10585E-01 ppm1 1.392 ppm2 0.561 CV 1
OR { 1225}
(( segid " " and resid 65 and name HG ))
( segid " " and resid 44 and name HD1%)
ASSI { 1228}
( segid " " and resid 27 and name HB% )
(( segid " " and resid 20 and name HA ))
3.100 1.200 1.200 peak 1228 spectrum 1 weight 0.10000E+01 volume 0.19393E-02 ppm1 1.155 ppm2 4.272 CV 1
OR { 1228}
( segid " " and resid 27 and name HB% )
(( segid " " and resid 17 and name HA ))
ASSI { 1231}
( segid " " and resid 27 and name HB% )
(( segid " " and resid 21 and name HN ))
4.100 2.100 1.900 peak 1231 spectrum 1 weight 0.10000E+01 volume 0.92905E-03 ppm1 1.159 ppm2 8.844 CV 1
OR { 1231}
( segid " " and resid 27 and name HB% )
(( segid " " and resid 17 and name HN ))
ASSI { 1234}
( segid " " and resid 27 and name HB% )
(( segid " " and resid 61 and name HB ))
3.600 1.600 1.600 peak 1234 spectrum 1 weight 0.10000E+01 volume 0.16579E-02 ppm1 1.151 ppm2 1.692 CV 1
OR { 1234}
( segid " " and resid 27 and name HB% )
(( segid " " and resid 39 and name HB3 ))
OR { 1234}
( segid " " and resid 27 and name HB% )
(( segid " " and resid 19 and name HG2 ))
ASSI { 1237}
( segid " " and resid 27 and name HB% )
( segid " " and resid 39 and name HD2%)
3.100 1.200 1.200 peak 1237 spectrum 1 weight 0.10000E+01 volume 0.21056E-02 ppm1 1.148 ppm2 0.329 CV 1
OR { 1237}
( segid " " and resid 27 and name HB% )
( segid " " and resid 71 and name HG1%)
ASSI { 1243}
( segid " " and resid 27 and name HB% )
( segid " " and resid 61 and name HD1%)
2.100 0.500 0.500 peak 1243 spectrum 1 weight 0.10000E+01 volume 0.10982E-01 ppm1 1.149 ppm2 0.565 CV 1
OR { 1243}
( segid " " and resid 27 and name HB% )
( segid " " and resid 65 and name HD1%)
ASSI { 1246}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 29 and name HB ))
4.200 2.300 1.800 peak 1246 spectrum 1 weight 0.10000E+01 volume 0.60674E-03 ppm1 5.613 ppm2 1.682 CV 1
OR { 1246}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 19 and name HG2 ))
ASSI { 1247}
(( segid " " and resid 28 and name HA ))
( segid " " and resid 29 and name HG2%)
3.300 1.300 1.300 peak 1247 spectrum 1 weight 0.10000E+01 volume 0.16481E-02 ppm1 5.609 ppm2 0.574 CV 1
OR { 1247}
(( segid " " and resid 28 and name HA ))
( segid " " and resid 87 and name HD1%)
OR { 1247}
(( segid " " and resid 28 and name HA ))
( segid " " and resid 29 and name HG1%)
ASSI { 1250}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 46 and name HD2 ))
4.100 2.100 1.900 peak 1250 spectrum 1 weight 0.10000E+01 volume 0.46755E-03 ppm1 2.815 ppm2 2.988 CV 1
OR { 1250}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 46 and name HD3 ))
OR { 1250}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 60 and name HB3 ))
ASSI { 1255}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 53 and name HB2 ))
3.900 1.900 1.900 peak 1255 spectrum 1 weight 0.10000E+01 volume 0.93288E-03 ppm1 2.819 ppm2 3.061 CV 1
OR { 1255}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 48 and name HB3 ))
ASSI { 1265}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 67 and name HB3 ))
3.400 3.400 2.600 peak 1265 spectrum 1 weight 0.10000E+01 volume 0.40475E-03 ppm1 2.135 ppm2 2.008 CV 1
OR { 1265}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 19 and name HB2 ))
ASSI { 1266}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 16 and name HB2 ))
3.800 1.800 1.800 peak 1266 spectrum 1 weight 0.10000E+01 volume 0.48362E-03 ppm1 2.134 ppm2 1.673 CV 1
OR { 1266}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 29 and name HB ))
ASSI { 1270}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 16 and name HB2 ))
3.200 1.200 1.200 peak 1270 spectrum 1 weight 0.10000E+01 volume 0.93904E-03 ppm1 2.771 ppm2 1.664 CV 1
OR { 1270}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 29 and name HB ))
ASSI { 1275}
(( segid " " and resid 70 and name HG3 ))
(( segid " " and resid 70 and name HA ))
3.300 1.300 1.300 peak 1275 spectrum 1 weight 0.10000E+01 volume 0.25930E-02 ppm1 2.153 ppm2 5.255 CV 1
OR { 1275}
(( segid " " and resid 70 and name HG3 ))
(( segid " " and resid 16 and name HA ))
ASSI { 1287}
(( segid " " and resid 44 and name HB ))
(( segid " " and resid 41 and name HB2 ))
3.900 1.900 1.900 peak 1287 spectrum 1 weight 0.10000E+01 volume 0.10878E-02 ppm1 2.139 ppm2 1.378 CV 1
OR { 1287}
(( segid " " and resid 70 and name HG3 ))
(( segid " " and resid 16 and name HG2 ))
OR { 1287}
(( segid " " and resid 44 and name HB ))
(( segid " " and resid 65 and name HG ))
ASSI { 1290}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 75 and name HG12))
4.200 2.200 1.800 peak 1290 spectrum 1 weight 0.10000E+01 volume 0.52895E-03 ppm1 5.154 ppm2 0.979 CV 1
OR { 1290}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 75 and name HG12))
ASSI { 1291}
(( segid " " and resid 65 and name HA ))
( segid " " and resid 44 and name HG2%)
4.500 2.600 1.500 peak 1291 spectrum 1 weight 0.10000E+01 volume 0.44544E-03 ppm1 5.134 ppm2 0.835 CV 1
OR { 1291}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 20 and name HG13))
ASSI { 1294}
(( segid " " and resid 69 and name HB3 ))
(( segid " " and resid 69 and name HN ))
2.900 1.000 1.000 peak 1294 spectrum 1 weight 0.10000E+01 volume 0.20077E-02 ppm1 2.052 ppm2 7.700 CV 1
OR { 1294}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 35 and name HN ))
OR { 1294}
(( segid " " and resid 34 and name HB3 ))
(( segid " " and resid 35 and name HN ))
ASSI { 1296}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 8 and name HN ))
3.600 1.600 1.600 peak 1296 spectrum 1 weight 0.10000E+01 volume 0.91570E-03 ppm1 2.034 ppm2 8.360 CV 1
OR { 1296}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 7 and name HN ))
ASSI { 1319}
(( segid " " and resid 37 and name HA2 ))
(( segid " " and resid 84 and name HA2 ))
3.800 3.800 2.200 peak 1319 spectrum 1 weight 0.10000E+01 volume 0.96382E-03 ppm1 3.628 ppm2 3.933 CV 1
OR { 1319}
(( segid " " and resid 37 and name HA2 ))
(( segid " " and resid 75 and name HA ))
ASSI { 1320}
(( segid " " and resid 37 and name HA2 ))
( segid " " and resid 85 and name HB% )
3.700 1.700 1.700 peak 1320 spectrum 1 weight 0.10000E+01 volume 0.83625E-03 ppm1 3.619 ppm2 1.490 CV 1
OR { 1320}
(( segid " " and resid 37 and name HA2 ))
(( segid " " and resid 87 and name HG ))
ASSI { 1321}
(( segid " " and resid 37 and name HA2 ))
( segid " " and resid 87 and name HD1%)
3.200 1.300 1.300 peak 1321 spectrum 1 weight 0.10000E+01 volume 0.14067E-02 ppm1 3.619 ppm2 0.554 CV 1
OR { 1321}
(( segid " " and resid 37 and name HA2 ))
( segid " " and resid 29 and name HG2%)
ASSI { 1322}
(( segid " " and resid 37 and name HA1 ))
(( segid " " and resid 87 and name HG ))
3.300 1.300 1.300 peak 1322 spectrum 1 weight 0.10000E+01 volume 0.96559E-03 ppm1 5.144 ppm2 1.498 CV 1
OR { 1322}
(( segid " " and resid 37 and name HA1 ))
( segid " " and resid 85 and name HB% )
ASSI { 1323}
(( segid " " and resid 37 and name HA1 ))
( segid " " and resid 87 and name HD1%)
3.800 1.800 1.800 peak 1323 spectrum 1 weight 0.10000E+01 volume 0.11798E-02 ppm1 5.141 ppm2 0.553 CV 1
OR { 1323}
(( segid " " and resid 37 and name HA1 ))
( segid " " and resid 29 and name HG2%)
ASSI { 1326}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HD2 ))
3.600 1.600 1.600 peak 1326 spectrum 1 weight 0.10000E+01 volume 0.97141E-03 ppm1 4.537 ppm2 3.098 CV 1
OR { 1326}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 36 and name HB2 ))
ASSI { 1343}
( segid " " and resid 39 and name HD2%)
(( segid " " and resid 42 and name HG3 ))
3.900 1.900 1.900 peak 1343 spectrum 1 weight 0.10000E+01 volume 0.90256E-03 ppm1 0.315 ppm2 1.544 CV 1
OR { 1343}
( segid " " and resid 39 and name HD2%)
(( segid " " and resid 87 and name HG ))
OR { 1343}
( segid " " and resid 39 and name HD2%)
(( segid " " and resid 42 and name HG2 ))
ASSI { 1344}
( segid " " and resid 39 and name HD2%)
(( segid " " and resid 71 and name HB ))
3.800 1.800 1.800 peak 1344 spectrum 1 weight 0.10000E+01 volume 0.70628E-03 ppm1 0.317 ppm2 1.438 CV 1
OR { 1344}
( segid " " and resid 39 and name HD2%)
(( segid " " and resid 20 and name HG12))
ASSI { 1346}
( segid " " and resid 39 and name HD2%)
( segid " " and resid 41 and name HD2%)
2.900 2.900 3.100 peak 1346 spectrum 1 weight 0.10000E+01 volume 0.57806E-02 ppm1 0.316 ppm2 0.903 CV 1
OR { 1346}
( segid " " and resid 39 and name HD2%)
( segid " " and resid 61 and name HG2%)
ASSI { 1347}
( segid " " and resid 39 and name HD2%)
( segid " " and resid 41 and name HD1%)
3.200 3.200 2.800 peak 1347 spectrum 1 weight 0.10000E+01 volume 0.26024E-02 ppm1 0.316 ppm2 0.770 CV 1
OR { 1347}
( segid " " and resid 39 and name HD2%)
( segid " " and resid 75 and name HD1%)
ASSI { 1351}
( segid " " and resid 71 and name HG1%)
(( segid " " and resid 47 and name HG2 ))
4.900 3.000 1.100 peak 1351 spectrum 1 weight 0.10000E+01 volume 0.22807E-03 ppm1 0.305 ppm2 1.955 CV 1
OR { 1351}
( segid " " and resid 71 and name HG1%)
(( segid " " and resid 73 and name HB ))
ASSI { 1354}
( segid " " and resid 71 and name HG1%)
(( segid " " and resid 17 and name HG13))
2.800 2.800 3.200 peak 1354 spectrum 1 weight 0.10000E+01 volume 0.11513E-02 ppm1 0.314 ppm2 1.331 CV 1
OR { 1354}
( segid " " and resid 71 and name HG1%)
(( segid " " and resid 16 and name HG3 ))
ASSI { 1355}
( segid " " and resid 71 and name HG1%)
(( segid " " and resid 61 and name HG13))
1.900 1.900 4.100 peak 1355 spectrum 1 weight 0.10000E+01 volume 0.11121E-01 ppm1 0.315 ppm2 1.039 CV 1
OR { 1355}
( segid " " and resid 71 and name HG1%)
( segid " " and resid 18 and name HG2%)
ASSI { 1356}
( segid " " and resid 71 and name HG1%)
( segid " " and resid 44 and name HG2%)
2.500 2.500 3.500 peak 1356 spectrum 1 weight 0.10000E+01 volume 0.74680E-02 ppm1 0.315 ppm2 0.828 CV 1
OR { 1356}
( segid " " and resid 71 and name HG1%)
( segid " " and resid 72 and name HG2%)
OR { 1356}
( segid " " and resid 71 and name HG1%)
( segid " " and resid 12 and name HD1%)
ASSI { 1357}
( segid " " and resid 71 and name HG1%)
( segid " " and resid 17 and name HD1%)
2.300 0.700 0.700 peak 1357 spectrum 1 weight 0.10000E+01 volume 0.68698E-02 ppm1 0.315 ppm2 0.550 CV 1
OR { 1357}
( segid " " and resid 71 and name HG1%)
( segid " " and resid 65 and name HD1%)
ASSI { 1387}
(( segid " " and resid 41 and name HB3 ))
( segid " " and resid 61 and name HD1%)
4.100 2.100 1.900 peak 1387 spectrum 1 weight 0.10000E+01 volume 0.87635E-03 ppm1 1.994 ppm2 0.583 CV 1
OR { 1387}
(( segid " " and resid 41 and name HB3 ))
( segid " " and resid 44 and name HD1%)
ASSI { 1388}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 43 and name HG3 ))
4.300 2.300 1.700 peak 1388 spectrum 1 weight 0.10000E+01 volume 0.60454E-03 ppm1 4.315 ppm2 2.205 CV 1
OR { 1388}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 59 and name HB2 ))
OR { 1388}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 40 and name HG2 ))
ASSI { 1394}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 58 and name HB3 ))
3.700 1.700 1.700 peak 1394 spectrum 1 weight 0.10000E+01 volume 0.14597E-02 ppm1 4.315 ppm2 1.787 CV 1
OR { 1394}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HD3 ))
ASSI { 1401}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 42 and name HN ))
3.700 1.700 1.700 peak 1401 spectrum 1 weight 0.10000E+01 volume 0.19731E-02 ppm1 2.085 ppm2 8.739 CV 1
OR { 1401}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 51 and name HN ))
ASSI { 1402}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 14 and name HN ))
2.700 0.900 0.900 peak 1402 spectrum 1 weight 0.10000E+01 volume 0.21399E-02 ppm1 1.878 ppm2 8.740 CV 1
OR { 1402}
(( segid " " and resid 42 and name HB3 ))
(( segid " " and resid 42 and name HN ))
ASSI { 1412}
(( segid " " and resid 43 and name HB3 ))
( segid " " and resid 39 and name HD1%)
4.300 2.300 1.700 peak 1412 spectrum 1 weight 0.10000E+01 volume 0.62505E-03 ppm1 1.945 ppm2 0.603 CV 1
OR { 1412}
(( segid " " and resid 43 and name HB3 ))
( segid " " and resid 44 and name HD1%)
ASSI { 1418}
(( segid " " and resid 41 and name HA ))
( segid " " and resid 41 and name HD1%)
2.700 0.900 0.900 peak 1418 spectrum 1 weight 0.10000E+01 volume 0.30991E-02 ppm1 3.924 ppm2 0.805 CV 1
OR { 1418}
(( segid " " and resid 41 and name HA ))
( segid " " and resid 44 and name HG2%)
ASSI { 1419}
(( segid " " and resid 41 and name HA ))
( segid " " and resid 44 and name HD1%)
2.600 0.800 0.800 peak 1419 spectrum 1 weight 0.10000E+01 volume 0.45633E-02 ppm1 3.925 ppm2 0.584 CV 1
OR { 1419}
(( segid " " and resid 41 and name HA ))
( segid " " and resid 61 and name HD1%)
ASSI { 1424}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 44 and name HA ))
4.000 2.000 2.000 peak 1424 spectrum 1 weight 0.10000E+01 volume 0.98216E-03 ppm1 3.906 ppm2 3.816 CV 1
OR { 1424}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 61 and name HA ))
ASSI { 1436}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 46 and name HB2 ))
4.400 2.400 1.600 peak 1436 spectrum 1 weight 0.10000E+01 volume 0.63511E-03 ppm1 4.102 ppm2 1.787 CV 1
OR { 1436}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 47 and name HB3 ))
ASSI { 1441}
( segid " " and resid 45 and name HB% )
( segid " " and resid 93 and name HD2%)
3.500 1.500 1.500 peak 1441 spectrum 1 weight 0.10000E+01 volume 0.15078E-02 ppm1 1.144 ppm2 0.840 CV 1
OR { 1441}
( segid " " and resid 45 and name HB% )
( segid " " and resid 44 and name HG2%)
ASSI { 1442}
( segid " " and resid 45 and name HB% )
(( segid " " and resid 47 and name HB2 ))
3.300 1.400 1.400 peak 1442 spectrum 1 weight 0.10000E+01 volume 0.18317E-02 ppm1 1.144 ppm2 1.758 CV 1
OR { 1442}
( segid " " and resid 45 and name HB% )
(( segid " " and resid 47 and name HB3 ))
OR { 1442}
( segid " " and resid 45 and name HB% )
(( segid " " and resid 46 and name HB2 ))
ASSI { 1447}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 45 and name HA ))
3.800 1.800 1.800 peak 1447 spectrum 1 weight 0.10000E+01 volume 0.83686E-03 ppm1 3.377 ppm2 4.080 CV 1
OR { 1447}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 47 and name HA ))
ASSI { 1467}
(( segid " " and resid 14 and name HD3 ))
(( segid " " and resid 71 and name HN ))
4.100 2.100 1.900 peak 1467 spectrum 1 weight 0.10000E+01 volume 0.45905E-03 ppm1 1.712 ppm2 8.609 CV 1
OR { 1467}
(( segid " " and resid 14 and name HD2 ))
(( segid " " and resid 71 and name HN ))
OR { 1467}
(( segid " " and resid 77 and name HD3 ))
(( segid " " and resid 78 and name HN ))
OR { 1467}
(( segid " " and resid 16 and name HD3 ))
(( segid " " and resid 71 and name HN ))
OR { 1467}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 71 and name HN ))
ASSI { 1468}
(( segid " " and resid 62 and name HD3 ))
(( segid " " and resid 62 and name HN ))
3.500 1.500 1.500 peak 1468 spectrum 1 weight 0.10000E+01 volume 0.97121E-03 ppm1 1.729 ppm2 8.310 CV 1
OR { 1468}
(( segid " " and resid 62 and name HD2 ))
(( segid " " and resid 62 and name HN ))
OR { 1468}
(( segid " " and resid 9 and name HD2 ))
(( segid " " and resid 10 and name HN ))
ASSI { 1471}
(( segid " " and resid 42 and name HD3 ))
(( segid " " and resid 43 and name HG3 ))
3.800 1.800 1.800 peak 1471 spectrum 1 weight 0.10000E+01 volume 0.16250E-02 ppm1 1.778 ppm2 2.225 CV 1
OR { 1471}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 59 and name HB2 ))
ASSI { 1474}
(( segid " " and resid 14 and name HD2 ))
(( segid " " and resid 15 and name HA2 ))
4.400 2.500 1.600 peak 1474 spectrum 1 weight 0.10000E+01 volume 0.49386E-03 ppm1 1.710 ppm2 3.175 CV 1
OR { 1474}
(( segid " " and resid 14 and name HD3 ))
(( segid " " and resid 15 and name HA2 ))
OR { 1474}
(( segid " " and resid 16 and name HD3 ))
(( segid " " and resid 15 and name HA2 ))
OR { 1474}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 15 and name HA2 ))
ASSI { 1475}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 16 and name HE3 ))
2.000 0.500 0.500 peak 1475 spectrum 1 weight 0.10000E+01 volume 0.16993E-01 ppm1 1.723 ppm2 3.038 CV 1
OR { 1475}
(( segid " " and resid 16 and name HD3 ))
(( segid " " and resid 16 and name HE2 ))
OR { 1475}
(( segid " " and resid 9 and name HD3 ))
(( segid " " and resid 9 and name HE2 ))
OR { 1475}
(( segid " " and resid 77 and name HD2 ))
(( segid " " and resid 77 and name HE2 ))
OR { 1475}
(( segid " " and resid 62 and name HD3 ))
(( segid " " and resid 62 and name HE3 ))
OR { 1475}
(( segid " " and resid 77 and name HD3 ))
(( segid " " and resid 77 and name HE3 ))
OR { 1475}
(( segid " " and resid 9 and name HD2 ))
(( segid " " and resid 9 and name HE3 ))
OR { 1475}
(( segid " " and resid 9 and name HD2 ))
(( segid " " and resid 9 and name HE2 ))
OR { 1475}
(( segid " " and resid 9 and name HD3 ))
(( segid " " and resid 9 and name HE3 ))
OR { 1475}
(( segid " " and resid 62 and name HD2 ))
(( segid " " and resid 62 and name HE3 ))
OR { 1475}
(( segid " " and resid 62 and name HD3 ))
(( segid " " and resid 62 and name HE2 ))
OR { 1475}
(( segid " " and resid 77 and name HD2 ))
(( segid " " and resid 77 and name HE3 ))
OR { 1475}
(( segid " " and resid 77 and name HD3 ))
(( segid " " and resid 77 and name HE2 ))
ASSI { 1477}
(( segid " " and resid 14 and name HD3 ))
(( segid " " and resid 70 and name HG3 ))
3.200 1.300 1.300 peak 1477 spectrum 1 weight 0.10000E+01 volume 0.19740E-02 ppm1 1.712 ppm2 2.145 CV 1
OR { 1477}
(( segid " " and resid 14 and name HD2 ))
(( segid " " and resid 70 and name HG3 ))
OR { 1477}
(( segid " " and resid 16 and name HD3 ))
(( segid " " and resid 70 and name HG3 ))
OR { 1477}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 70 and name HG3 ))
ASSI { 1479}
(( segid " " and resid 14 and name HD3 ))
(( segid " " and resid 70 and name HB2 ))
2.900 1.000 1.000 peak 1479 spectrum 1 weight 0.10000E+01 volume 0.29082E-02 ppm1 1.712 ppm2 2.050 CV 1
OR { 1479}
(( segid " " and resid 14 and name HD2 ))
(( segid " " and resid 70 and name HB2 ))
OR { 1479}
(( segid " " and resid 16 and name HD3 ))
(( segid " " and resid 70 and name HB2 ))
OR { 1479}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 70 and name HB2 ))
ASSI { 1481}
(( segid " " and resid 62 and name HD2 ))
( segid " " and resid 24 and name HD1%)
3.400 3.400 2.600 peak 1481 spectrum 1 weight 0.10000E+01 volume 0.57321E-03 ppm1 1.713 ppm2 1.114 CV 1
OR { 1481}
(( segid " " and resid 62 and name HD3 ))
( segid " " and resid 24 and name HD1%)
OR { 1481}
(( segid " " and resid 77 and name HD3 ))
(( segid " " and resid 87 and name HB3 ))
OR { 1481}
(( segid " " and resid 14 and name HD3 ))
(( segid " " and resid 87 and name HB3 ))
OR { 1481}
(( segid " " and resid 14 and name HD2 ))
(( segid " " and resid 87 and name HB3 ))
OR { 1481}
(( segid " " and resid 14 and name HD2 ))
( segid " " and resid 33 and name HB% )
OR { 1481}
(( segid " " and resid 14 and name HD3 ))
( segid " " and resid 33 and name HB% )
ASSI { 1482}
(( segid " " and resid 16 and name HD2 ))
( segid " " and resid 18 and name HG2%)
3.700 1.800 1.800 peak 1482 spectrum 1 weight 0.10000E+01 volume 0.58390E-03 ppm1 1.724 ppm2 0.996 CV 1
OR { 1482}
(( segid " " and resid 16 and name HD3 ))
( segid " " and resid 18 and name HG2%)
OR { 1482}
(( segid " " and resid 9 and name HD2 ))
( segid " " and resid 5 and name HD1%)
OR { 1482}
(( segid " " and resid 9 and name HD3 ))
( segid " " and resid 5 and name HD1%)
OR { 1482}
(( segid " " and resid 77 and name HD3 ))
(( segid " " and resid 75 and name HG12))
OR { 1482}
(( segid " " and resid 46 and name HB3 ))
( segid " " and resid 89 and name HG2%)
OR { 1482}
(( segid " " and resid 14 and name HD3 ))
( segid " " and resid 89 and name HG2%)
OR { 1482}
(( segid " " and resid 14 and name HD2 ))
( segid " " and resid 89 and name HG2%)
ASSI { 1483}
(( segid " " and resid 14 and name HD3 ))
( segid " " and resid 72 and name HD1%)
2.800 1.000 1.000 peak 1483 spectrum 1 weight 0.10000E+01 volume 0.32824E-02 ppm1 1.723 ppm2 0.868 CV 1
OR { 1483}
(( segid " " and resid 14 and name HD2 ))
( segid " " and resid 72 and name HD1%)
OR { 1483}
(( segid " " and resid 62 and name HD3 ))
( segid " " and resid 61 and name HG2%)
OR { 1483}
(( segid " " and resid 62 and name HD2 ))
( segid " " and resid 61 and name HG2%)
ASSI { 1484}
(( segid " " and resid 62 and name HD3 ))
( segid " " and resid 20 and name HG2%)
2.700 2.700 3.300 peak 1484 spectrum 1 weight 0.10000E+01 volume 0.17604E-02 ppm1 1.726 ppm2 0.718 CV 1
OR { 1484}
(( segid " " and resid 62 and name HD2 ))
( segid " " and resid 20 and name HG2%)
OR { 1484}
(( segid " " and resid 62 and name HD3 ))
( segid " " and resid 20 and name HD1%)
OR { 1484}
(( segid " " and resid 9 and name HD3 ))
( segid " " and resid 91 and name HD1%)
OR { 1484}
(( segid " " and resid 9 and name HD2 ))
( segid " " and resid 91 and name HD1%)
ASSI { 1503}
( segid " " and resid 91 and name HD1%)
(( segid " " and resid 39 and name HB3 ))
3.000 3.000 3.000 peak 1503 spectrum 1 weight 0.10000E+01 volume 0.96354E-03 ppm1 0.705 ppm2 1.680 CV 1
OR { 1503}
( segid " " and resid 91 and name HD1%)
( segid " " and resid 86 and name HB% )
OR { 1503}
( segid " " and resid 91 and name HD1%)
(( segid " " and resid 29 and name HB ))
OR { 1503}
( segid " " and resid 91 and name HD1%)
(( segid " " and resid 46 and name HB3 ))
ASSI { 1506}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 9 and name HD3 ))
3.000 1.100 1.100 peak 1506 spectrum 1 weight 0.10000E+01 volume 0.98613E-03 ppm1 0.803 ppm2 1.729 CV 1
OR { 1506}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 9 and name HD2 ))
OR { 1506}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 14 and name HB3 ))
ASSI { 1516}
( segid " " and resid 91 and name HD1%)
( segid " " and resid 39 and name HD2%)
3.200 3.200 2.800 peak 1516 spectrum 1 weight 0.10000E+01 volume 0.50685E-03 ppm1 0.701 ppm2 0.304 CV 1
OR { 1516}
( segid " " and resid 91 and name HD1%)
( segid " " and resid 71 and name HG1%)
ASSI { 1519}
( segid " " and resid 91 and name HD1%)
(( segid " " and resid 72 and name HA ))
3.200 1.300 1.300 peak 1519 spectrum 1 weight 0.10000E+01 volume 0.54543E-03 ppm1 0.704 ppm2 4.907 CV 1
OR { 1519}
( segid " " and resid 91 and name HD1%)
(( segid " " and resid 88 and name HA ))
ASSI { 1521}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 72 and name HA ))
4.100 2.100 1.900 peak 1521 spectrum 1 weight 0.10000E+01 volume 0.64001E-03 ppm1 0.804 ppm2 4.904 CV 1
OR { 1521}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 13 and name HA ))
ASSI { 1523}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 10 and name HA ))
3.300 3.300 2.700 peak 1523 spectrum 1 weight 0.10000E+01 volume 0.47606E-03 ppm1 0.801 ppm2 4.358 CV 1
OR { 1523}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 9 and name HA ))
ASSI { 1530}
( segid " " and resid 72 and name HD1%)
(( segid " " and resid 73 and name HN ))
2.600 2.600 3.400 peak 1530 spectrum 1 weight 0.10000E+01 volume 0.19686E-02 ppm1 0.885 ppm2 9.059 CV 1
OR { 1530}
( segid " " and resid 72 and name HD1%)
(( segid " " and resid 15 and name HN ))
ASSI { 1537}
( segid " " and resid 72 and name HD1%)
( segid " " and resid 73 and name HG1%)
2.700 2.700 3.300 peak 1537 spectrum 1 weight 0.10000E+01 volume 0.14388E-02 ppm1 0.881 ppm2 0.557 CV 1
OR { 1537}
( segid " " and resid 72 and name HD1%)
( segid " " and resid 29 and name HG1%)
OR { 1537}
( segid " " and resid 72 and name HD1%)
( segid " " and resid 17 and name HD1%)
ASSI { 1546}
( segid " " and resid 72 and name HD1%)
( segid " " and resid 45 and name HB% )
2.700 2.700 3.300 peak 1546 spectrum 1 weight 0.10000E+01 volume 0.14420E-02 ppm1 0.883 ppm2 1.119 CV 1
OR { 1546}
( segid " " and resid 72 and name HD1%)
( segid " " and resid 88 and name HG2%)
OR { 1546}
( segid " " and resid 72 and name HD1%)
(( segid " " and resid 87 and name HB3 ))
ASSI { 1555}
( segid " " and resid 41 and name HD2%)
(( segid " " and resid 25 and name HA ))
3.600 1.600 1.600 peak 1555 spectrum 1 weight 0.10000E+01 volume 0.78526E-03 ppm1 0.908 ppm2 3.796 CV 1
OR { 1555}
( segid " " and resid 41 and name HD2%)
(( segid " " and resid 61 and name HA ))
ASSI { 1559}
( segid " " and resid 41 and name HD2%)
(( segid " " and resid 44 and name HG12))
4.000 2.000 2.000 peak 1559 spectrum 1 weight 0.10000E+01 volume 0.79224E-03 ppm1 0.908 ppm2 1.872 CV 1
OR { 1559}
( segid " " and resid 41 and name HD2%)
(( segid " " and resid 42 and name HB3 ))
ASSI { 1567}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 29 and name HA ))
4.100 2.100 1.900 peak 1567 spectrum 1 weight 0.10000E+01 volume 0.67129E-03 ppm1 0.534 ppm2 4.663 CV 1
OR { 1567}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 71 and name HA ))
ASSI { 1568}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 44 and name HG12))
4.100 2.100 1.900 peak 1568 spectrum 1 weight 0.10000E+01 volume 0.54180E-03 ppm1 0.531 ppm2 1.853 CV 1
OR { 1568}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 66 and name HB2 ))
OR { 1568}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 19 and name HB3 ))
ASSI { 1569}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 14 and name HD3 ))
3.700 3.700 2.300 peak 1569 spectrum 1 weight 0.10000E+01 volume 0.81886E-03 ppm1 0.534 ppm2 1.750 CV 1
OR { 1569}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 14 and name HD2 ))
OR { 1569}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 47 and name HB2 ))
OR { 1569}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 47 and name HG3 ))
OR { 1569}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 59 and name HB3 ))
OR { 1569}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 47 and name HB3 ))
ASSI { 1570}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 16 and name HB3 ))
3.900 1.900 1.900 peak 1570 spectrum 1 weight 0.10000E+01 volume 0.11532E-02 ppm1 0.534 ppm2 1.674 CV 1
OR { 1570}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 16 and name HB2 ))
OR { 1570}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 29 and name HB ))
ASSI { 1571}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 18 and name HN ))
4.100 2.100 1.900 peak 1571 spectrum 1 weight 0.10000E+01 volume 0.11457E-02 ppm1 0.529 ppm2 9.219 CV 1
OR { 1571}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 68 and name HN ))
ASSI { 1572}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 30 and name HN ))
4.200 2.200 1.800 peak 1572 spectrum 1 weight 0.10000E+01 volume 0.58142E-03 ppm1 0.535 ppm2 8.997 CV 1
OR { 1572}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 28 and name HN ))
OR { 1572}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 29 and name HN ))
ASSI { 1574}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 16 and name HA ))
3.900 1.900 1.900 peak 1574 spectrum 1 weight 0.10000E+01 volume 0.52890E-03 ppm1 0.526 ppm2 5.247 CV 1
OR { 1574}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 70 and name HA ))
ASSI { 1578}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 70 and name HG3 ))
4.400 2.400 1.600 peak 1578 spectrum 1 weight 0.10000E+01 volume 0.46109E-03 ppm1 0.530 ppm2 2.159 CV 1
OR { 1578}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 30 and name HB2 ))
ASSI { 1582}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 65 and name HB3 ))
2.700 0.900 0.900 peak 1582 spectrum 1 weight 0.10000E+01 volume 0.53333E-02 ppm1 0.530 ppm2 1.169 CV 1
OR { 1582}
( segid " " and resid 17 and name HD1%)
( segid " " and resid 27 and name HB% )
ASSI { 1585}
( segid " " and resid 17 and name HD1%)
( segid " " and resid 93 and name HD2%)
2.600 2.600 3.400 peak 1585 spectrum 1 weight 0.10000E+01 volume 0.11372E-01 ppm1 0.529 ppm2 0.877 CV 1
OR { 1585}
( segid " " and resid 17 and name HD1%)
( segid " " and resid 72 and name HD1%)
OR { 1585}
( segid " " and resid 17 and name HD1%)
( segid " " and resid 61 and name HG2%)
ASSI { 1588}
( segid " " and resid 41 and name HD2%)
(( segid " " and resid 44 and name HG13))
2.800 2.800 3.200 peak 1588 spectrum 1 weight 0.10000E+01 volume 0.10137E-01 ppm1 0.909 ppm2 0.533 CV 1
OR { 1588}
( segid " " and resid 41 and name HD2%)
( segid " " and resid 65 and name HD1%)
ASSI { 1589}
( segid " " and resid 41 and name HD2%)
( segid " " and resid 61 and name HD1%)
2.800 1.000 1.000 peak 1589 spectrum 1 weight 0.10000E+01 volume 0.86821E-02 ppm1 0.909 ppm2 0.582 CV 1
OR { 1589}
( segid " " and resid 41 and name HD2%)
( segid " " and resid 44 and name HD1%)
ASSI { 1592}
( segid " " and resid 75 and name HD1%)
(( segid " " and resid 78 and name HG3 ))
4.100 2.100 1.900 peak 1592 spectrum 1 weight 0.10000E+01 volume 0.45926E-03 ppm1 0.788 ppm2 2.358 CV 1
OR { 1592}
( segid " " and resid 75 and name HD1%)
(( segid " " and resid 78 and name HG2 ))
OR { 1592}
( segid " " and resid 75 and name HD1%)
(( segid " " and resid 79 and name HG3 ))
ASSI { 1594}
( segid " " and resid 75 and name HD1%)
( segid " " and resid 86 and name HB% )
4.100 2.100 1.900 peak 1594 spectrum 1 weight 0.10000E+01 volume 0.53923E-03 ppm1 0.785 ppm2 1.660 CV 1
OR { 1594}
( segid " " and resid 75 and name HD1%)
(( segid " " and resid 29 and name HB ))
ASSI { 1598}
( segid " " and resid 75 and name HD1%)
( segid " " and resid 73 and name HG2%)
2.900 1.100 1.100 peak 1598 spectrum 1 weight 0.10000E+01 volume 0.35593E-02 ppm1 0.784 ppm2 0.596 CV 1
OR { 1598}
( segid " " and resid 75 and name HD1%)
( segid " " and resid 29 and name HG1%)
OR { 1598}
( segid " " and resid 75 and name HD1%)
( segid " " and resid 29 and name HG2%)
ASSI { 1606}
( segid " " and resid 75 and name HD1%)
(( segid " " and resid 75 and name HN ))
3.200 1.300 1.300 peak 1606 spectrum 1 weight 0.10000E+01 volume 0.14781E-02 ppm1 0.786 ppm2 8.635 CV 1
OR { 1606}
( segid " " and resid 75 and name HD1%)
(( segid " " and resid 86 and name HN ))
ASSI { 1611}
( segid " " and resid 75 and name HD1%)
(( segid " " and resid 87 and name HA ))
3.800 1.800 1.800 peak 1611 spectrum 1 weight 0.10000E+01 volume 0.45682E-03 ppm1 0.790 ppm2 5.154 CV 1
OR { 1611}
( segid " " and resid 75 and name HD1%)
(( segid " " and resid 74 and name HA ))
ASSI { 1613}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 19 and name HB2 ))
4.100 2.200 1.900 peak 1613 spectrum 1 weight 0.10000E+01 volume 0.96115E-03 ppm1 0.685 ppm2 2.022 CV 1
OR { 1613}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 41 and name HB3 ))
ASSI { 1616}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 66 and name HB3 ))
3.400 1.500 1.500 peak 1616 spectrum 1 weight 0.10000E+01 volume 0.18782E-02 ppm1 0.685 ppm2 1.707 CV 1
OR { 1616}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 61 and name HB ))
ASSI { 1617}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 66 and name HG2 ))
3.600 1.600 1.600 peak 1617 spectrum 1 weight 0.10000E+01 volume 0.16348E-02 ppm1 0.685 ppm2 1.568 CV 1
OR { 1617}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 19 and name HG3 ))
OR { 1617}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 66 and name HG3 ))
ASSI { 1619}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 65 and name HB3 ))
2.800 1.000 1.000 peak 1619 spectrum 1 weight 0.10000E+01 volume 0.49289E-02 ppm1 0.685 ppm2 1.171 CV 1
OR { 1619}
( segid " " and resid 20 and name HD1%)
( segid " " and resid 27 and name HB% )
ASSI { 1622}
( segid " " and resid 20 and name HD1%)
( segid " " and resid 65 and name HD1%)
2.100 2.100 3.900 peak 1622 spectrum 1 weight 0.10000E+01 volume 0.33800E-01 ppm1 0.685 ppm2 0.568 CV 1
OR { 1622}
( segid " " and resid 20 and name HD1%)
( segid " " and resid 61 and name HD1%)
ASSI { 1627}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 20 and name HA ))
3.700 1.700 1.700 peak 1627 spectrum 1 weight 0.10000E+01 volume 0.19351E-02 ppm1 0.685 ppm2 4.273 CV 1
OR { 1627}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 17 and name HA ))
ASSI { 1631}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 18 and name HN ))
5.200 3.400 0.800 peak 1631 spectrum 1 weight 0.10000E+01 volume 0.49347E-03 ppm1 0.685 ppm2 9.234 CV 1
OR { 1631}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 68 and name HN ))
ASSI { 1633}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 21 and name HN ))
4.500 2.500 1.500 peak 1633 spectrum 1 weight 0.10000E+01 volume 0.94677E-03 ppm1 0.686 ppm2 8.822 CV 1
OR { 1633}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 17 and name HN ))
ASSI { 1635}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 65 and name HN ))
3.500 1.500 1.500 peak 1635 spectrum 1 weight 0.10000E+01 volume 0.79135E-03 ppm1 0.685 ppm2 7.155 CV 1
OR { 1635}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 64 and name HN ))
ASSI { 1644}
( segid " " and resid 44 and name HD1%)
( segid " " and resid 39 and name HD2%)
2.700 2.700 3.300 peak 1644 spectrum 1 weight 0.10000E+01 volume 0.41357E-02 ppm1 0.580 ppm2 0.335 CV 1
OR { 1644}
( segid " " and resid 44 and name HD1%)
( segid " " and resid 71 and name HG1%)
ASSI { 1647}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 25 and name HB3 ))
3.800 1.800 1.800 peak 1647 spectrum 1 weight 0.10000E+01 volume 0.41398E-03 ppm1 0.575 ppm2 2.212 CV 1
OR { 1647}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 59 and name HB2 ))
ASSI { 1650}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 41 and name HB2 ))
2.400 0.700 0.700 peak 1650 spectrum 1 weight 0.10000E+01 volume 0.39767E-02 ppm1 0.573 ppm2 1.393 CV 1
OR { 1650}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 65 and name HB2 ))
ASSI { 1656}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 62 and name HA ))
2.900 2.900 3.100 peak 1656 spectrum 1 weight 0.10000E+01 volume 0.89743E-03 ppm1 0.572 ppm2 4.186 CV 1
OR { 1656}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 22 and name HA ))
ASSI { 1659}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 62 and name HN ))
3.600 1.600 1.600 peak 1659 spectrum 1 weight 0.10000E+01 volume 0.42070E-03 ppm1 0.574 ppm2 8.293 CV 1
OR { 1659}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 60 and name HN ))
ASSI { 1667}
( segid " " and resid 61 and name HG2%)
(( segid " " and resid 60 and name HA ))
4.000 2.000 2.000 peak 1667 spectrum 1 weight 0.10000E+01 volume 0.91714E-03 ppm1 0.870 ppm2 4.979 CV 1
OR { 1667}
( segid " " and resid 61 and name HG2%)
(( segid " " and resid 27 and name HA ))
ASSI { 1670}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 86 and name HN ))
2.800 1.000 1.000 peak 1670 spectrum 1 weight 0.10000E+01 volume 0.31171E-02 ppm1 0.845 ppm2 8.633 CV 1
OR { 1670}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 75 and name HN ))
ASSI { 1671}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 85 and name HN ))
4.400 2.500 1.600 peak 1671 spectrum 1 weight 0.10000E+01 volume 0.48168E-03 ppm1 0.846 ppm2 8.426 CV 1
OR { 1671}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 88 and name HN ))
ASSI { 1673}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 87 and name HA ))
4.100 2.100 1.900 peak 1673 spectrum 1 weight 0.10000E+01 volume 0.82105E-03 ppm1 0.845 ppm2 5.155 CV 1
OR { 1673}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 74 and name HA ))
ASSI { 1689}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 44 and name HN ))
3.500 1.500 1.500 peak 1689 spectrum 1 weight 0.10000E+01 volume 0.24476E-02 ppm1 0.842 ppm2 7.679 CV 1
OR { 1689}
( segid " " and resid 91 and name HG2%)
(( segid " " and resid 91 and name HN ))
ASSI { 1690}
( segid " " and resid 91 and name HG2%)
(( segid " " and resid 92 and name HN ))
2.600 0.900 0.900 peak 1690 spectrum 1 weight 0.10000E+01 volume 0.46519E-02 ppm1 0.841 ppm2 9.064 CV 1
OR { 1690}
( segid " " and resid 72 and name HG2%)
(( segid " " and resid 73 and name HN ))
ASSI { 1691}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 60 and name HN ))
4.400 2.400 1.600 peak 1691 spectrum 1 weight 0.10000E+01 volume 0.46986E-03 ppm1 0.848 ppm2 8.283 CV 1
OR { 1691}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 94 and name HN ))
ASSI { 1692}
( segid " " and resid 72 and name HG2%)
(( segid " " and resid 73 and name HA ))
3.600 1.600 1.600 peak 1692 spectrum 1 weight 0.10000E+01 volume 0.83501E-03 ppm1 0.845 ppm2 5.322 CV 1
OR { 1692}
( segid " " and resid 91 and name HG2%)
(( segid " " and resid 73 and name HA ))
ASSI { 1693}
( segid " " and resid 91 and name HG2%)
(( segid " " and resid 89 and name HA ))
3.900 1.900 1.900 peak 1693 spectrum 1 weight 0.10000E+01 volume 0.98045E-03 ppm1 0.847 ppm2 5.169 CV 1
OR { 1693}
( segid " " and resid 72 and name HG2%)
(( segid " " and resid 89 and name HA ))
ASSI { 1694}
( segid " " and resid 72 and name HG2%)
(( segid " " and resid 71 and name HA ))
4.100 2.200 1.900 peak 1694 spectrum 1 weight 0.10000E+01 volume 0.10622E-02 ppm1 0.844 ppm2 4.663 CV 1
OR { 1694}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 58 and name HA ))
ASSI { 1695}
( segid " " and resid 91 and name HG2%)
(( segid " " and resid 92 and name HB2 ))
3.600 1.700 1.700 peak 1695 spectrum 1 weight 0.10000E+01 volume 0.12073E-02 ppm1 0.844 ppm2 3.923 CV 1
OR { 1695}
( segid " " and resid 91 and name HG2%)
(( segid " " and resid 92 and name HB3 ))
OR { 1695}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 41 and name HA ))
ASSI { 1698}
( segid " " and resid 72 and name HG2%)
(( segid " " and resid 14 and name HE2 ))
4.300 2.300 1.700 peak 1698 spectrum 1 weight 0.10000E+01 volume 0.51740E-03 ppm1 0.841 ppm2 2.975 CV 1
OR { 1698}
( segid " " and resid 72 and name HG2%)
(( segid " " and resid 14 and name HE3 ))
OR { 1698}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 46 and name HD3 ))
ASSI { 1701}
( segid " " and resid 91 and name HG2%)
(( segid " " and resid 74 and name HG3 ))
3.800 1.800 1.800 peak 1701 spectrum 1 weight 0.10000E+01 volume 0.39960E-03 ppm1 0.856 ppm2 2.327 CV 1
OR { 1701}
( segid " " and resid 72 and name HG2%)
(( segid " " and resid 74 and name HG3 ))
OR { 1701}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 25 and name HB2 ))
OR { 1701}
( segid " " and resid 72 and name HG2%)
(( segid " " and resid 76 and name HB2 ))
ASSI { 1703}
( segid " " and resid 72 and name HG2%)
(( segid " " and resid 72 and name HB ))
2.100 0.500 0.500 peak 1703 spectrum 1 weight 0.10000E+01 volume 0.13831E-01 ppm1 0.845 ppm2 1.914 CV 1
OR { 1703}
( segid " " and resid 91 and name HG2%)
(( segid " " and resid 91 and name HB ))
ASSI { 1705}
( segid " " and resid 72 and name HG2%)
(( segid " " and resid 12 and name HG13))
2.700 0.900 0.900 peak 1705 spectrum 1 weight 0.10000E+01 volume 0.38637E-02 ppm1 0.844 ppm2 1.494 CV 1
OR { 1705}
( segid " " and resid 72 and name HG2%)
(( segid " " and resid 14 and name HG2 ))
ASSI { 1706}
( segid " " and resid 91 and name HG2%)
(( segid " " and resid 91 and name HG13))
2.800 1.000 1.000 peak 1706 spectrum 1 weight 0.10000E+01 volume 0.49482E-02 ppm1 0.844 ppm2 1.410 CV 1
OR { 1706}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 65 and name HG ))
ASSI { 1708}
( segid " " and resid 44 and name HG2%)
( segid " " and resid 45 and name HB% )
3.200 1.300 1.300 peak 1708 spectrum 1 weight 0.10000E+01 volume 0.33347E-02 ppm1 0.839 ppm2 1.158 CV 1
OR { 1708}
( segid " " and resid 91 and name HG2%)
( segid " " and resid 88 and name HG2%)
OR { 1708}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 65 and name HB3 ))
ASSI { 1714}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 74 and name HB3 ))
3.000 1.100 1.100 peak 1714 spectrum 1 weight 0.10000E+01 volume 0.38212E-02 ppm1 0.774 ppm2 1.938 CV 1
OR { 1714}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 72 and name HB ))
OR { 1714}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 74 and name HB2 ))
OR { 1714}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 73 and name HB ))
ASSI { 1715}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 14 and name HB3 ))
3.100 3.100 2.900 peak 1715 spectrum 1 weight 0.10000E+01 volume 0.17273E-02 ppm1 0.773 ppm2 1.761 CV 1
OR { 1715}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 9 and name HD3 ))
OR { 1715}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 9 and name HD2 ))
OR { 1715}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 62 and name HD3 ))
ASSI { 1716}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 16 and name HB3 ))
3.500 1.500 1.500 peak 1716 spectrum 1 weight 0.10000E+01 volume 0.21674E-02 ppm1 0.773 ppm2 1.669 CV 1
OR { 1716}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 66 and name HB3 ))
OR { 1716}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 16 and name HB2 ))
OR { 1716}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 19 and name HG2 ))
ASSI { 1717}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 12 and name HB ))
2.100 0.500 0.500 peak 1717 spectrum 1 weight 0.10000E+01 volume 0.12662E-01 ppm1 0.773 ppm2 1.544 CV 1
OR { 1717}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 17 and name HG12))
ASSI { 1718}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 16 and name HA ))
4.900 3.000 1.100 peak 1718 spectrum 1 weight 0.10000E+01 volume 0.40615E-03 ppm1 0.770 ppm2 5.251 CV 1
OR { 1718}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 70 and name HA ))
ASSI { 1719}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 65 and name HA ))
3.900 1.900 1.900 peak 1719 spectrum 1 weight 0.10000E+01 volume 0.92487E-03 ppm1 0.773 ppm2 5.129 CV 1
OR { 1719}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 74 and name HA ))
ASSI { 1724}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 74 and name HN ))
4.300 2.300 1.700 peak 1724 spectrum 1 weight 0.10000E+01 volume 0.53716E-03 ppm1 0.773 ppm2 8.642 CV 1
OR { 1724}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 75 and name HN ))
OR { 1724}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 70 and name HN ))
ASSI { 1725}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 19 and name HN ))
2.600 0.900 0.900 peak 1725 spectrum 1 weight 0.10000E+01 volume 0.39160E-02 ppm1 0.773 ppm2 7.392 CV 1
OR { 1725}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 12 and name HN ))
ASSI { 1726}
( segid " " and resid 12 and name HG2%)
( segid " " and resid 13 and name HD% )
3.900 1.900 1.900 peak 1726 spectrum 1 weight 0.10000E+01 volume 0.69184E-03 ppm1 0.776 ppm2 7.100 CV 1
OR { 1726}
( segid " " and resid 17 and name HG2%)
( segid " " and resid 28 and name HD% )
ASSI { 1738}
( segid " " and resid 17 and name HG2%)
( segid " " and resid 17 and name HD1%)
2.600 0.900 0.900 peak 1738 spectrum 1 weight 0.10000E+01 volume 0.11294E-01 ppm1 0.773 ppm2 0.559 CV 1
OR { 1738}
( segid " " and resid 17 and name HG2%)
( segid " " and resid 65 and name HD1%)
OR { 1738}
( segid " " and resid 17 and name HG2%)
( segid " " and resid 61 and name HD1%)
ASSI { 1742}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 69 and name HB3 ))
3.000 3.000 3.000 peak 1742 spectrum 1 weight 0.10000E+01 volume 0.73160E-03 ppm1 0.380 ppm2 2.079 CV 1
OR { 1742}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 70 and name HB3 ))
ASSI { 1743}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 17 and name HG12))
3.400 1.400 1.400 peak 1743 spectrum 1 weight 0.10000E+01 volume 0.82441E-03 ppm1 0.382 ppm2 1.544 CV 1
OR { 1743}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 87 and name HG ))
ASSI { 1746}
( segid " " and resid 71 and name HG2%)
( segid " " and resid 27 and name HB% )
3.700 1.700 1.700 peak 1746 spectrum 1 weight 0.10000E+01 volume 0.51121E-03 ppm1 0.381 ppm2 1.184 CV 1
OR { 1746}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 39 and name HG ))
ASSI { 1748}
( segid " " and resid 71 and name HG2%)
( segid " " and resid 93 and name HD2%)
3.100 1.200 1.200 peak 1748 spectrum 1 weight 0.10000E+01 volume 0.30763E-02 ppm1 0.374 ppm2 0.841 CV 1
OR { 1748}
( segid " " and resid 71 and name HG2%)
( segid " " and resid 72 and name HG2%)
ASSI { 1749}
( segid " " and resid 71 and name HG2%)
( segid " " and resid 73 and name HG2%)
2.100 0.500 0.500 peak 1749 spectrum 1 weight 0.10000E+01 volume 0.15694E-01 ppm1 0.374 ppm2 0.561 CV 1
OR { 1749}
( segid " " and resid 71 and name HG2%)
( segid " " and resid 73 and name HG1%)
OR { 1749}
( segid " " and resid 71 and name HG2%)
( segid " " and resid 17 and name HD1%)
OR { 1749}
( segid " " and resid 71 and name HG2%)
( segid " " and resid 29 and name HG2%)
ASSI { 1751}
( segid " " and resid 20 and name HG2%)
(( segid " " and resid 22 and name HG2 ))
4.100 2.100 1.900 peak 1751 spectrum 1 weight 0.10000E+01 volume 0.75658E-03 ppm1 0.706 ppm2 2.340 CV 1
OR { 1751}
( segid " " and resid 20 and name HG2%)
(( segid " " and resid 21 and name HG3 ))
OR { 1751}
( segid " " and resid 20 and name HG2%)
(( segid " " and resid 21 and name HG2 ))
ASSI { 1754}
( segid " " and resid 20 and name HG2%)
(( segid " " and resid 61 and name HB ))
3.500 1.500 1.500 peak 1754 spectrum 1 weight 0.10000E+01 volume 0.18648E-02 ppm1 0.706 ppm2 1.715 CV 1
OR { 1754}
( segid " " and resid 20 and name HG2%)
(( segid " " and resid 62 and name HD3 ))
ASSI { 1765}
( segid " " and resid 20 and name HG2%)
(( segid " " and resid 22 and name HD2 ))
3.600 1.600 1.600 peak 1765 spectrum 1 weight 0.10000E+01 volume 0.18874E-02 ppm1 0.706 ppm2 3.905 CV 1
OR { 1765}
( segid " " and resid 20 and name HG2%)
(( segid " " and resid 41 and name HA ))
ASSI { 1766}
( segid " " and resid 20 and name HG2%)
(( segid " " and resid 61 and name HA ))
4.300 2.300 1.700 peak 1766 spectrum 1 weight 0.10000E+01 volume 0.54045E-03 ppm1 0.705 ppm2 3.793 CV 1
OR { 1766}
( segid " " and resid 20 and name HG2%)
(( segid " " and resid 25 and name HA ))
ASSI { 1768}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 70 and name HA ))
3.300 1.400 1.400 peak 1768 spectrum 1 weight 0.10000E+01 volume 0.14928E-02 ppm1 0.371 ppm2 5.247 CV 1
OR { 1768}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 16 and name HA ))
ASSI { 1769}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 15 and name HA1 ))
3.400 1.400 1.400 peak 1769 spectrum 1 weight 0.10000E+01 volume 0.51135E-03 ppm1 0.372 ppm2 5.010 CV 1
OR { 1769}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 39 and name HA ))
ASSI { 1788}
( segid " " and resid 45 and name HB% )
(( segid " " and resid 90 and name HA ))
4.000 2.000 2.000 peak 1788 spectrum 1 weight 0.10000E+01 volume 0.56322E-03 ppm1 1.147 ppm2 4.667 CV 1
OR { 1788}
( segid " " and resid 45 and name HB% )
(( segid " " and resid 71 and name HA ))
ASSI { 1792}
( segid " " and resid 10 and name HB% )
(( segid " " and resid 75 and name HA ))
3.700 1.700 1.700 peak 1792 spectrum 1 weight 0.10000E+01 volume 0.61373E-03 ppm1 1.417 ppm2 3.917 CV 1
OR { 1792}
( segid " " and resid 94 and name HB% )
(( segid " " and resid 96 and name HB2 ))
OR { 1792}
( segid " " and resid 94 and name HB% )
(( segid " " and resid 96 and name HB3 ))
ASSI { 1793}
( segid " " and resid 10 and name HB% )
(( segid " " and resid 74 and name HG3 ))
3.700 1.700 1.700 peak 1793 spectrum 1 weight 0.10000E+01 volume 0.72538E-03 ppm1 1.413 ppm2 2.311 CV 1
OR { 1793}
( segid " " and resid 10 and name HB% )
(( segid " " and resid 76 and name HB2 ))
ASSI { 1797}
( segid " " and resid 10 and name HB% )
(( segid " " and resid 6 and name HB2 ))
2.600 2.600 3.400 peak 1797 spectrum 1 weight 0.10000E+01 volume 0.18147E-02 ppm1 1.435 ppm2 2.103 CV 1
OR { 1797}
( segid " " and resid 94 and name HB% )
(( segid " " and resid 44 and name HB ))
ASSI { 1798}
( segid " " and resid 10 and name HB% )
(( segid " " and resid 9 and name HB2 ))
2.800 2.800 3.200 peak 1798 spectrum 1 weight 0.10000E+01 volume 0.13621E-02 ppm1 1.427 ppm2 1.906 CV 1
OR { 1798}
( segid " " and resid 94 and name HB% )
(( segid " " and resid 91 and name HB ))
ASSI { 1799}
( segid " " and resid 94 and name HB% )
(( segid " " and resid 46 and name HB2 ))
3.400 1.500 1.500 peak 1799 spectrum 1 weight 0.10000E+01 volume 0.15453E-02 ppm1 1.421 ppm2 1.785 CV 1
OR { 1799}
( segid " " and resid 94 and name HB% )
(( segid " " and resid 47 and name HB3 ))
OR { 1799}
( segid " " and resid 94 and name HB% )
(( segid " " and resid 47 and name HB2 ))
ASSI { 1800}
( segid " " and resid 10 and name HB% )
(( segid " " and resid 12 and name HB ))
2.400 2.400 3.600 peak 1800 spectrum 1 weight 0.10000E+01 volume 0.13413E-01 ppm1 1.434 ppm2 1.523 CV 1
OR { 1800}
( segid " " and resid 10 and name HB% )
(( segid " " and resid 12 and name HG13))
OR { 1800}
( segid " " and resid 10 and name HB% )
(( segid " " and resid 75 and name HG13))
ASSI { 1805}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 89 and name HA ))
3.700 1.700 1.700 peak 1805 spectrum 1 weight 0.10000E+01 volume 0.95642E-03 ppm1 1.143 ppm2 5.160 CV 1
OR { 1805}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 87 and name HA ))
ASSI { 1810}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 73 and name HB ))
2.900 1.000 1.000 peak 1810 spectrum 1 weight 0.10000E+01 volume 0.25928E-02 ppm1 1.143 ppm2 1.944 CV 1
OR { 1810}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 74 and name HB3 ))
OR { 1810}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 91 and name HB ))
ASSI { 1824}
( segid " " and resid 33 and name HB% )
(( segid " " and resid 75 and name HG13))
3.600 3.600 2.400 peak 1824 spectrum 1 weight 0.10000E+01 volume 0.82420E-03 ppm1 1.104 ppm2 1.547 CV 1
OR { 1824}
( segid " " and resid 33 and name HB% )
(( segid " " and resid 87 and name HG ))
ASSI { 1836}
(( segid " " and resid 79 and name HG3 ))
( segid " " and resid 33 and name HB% )
3.300 3.300 2.700 peak 1836 spectrum 1 weight 0.10000E+01 volume 0.54973E-03 ppm1 2.331 ppm2 1.113 CV 1
OR { 1836}
(( segid " " and resid 79 and name HG2 ))
( segid " " and resid 33 and name HB% )
OR { 1836}
(( segid " " and resid 79 and name HG2 ))
(( segid " " and resid 87 and name HB3 ))
OR { 1836}
(( segid " " and resid 79 and name HG3 ))
(( segid " " and resid 87 and name HB3 ))
ASSI { 1837}
( segid " " and resid 10 and name HB% )
(( segid " " and resid 10 and name HN ))
2.600 0.800 0.800 peak 1837 spectrum 1 weight 0.10000E+01 volume 0.55484E-02 ppm1 1.411 ppm2 8.292 CV 1
OR { 1837}
( segid " " and resid 10 and name HB% )
(( segid " " and resid 11 and name HN ))
ASSI { 1838}
( segid " " and resid 10 and name HB% )
(( segid " " and resid 74 and name HE21))
3.300 1.300 1.300 peak 1838 spectrum 1 weight 0.10000E+01 volume 0.15844E-02 ppm1 1.410 ppm2 7.357 CV 1
OR { 1838}
( segid " " and resid 10 and name HB% )
(( segid " " and resid 12 and name HN ))
ASSI { 1845}
( segid " " and resid 94 and name HB% )
(( segid " " and resid 45 and name HN ))
3.400 1.500 1.500 peak 1845 spectrum 1 weight 0.10000E+01 volume 0.79785E-03 ppm1 1.433 ppm2 7.851 CV 1
OR { 1845}
( segid " " and resid 94 and name HB% )
(( segid " " and resid 96 and name HN ))
ASSI { 1847}
( segid " " and resid 29 and name HG2%)
(( segid " " and resid 29 and name HN ))
3.000 1.100 1.100 peak 1847 spectrum 1 weight 0.10000E+01 volume 0.29754E-02 ppm1 0.572 ppm2 8.994 CV 1
OR { 1847}
( segid " " and resid 29 and name HG2%)
(( segid " " and resid 30 and name HN ))
ASSI { 1855}
( segid " " and resid 29 and name HG2%)
(( segid " " and resid 39 and name HA ))
4.100 2.100 1.900 peak 1855 spectrum 1 weight 0.10000E+01 volume 0.73010E-03 ppm1 0.572 ppm2 4.994 CV 1
OR { 1855}
( segid " " and resid 29 and name HG2%)
(( segid " " and resid 15 and name HA1 ))
ASSI { 1859}
( segid " " and resid 29 and name HG1%)
(( segid " " and resid 30 and name HN ))
2.800 1.000 1.000 peak 1859 spectrum 1 weight 0.10000E+01 volume 0.25752E-02 ppm1 0.565 ppm2 8.995 CV 1
OR { 1859}
( segid " " and resid 29 and name HG1%)
(( segid " " and resid 31 and name HN ))
ASSI { 1860}
( segid " " and resid 29 and name HG1%)
(( segid " " and resid 16 and name HA ))
3.500 1.500 1.500 peak 1860 spectrum 1 weight 0.10000E+01 volume 0.12474E-02 ppm1 0.564 ppm2 5.271 CV 1
OR { 1860}
( segid " " and resid 29 and name HG1%)
(( segid " " and resid 31 and name HA ))
ASSI { 1862}
(( segid " " and resid 79 and name HG2 ))
(( segid " " and resid 80 and name HB2 ))
3.200 3.200 2.800 peak 1862 spectrum 1 weight 0.10000E+01 volume 0.26739E-02 ppm1 2.341 ppm2 1.893 CV 1
OR { 1862}
(( segid " " and resid 79 and name HG3 ))
(( segid " " and resid 80 and name HB2 ))
OR { 1862}
(( segid " " and resid 79 and name HG2 ))
(( segid " " and resid 83 and name HB3 ))
OR { 1862}
(( segid " " and resid 78 and name HG3 ))
(( segid " " and resid 80 and name HB2 ))
OR { 1862}
(( segid " " and resid 79 and name HG3 ))
(( segid " " and resid 83 and name HB3 ))
ASSI { 1867}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 65 and name HN ))
3.200 1.300 1.300 peak 1867 spectrum 1 weight 0.10000E+01 volume 0.18144E-02 ppm1 0.107 ppm2 7.172 CV 1
OR { 1867}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 64 and name HN ))
ASSI { 1870}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 64 and name HN ))
2.700 0.900 0.900 peak 1870 spectrum 1 weight 0.10000E+01 volume 0.56388E-02 ppm1 0.362 ppm2 7.178 CV 1
OR { 1870}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 65 and name HN ))
ASSI { 1871}
( segid " " and resid 64 and name HG2%)
( segid " " and resid 49 and name HE% )
2.600 2.600 3.400 peak 1871 spectrum 1 weight 0.10000E+01 volume 0.20021E-02 ppm1 0.362 ppm2 7.090 CV 1
OR { 1871}
( segid " " and resid 64 and name HG2%)
( segid " " and resid 53 and name HD% )
ASSI { 1873}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 50 and name HD3 ))
2.800 2.800 3.200 peak 1873 spectrum 1 weight 0.10000E+01 volume 0.12389E-02 ppm1 0.361 ppm2 4.162 CV 1
OR { 1873}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 62 and name HA ))
OR { 1873}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 55 and name HA ))
ASSI { 1876}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 60 and name HB2 ))
3.100 1.200 1.200 peak 1876 spectrum 1 weight 0.10000E+01 volume 0.15143E-02 ppm1 0.362 ppm2 2.844 CV 1
OR { 1876}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 63 and name HB2 ))
ASSI { 1889}
( segid " " and resid 29 and name HG1%)
(( segid " " and resid 15 and name HA2 ))
2.700 0.900 0.900 peak 1889 spectrum 1 weight 0.10000E+01 volume 0.27876E-02 ppm1 0.564 ppm2 3.153 CV 1
OR { 1889}
( segid " " and resid 29 and name HG1%)
(( segid " " and resid 31 and name HB2 ))
ASSI { 1915}
( segid " " and resid 64 and name HG1%)
( segid " " and resid 89 and name HG2%)
2.300 2.300 3.700 peak 1915 spectrum 1 weight 0.10000E+01 volume 0.86342E-02 ppm1 0.106 ppm2 0.951 CV 1
OR { 1915}
( segid " " and resid 64 and name HG1%)
( segid " " and resid 93 and name HD1%)
ASSI { 1924}
( segid " " and resid 89 and name HG2%)
(( segid " " and resid 71 and name HB ))
2.700 2.700 3.300 peak 1924 spectrum 1 weight 0.10000E+01 volume 0.14792E-02 ppm1 0.973 ppm2 1.435 CV 1
OR { 1924}
( segid " " and resid 89 and name HG2%)
(( segid " " and resid 91 and name HG13))
ASSI { 1936}
( segid " " and resid 29 and name HG2%)
(( segid " " and resid 87 and name HG ))
3.600 1.600 1.600 peak 1936 spectrum 1 weight 0.10000E+01 volume 0.15739E-02 ppm1 0.571 ppm2 1.547 CV 1
OR { 1936}
( segid " " and resid 29 and name HG2%)
(( segid " " and resid 17 and name HG12))
ASSI { 1940}
( segid " " and resid 65 and name HD2%)
( segid " " and resid 93 and name HD2%)
2.400 2.400 3.600 peak 1940 spectrum 1 weight 0.10000E+01 volume 0.12362E-01 ppm1 0.618 ppm2 0.876 CV 1
OR { 1940}
( segid " " and resid 65 and name HD2%)
( segid " " and resid 72 and name HD1%)
ASSI { 1941}
( segid " " and resid 29 and name HG2%)
( segid " " and resid 17 and name HG2%)
2.100 2.100 3.900 peak 1941 spectrum 1 weight 0.10000E+01 volume 0.18793E-01 ppm1 0.573 ppm2 0.771 CV 1
OR { 1941}
( segid " " and resid 29 and name HG2%)
( segid " " and resid 75 and name HD1%)
ASSI { 1950}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 29 and name HN ))
3.900 1.900 1.900 peak 1950 spectrum 1 weight 0.10000E+01 volume 0.54384E-03 ppm1 0.597 ppm2 8.997 CV 1
OR { 1950}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 90 and name HN ))
ASSI { 1953}
( segid " " and resid 93 and name HD2%)
(( segid " " and resid 72 and name HN ))
3.500 1.500 1.500 peak 1953 spectrum 1 weight 0.10000E+01 volume 0.83111E-03 ppm1 0.867 ppm2 7.289 CV 1
OR { 1953}
( segid " " and resid 93 and name HD2%)
( segid " " and resid 48 and name HD% )
ASSI { 1959}
(( segid " " and resid 25 and name HG3 ))
( segid " " and resid 41 and name HD2%)
3.200 1.300 1.300 peak 1959 spectrum 1 weight 0.10000E+01 volume 0.13909E-02 ppm1 2.308 ppm2 0.889 CV 1
OR { 1959}
(( segid " " and resid 25 and name HG2 ))
( segid " " and resid 41 and name HD2%)
OR { 1959}
(( segid " " and resid 25 and name HG3 ))
( segid " " and resid 61 and name HG2%)
ASSI { 1963}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 87 and name HA ))
3.900 1.900 1.900 peak 1963 spectrum 1 weight 0.10000E+01 volume 0.91468E-03 ppm1 0.613 ppm2 5.132 CV 1
OR { 1963}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 37 and name HA1 ))
ASSI { 1965}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 89 and name HA ))
3.900 1.900 1.900 peak 1965 spectrum 1 weight 0.10000E+01 volume 0.93788E-03 ppm1 0.611 ppm2 5.173 CV 1
OR { 1965}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 87 and name HA ))
ASSI { 1967}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 38 and name HA ))
4.100 2.100 1.900 peak 1967 spectrum 1 weight 0.10000E+01 volume 0.61874E-03 ppm1 0.607 ppm2 4.644 CV 1
OR { 1967}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 26 and name HA ))
ASSI { 1968}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 40 and name HD3 ))
3.600 1.600 1.600 peak 1968 spectrum 1 weight 0.10000E+01 volume 0.17023E-02 ppm1 0.610 ppm2 3.817 CV 1
OR { 1968}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 44 and name HA ))
ASSI { 1975}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 26 and name HA ))
4.500 2.500 1.500 peak 1975 spectrum 1 weight 0.10000E+01 volume 0.53580E-03 ppm1 0.797 ppm2 4.653 CV 1
OR { 1975}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 58 and name HA ))
ASSI { 1979}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 61 and name HA ))
2.900 1.000 1.000 peak 1979 spectrum 1 weight 0.10000E+01 volume 0.27587E-02 ppm1 0.794 ppm2 3.797 CV 1
OR { 1979}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 44 and name HA ))
ASSI { 1984}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 40 and name HD2 ))
3.800 1.800 1.800 peak 1984 spectrum 1 weight 0.10000E+01 volume 0.11624E-02 ppm1 0.606 ppm2 3.904 CV 1
OR { 1984}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 41 and name HA ))
ASSI { 1989}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 43 and name HG3 ))
4.100 2.100 1.900 peak 1989 spectrum 1 weight 0.10000E+01 volume 0.72428E-03 ppm1 0.608 ppm2 2.187 CV 1
OR { 1989}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 40 and name HG3 ))
OR { 1989}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 40 and name HG2 ))
ASSI { 1990}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 41 and name HB2 ))
3.600 1.600 1.600 peak 1990 spectrum 1 weight 0.10000E+01 volume 0.10807E-02 ppm1 0.613 ppm2 1.397 CV 1
OR { 1990}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 65 and name HG ))
OR { 1990}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 65 and name HB2 ))
OR { 1990}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 91 and name HG13))
ASSI { 1993}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 73 and name HB ))
3.300 1.400 1.400 peak 1993 spectrum 1 weight 0.10000E+01 volume 0.16212E-02 ppm1 0.608 ppm2 1.945 CV 1
OR { 1993}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 43 and name HB3 ))
ASSI { 1997}
( segid " " and resid 39 and name HD1%)
( segid " " and resid 75 and name HD1%)
2.700 2.700 3.300 peak 1997 spectrum 1 weight 0.10000E+01 volume 0.68555E-02 ppm1 0.610 ppm2 0.793 CV 1
OR { 1997}
( segid " " and resid 39 and name HD1%)
( segid " " and resid 41 and name HD1%)
OR { 1997}
( segid " " and resid 39 and name HD1%)
( segid " " and resid 12 and name HD1%)
ASSI { 2000}
( segid " " and resid 93 and name HD2%)
(( segid " " and resid 14 and name HE2 ))
3.100 3.100 2.900 peak 2000 spectrum 1 weight 0.10000E+01 volume 0.70396E-03 ppm1 0.864 ppm2 2.979 CV 1
OR { 2000}
( segid " " and resid 93 and name HD2%)
(( segid " " and resid 14 and name HE3 ))
OR { 2000}
( segid " " and resid 93 and name HD2%)
(( segid " " and resid 46 and name HD2 ))
ASSI { 2001}
( segid " " and resid 93 and name HD2%)
(( segid " " and resid 70 and name HB2 ))
2.600 2.600 3.400 peak 2001 spectrum 1 weight 0.10000E+01 volume 0.20560E-02 ppm1 0.864 ppm2 2.051 CV 1
OR { 2001}
( segid " " and resid 93 and name HD2%)
(( segid " " and resid 69 and name HB3 ))
ASSI { 2008}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 59 and name HG2 ))
2.700 0.900 0.900 peak 2008 spectrum 1 weight 0.10000E+01 volume 0.30064E-02 ppm1 0.794 ppm2 2.001 CV 1
OR { 2008}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 41 and name HB3 ))
OR { 2008}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 59 and name HG3 ))
ASSI { 2011}
( segid " " and resid 93 and name HD2%)
(( segid " " and resid 71 and name HB ))
2.900 1.100 1.100 peak 2011 spectrum 1 weight 0.10000E+01 volume 0.23453E-02 ppm1 0.864 ppm2 1.417 CV 1
OR { 2011}
( segid " " and resid 93 and name HD2%)
( segid " " and resid 94 and name HB% )
ASSI { 2014}
( segid " " and resid 41 and name HD1%)
( segid " " and resid 44 and name HD1%)
2.100 0.500 0.500 peak 2014 spectrum 1 weight 0.10000E+01 volume 0.13602E-01 ppm1 0.793 ppm2 0.597 CV 1
OR { 2014}
( segid " " and resid 41 and name HD1%)
( segid " " and resid 61 and name HD1%)
ASSI { 2018}
( segid " " and resid 93 and name HD2%)
( segid " " and resid 65 and name HD2%)
1.700 1.700 4.300 peak 2018 spectrum 1 weight 0.10000E+01 volume 0.21101E-01 ppm1 0.884 ppm2 0.629 CV 1
OR { 2018}
( segid " " and resid 93 and name HD2%)
( segid " " and resid 39 and name HD1%)
ASSI { 2028}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 29 and name HB ))
3.300 1.400 1.400 peak 2028 spectrum 1 weight 0.10000E+01 volume 0.17339E-02 ppm1 1.010 ppm2 1.663 CV 1
OR { 2028}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 16 and name HB2 ))
OR { 2028}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 16 and name HB3 ))
ASSI { 2036}
( segid " " and resid 93 and name HD1%)
(( segid " " and resid 14 and name HB2 ))
3.100 3.100 2.900 peak 2036 spectrum 1 weight 0.10000E+01 volume 0.10067E-02 ppm1 0.947 ppm2 1.865 CV 1
OR { 2036}
( segid " " and resid 5 and name HD1%)
(( segid " " and resid 9 and name HB2 ))
OR { 2036}
( segid " " and resid 93 and name HD1%)
(( segid " " and resid 44 and name HG12))
ASSI { 2041}
(( segid " " and resid 79 and name HG2 ))
(( segid " " and resid 35 and name HB2 ))
3.200 1.300 1.300 peak 2041 spectrum 1 weight 0.10000E+01 volume 0.15074E-02 ppm1 2.324 ppm2 1.619 CV 1
OR { 2041}
(( segid " " and resid 79 and name HG3 ))
(( segid " " and resid 35 and name HB2 ))
OR { 2041}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 35 and name HB2 ))
OR { 2041}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 41 and name HG ))
ASSI { 2046}
(( segid " " and resid 78 and name HG3 ))
( segid " " and resid 86 and name HB% )
3.300 1.400 1.400 peak 2046 spectrum 1 weight 0.10000E+01 volume 0.16389E-02 ppm1 2.342 ppm2 1.687 CV 1
OR { 2046}
(( segid " " and resid 78 and name HG2 ))
( segid " " and resid 86 and name HB% )
OR { 2046}
(( segid " " and resid 79 and name HG2 ))
(( segid " " and resid 80 and name HG2 ))
OR { 2046}
(( segid " " and resid 79 and name HG2 ))
( segid " " and resid 86 and name HB% )
OR { 2046}
(( segid " " and resid 79 and name HG3 ))
(( segid " " and resid 80 and name HG2 ))
ASSI { 2052}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 39 and name HB3 ))
2.500 0.800 0.800 peak 2052 spectrum 1 weight 0.10000E+01 volume 0.60564E-02 ppm1 0.542 ppm2 1.676 CV 1
OR { 2052}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 29 and name HB ))
ASSI { 2055}
( segid " " and resid 87 and name HD1%)
( segid " " and resid 89 and name HG2%)
2.300 2.300 3.700 peak 2055 spectrum 1 weight 0.10000E+01 volume 0.13571E-01 ppm1 0.544 ppm2 0.950 CV 1
OR { 2055}
( segid " " and resid 65 and name HD1%)
( segid " " and resid 89 and name HG2%)
OR { 2055}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 75 and name HG12))
ASSI { 2056}
( segid " " and resid 65 and name HD1%)
( segid " " and resid 44 and name HG2%)
2.100 2.100 3.900 peak 2056 spectrum 1 weight 0.10000E+01 volume 0.77554E-02 ppm1 0.543 ppm2 0.852 CV 1
OR { 2056}
( segid " " and resid 65 and name HD1%)
( segid " " and resid 61 and name HG2%)
OR { 2056}
( segid " " and resid 65 and name HD1%)
( segid " " and resid 93 and name HD2%)
ASSI { 2060}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 65 and name HB3 ))
2.300 0.700 0.700 peak 2060 spectrum 1 weight 0.10000E+01 volume 0.82721E-02 ppm1 0.545 ppm2 1.174 CV 1
OR { 2060}
( segid " " and resid 65 and name HD1%)
( segid " " and resid 27 and name HB% )
ASSI { 2061}
( segid " " and resid 87 and name HD1%)
( segid " " and resid 71 and name HG2%)
2.200 2.200 3.800 peak 2061 spectrum 1 weight 0.10000E+01 volume 0.99454E-02 ppm1 0.545 ppm2 0.355 CV 1
OR { 2061}
( segid " " and resid 65 and name HD1%)
( segid " " and resid 71 and name HG2%)
ASSI { 2092}
(( segid " " and resid 20 and name HG13))
(( segid " " and resid 19 and name HG3 ))
4.400 2.400 1.600 peak 2092 spectrum 1 weight 0.10000E+01 volume 0.51724E-03 ppm1 0.819 ppm2 1.575 CV 1
OR { 2092}
(( segid " " and resid 20 and name HG13))
(( segid " " and resid 66 and name HG2 ))
ASSI { 2098}
(( segid " " and resid 20 and name HG13))
( segid " " and resid 61 and name HD1%)
3.500 1.600 1.600 peak 2098 spectrum 1 weight 0.10000E+01 volume 0.23409E-02 ppm1 0.822 ppm2 0.575 CV 1
OR { 2098}
(( segid " " and resid 20 and name HG13))
( segid " " and resid 65 and name HD1%)
ASSI { 2133}
(( segid " " and resid 17 and name HG13))
( segid " " and resid 17 and name HD1%)
2.700 0.900 0.900 peak 2133 spectrum 1 weight 0.10000E+01 volume 0.26685E-02 ppm1 1.332 ppm2 0.555 CV 1
OR { 2133}
(( segid " " and resid 17 and name HG13))
( segid " " and resid 65 and name HD1%)
ASSI { 2148}
(( segid " " and resid 72 and name HG12))
(( segid " " and resid 73 and name HN ))
4.500 2.600 1.500 peak 2148 spectrum 1 weight 0.10000E+01 volume 0.49284E-03 ppm1 1.274 ppm2 9.054 CV 1
OR { 2148}
(( segid " " and resid 72 and name HG12))
(( segid " " and resid 15 and name HN ))
ASSI { 2153}
(( segid " " and resid 65 and name HG ))
(( segid " " and resid 65 and name HN ))
3.500 1.600 1.600 peak 2153 spectrum 1 weight 0.10000E+01 volume 0.54753E-03 ppm1 1.393 ppm2 7.154 CV 1
OR { 2153}
(( segid " " and resid 65 and name HG ))
(( segid " " and resid 64 and name HN ))
ASSI { 2161}
(( segid " " and resid 87 and name HG ))
(( segid " " and resid 87 and name HA ))
3.800 1.800 1.800 peak 2161 spectrum 1 weight 0.10000E+01 volume 0.49781E-03 ppm1 1.509 ppm2 5.151 CV 1
OR { 2161}
(( segid " " and resid 87 and name HG ))
(( segid " " and resid 37 and name HA1 ))
ASSI { 2163}
(( segid " " and resid 17 and name HG12))
(( segid " " and resid 29 and name HA ))
4.700 2.700 1.300 peak 2163 spectrum 1 weight 0.10000E+01 volume 0.47371E-03 ppm1 1.558 ppm2 4.660 CV 1
OR { 2163}
(( segid " " and resid 17 and name HG12))
(( segid " " and resid 71 and name HA ))
OR { 2163}
(( segid " " and resid 17 and name HG12))
(( segid " " and resid 26 and name HA ))
ASSI { 2166}
(( segid " " and resid 19 and name HG3 ))
(( segid " " and resid 21 and name HG3 ))
3.500 1.500 1.500 peak 2166 spectrum 1 weight 0.10000E+01 volume 0.11352E-02 ppm1 1.563 ppm2 2.352 CV 1
OR { 2166}
(( segid " " and resid 19 and name HG3 ))
(( segid " " and resid 21 and name HG2 ))
OR { 2166}
(( segid " " and resid 35 and name HG2 ))
(( segid " " and resid 79 and name HG2 ))
OR { 2166}
(( segid " " and resid 35 and name HG2 ))
(( segid " " and resid 79 and name HG3 ))
ASSI { 2174}
(( segid " " and resid 46 and name HG2 ))
(( segid " " and resid 47 and name HA ))
3.900 1.900 1.900 peak 2174 spectrum 1 weight 0.10000E+01 volume 0.63370E-03 ppm1 1.574 ppm2 4.091 CV 1
OR { 2174}
(( segid " " and resid 46 and name HG3 ))
(( segid " " and resid 47 and name HA ))
OR { 2174}
(( segid " " and resid 46 and name HG3 ))
(( segid " " and resid 45 and name HA ))
OR { 2174}
(( segid " " and resid 46 and name HG2 ))
(( segid " " and resid 45 and name HA ))
ASSI { 2178}
(( segid " " and resid 35 and name HG2 ))
(( segid " " and resid 34 and name HG3 ))
3.600 1.600 1.600 peak 2178 spectrum 1 weight 0.10000E+01 volume 0.15001E-02 ppm1 1.576 ppm2 2.248 CV 1
OR { 2178}
(( segid " " and resid 66 and name HG2 ))
(( segid " " and resid 67 and name HG3 ))
OR { 2178}
(( segid " " and resid 66 and name HG3 ))
(( segid " " and resid 67 and name HG3 ))
OR { 2178}
(( segid " " and resid 66 and name HG2 ))
(( segid " " and resid 67 and name HG2 ))
ASSI { 2179}
(( segid " " and resid 17 and name HG12))
( segid " " and resid 17 and name HD1%)
2.500 0.800 0.800 peak 2179 spectrum 1 weight 0.10000E+01 volume 0.31565E-02 ppm1 1.526 ppm2 0.556 CV 1
OR { 2179}
(( segid " " and resid 17 and name HG12))
( segid " " and resid 65 and name HD1%)
ASSI { 2188}
(( segid " " and resid 72 and name HG13))
( segid " " and resid 45 and name HB% )
3.400 3.400 2.600 peak 2188 spectrum 1 weight 0.10000E+01 volume 0.19330E-02 ppm1 1.637 ppm2 1.151 CV 1
OR { 2188}
(( segid " " and resid 72 and name HG13))
( segid " " and resid 88 and name HG2%)
ASSI { 2196}
(( segid " " and resid 41 and name HG ))
( segid " " and resid 44 and name HD1%)
3.700 1.700 1.700 peak 2196 spectrum 1 weight 0.10000E+01 volume 0.16162E-02 ppm1 1.634 ppm2 0.586 CV 1
OR { 2196}
(( segid " " and resid 41 and name HG ))
( segid " " and resid 61 and name HD1%)
ASSI { 2207}
(( segid " " and resid 80 and name HG2 ))
(( segid " " and resid 79 and name HG2 ))
3.600 1.600 1.600 peak 2207 spectrum 1 weight 0.10000E+01 volume 0.11476E-02 ppm1 1.687 ppm2 2.322 CV 1
OR { 2207}
(( segid " " and resid 80 and name HG2 ))
(( segid " " and resid 79 and name HG3 ))
OR { 2207}
(( segid " " and resid 5 and name HG ))
(( segid " " and resid 6 and name HG3 ))
ASSI { 2215}
(( segid " " and resid 17 and name HG12))
(( segid " " and resid 18 and name HN ))
4.800 2.900 1.200 peak 2215 spectrum 1 weight 0.10000E+01 volume 0.45058E-03 ppm1 1.540 ppm2 9.230 CV 1
OR { 2215}
(( segid " " and resid 17 and name HG12))
(( segid " " and resid 68 and name HN ))
ASSI { 2217}
(( segid " " and resid 72 and name HG13))
(( segid " " and resid 73 and name HN ))
4.800 2.900 1.200 peak 2217 spectrum 1 weight 0.10000E+01 volume 0.44607E-03 ppm1 1.627 ppm2 9.053 CV 1
OR { 2217}
(( segid " " and resid 72 and name HG13))
(( segid " " and resid 15 and name HN ))
ASSI { 2249}
(( segid " " and resid 16 and name HG2 ))
(( segid " " and resid 16 and name HA ))
3.100 1.200 1.200 peak 2249 spectrum 1 weight 0.10000E+01 volume 0.14755E-02 ppm1 1.365 ppm2 5.251 CV 1
OR { 2249}
(( segid " " and resid 16 and name HG2 ))
(( segid " " and resid 70 and name HA ))
ASSI { 2250}
(( segid " " and resid 16 and name HG3 ))
(( segid " " and resid 16 and name HA ))
2.900 1.000 1.000 peak 2250 spectrum 1 weight 0.10000E+01 volume 0.14855E-02 ppm1 1.323 ppm2 5.251 CV 1
OR { 2250}
(( segid " " and resid 16 and name HG3 ))
(( segid " " and resid 70 and name HA ))
ASSI { 2257}
(( segid " " and resid 14 and name HG2 ))
( segid " " and resid 72 and name HD1%)
3.100 1.200 1.200 peak 2257 spectrum 1 weight 0.10000E+01 volume 0.17819E-02 ppm1 1.466 ppm2 0.885 CV 1
OR { 2257}
(( segid " " and resid 62 and name HG3 ))
( segid " " and resid 61 and name HG2%)
ASSI { 2258}
(( segid " " and resid 14 and name HG2 ))
( segid " " and resid 73 and name HG2%)
4.100 2.100 1.900 peak 2258 spectrum 1 weight 0.10000E+01 volume 0.61923E-03 ppm1 1.459 ppm2 0.576 CV 1
OR { 2258}
(( segid " " and resid 62 and name HG3 ))
( segid " " and resid 61 and name HD1%)
OR { 2258}
(( segid " " and resid 14 and name HG2 ))
( segid " " and resid 29 and name HG1%)
OR { 2258}
(( segid " " and resid 14 and name HG2 ))
( segid " " and resid 73 and name HG1%)
ASSI { 2262}
(( segid " " and resid 16 and name HG2 ))
(( segid " " and resid 70 and name HG3 ))
4.100 2.100 1.900 peak 2262 spectrum 1 weight 0.10000E+01 volume 0.95088E-03 ppm1 1.370 ppm2 2.134 CV 1
OR { 2262}
(( segid " " and resid 14 and name HG3 ))
(( segid " " and resid 70 and name HG3 ))
ASSI { 2264}
(( segid " " and resid 16 and name HG2 ))
(( segid " " and resid 16 and name HD3 ))
2.000 0.500 0.500 peak 2264 spectrum 1 weight 0.10000E+01 volume 0.14934E-01 ppm1 1.392 ppm2 1.708 CV 1
OR { 2264}
(( segid " " and resid 14 and name HG3 ))
(( segid " " and resid 14 and name HD2 ))
OR { 2264}
(( segid " " and resid 14 and name HG3 ))
(( segid " " and resid 14 and name HB3 ))
OR { 2264}
(( segid " " and resid 14 and name HG3 ))
(( segid " " and resid 14 and name HD3 ))
ASSI { 2269}
(( segid " " and resid 8 and name HG2 ))
(( segid " " and resid 8 and name HA ))
2.700 0.900 0.900 peak 2269 spectrum 1 weight 0.10000E+01 volume 0.48030E-02 ppm1 1.484 ppm2 4.343 CV 1
OR { 2269}
(( segid " " and resid 8 and name HG3 ))
(( segid " " and resid 8 and name HA ))
OR { 2269}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 9 and name HA ))
OR { 2269}
(( segid " " and resid 9 and name HG3 ))
(( segid " " and resid 9 and name HA ))
ASSI { 2273}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 6 and name HG2 ))
3.700 1.700 1.700 peak 2273 spectrum 1 weight 0.10000E+01 volume 0.78026E-03 ppm1 1.479 ppm2 2.330 CV 1
OR { 2273}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 6 and name HG3 ))
OR { 2273}
(( segid " " and resid 9 and name HG3 ))
(( segid " " and resid 6 and name HG3 ))
OR { 2273}
(( segid " " and resid 9 and name HG3 ))
(( segid " " and resid 6 and name HG2 ))
OR { 2273}
(( segid " " and resid 77 and name HG2 ))
(( segid " " and resid 76 and name HB2 ))
OR { 2273}
(( segid " " and resid 77 and name HG3 ))
(( segid " " and resid 76 and name HB2 ))
ASSI { 2275}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 9 and name HD3 ))
1.600 0.300 0.600 peak 2275 spectrum 1 weight 0.10000E+01 volume 0.63114E-01 ppm1 1.471 ppm2 1.732 CV 1
OR { 2275}
(( segid " " and resid 77 and name HG2 ))
(( segid " " and resid 77 and name HD2 ))
OR { 2275}
(( segid " " and resid 77 and name HG3 ))
(( segid " " and resid 77 and name HD3 ))
OR { 2275}
(( segid " " and resid 9 and name HG3 ))
(( segid " " and resid 9 and name HD2 ))
OR { 2275}
(( segid " " and resid 77 and name HG3 ))
(( segid " " and resid 77 and name HD2 ))
OR { 2275}
(( segid " " and resid 77 and name HG2 ))
(( segid " " and resid 77 and name HD3 ))
OR { 2275}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 9 and name HD2 ))
ASSI { 2282}
(( segid " " and resid 42 and name HG2 ))
(( segid " " and resid 43 and name HG3 ))
3.700 1.700 1.700 peak 2282 spectrum 1 weight 0.10000E+01 volume 0.19050E-02 ppm1 1.551 ppm2 2.197 CV 1
OR { 2282}
(( segid " " and resid 42 and name HG3 ))
(( segid " " and resid 43 and name HG3 ))
OR { 2282}
(( segid " " and resid 42 and name HG2 ))
(( segid " " and resid 40 and name HG3 ))
OR { 2282}
(( segid " " and resid 42 and name HG3 ))
(( segid " " and resid 40 and name HG2 ))
OR { 2282}
(( segid " " and resid 42 and name HG2 ))
(( segid " " and resid 40 and name HG2 ))
ASSI { 2285}
(( segid " " and resid 62 and name HG3 ))
(( segid " " and resid 62 and name HA ))
3.900 1.900 1.900 peak 2285 spectrum 1 weight 0.10000E+01 volume 0.10383E-02 ppm1 1.455 ppm2 4.182 CV 1
OR { 2285}
(( segid " " and resid 62 and name HG3 ))
(( segid " " and resid 22 and name HA ))
ASSI { 2307}
(( segid " " and resid 59 and name HG3 ))
( segid " " and resid 94 and name HB% )
3.500 3.500 2.500 peak 2307 spectrum 1 weight 0.10000E+01 volume 0.45259E-03 ppm1 1.990 ppm2 1.439 CV 1
OR { 2307}
(( segid " " and resid 59 and name HG2 ))
( segid " " and resid 94 and name HB% )
OR { 2307}
(( segid " " and resid 59 and name HG2 ))
(( segid " " and resid 62 and name HG3 ))
OR { 2307}
(( segid " " and resid 59 and name HG2 ))
(( segid " " and resid 20 and name HG12))
ASSI { 2310}
(( segid " " and resid 59 and name HG2 ))
(( segid " " and resid 44 and name HG12))
2.700 2.700 3.300 peak 2310 spectrum 1 weight 0.10000E+01 volume 0.12257E-01 ppm1 2.001 ppm2 1.866 CV 1
OR { 2310}
(( segid " " and resid 59 and name HG3 ))
(( segid " " and resid 44 and name HG12))
OR { 2310}
(( segid " " and resid 59 and name HG2 ))
(( segid " " and resid 58 and name HB2 ))
ASSI { 2313}
(( segid " " and resid 44 and name HG12))
(( segid " " and resid 42 and name HG2 ))
3.500 3.500 2.500 peak 2313 spectrum 1 weight 0.10000E+01 volume 0.10278E-02 ppm1 1.858 ppm2 1.531 CV 1
OR { 2313}
(( segid " " and resid 44 and name HG12))
(( segid " " and resid 17 and name HG12))
OR { 2313}
(( segid " " and resid 44 and name HG12))
(( segid " " and resid 87 and name HB2 ))
ASSI { 2319}
(( segid " " and resid 44 and name HG12))
(( segid " " and resid 59 and name HG2 ))
2.900 2.900 3.100 peak 2319 spectrum 1 weight 0.10000E+01 volume 0.84090E-02 ppm1 1.845 ppm2 2.003 CV 1
OR { 2319}
(( segid " " and resid 44 and name HG12))
(( segid " " and resid 41 and name HB3 ))
OR { 2319}
(( segid " " and resid 44 and name HG12))
(( segid " " and resid 59 and name HG3 ))
ASSI { 2320}
(( segid " " and resid 44 and name HG12))
(( segid " " and resid 41 and name HB2 ))
3.800 1.800 1.800 peak 2320 spectrum 1 weight 0.10000E+01 volume 0.11201E-02 ppm1 1.841 ppm2 1.401 CV 1
OR { 2320}
(( segid " " and resid 44 and name HG12))
(( segid " " and resid 65 and name HG ))
ASSI { 2321}
(( segid " " and resid 44 and name HG12))
(( segid " " and resid 39 and name HG ))
4.000 2.000 2.000 peak 2321 spectrum 1 weight 0.10000E+01 volume 0.86232E-03 ppm1 1.836 ppm2 1.192 CV 1
OR { 2321}
(( segid " " and resid 44 and name HG12))
(( segid " " and resid 65 and name HB3 ))
ASSI { 2325}
(( segid " " and resid 44 and name HG12))
( segid " " and resid 39 and name HD2%)
3.500 1.500 1.500 peak 2325 spectrum 1 weight 0.10000E+01 volume 0.74824E-03 ppm1 1.840 ppm2 0.339 CV 1
OR { 2325}
(( segid " " and resid 44 and name HG12))
( segid " " and resid 64 and name HG2%)
ASSI { 2329}
(( segid " " and resid 25 and name HB3 ))
( segid " " and resid 26 and name HB% )
4.600 2.600 1.400 peak 2329 spectrum 1 weight 0.10000E+01 volume 0.41200E-03 ppm1 2.205 ppm2 0.587 CV 1
OR { 2329}
(( segid " " and resid 25 and name HB3 ))
( segid " " and resid 61 and name HD1%)
ASSI { 2337}
(( segid " " and resid 6 and name HG2 ))
(( segid " " and resid 6 and name HB3 ))
1.700 0.400 0.500 peak 2337 spectrum 1 weight 0.10000E+01 volume 0.49308E-01 ppm1 2.321 ppm2 2.038 CV 1
OR { 2337}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 34 and name HB3 ))
OR { 2337}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 34 and name HB2 ))
OR { 2337}
(( segid " " and resid 79 and name HG3 ))
(( segid " " and resid 79 and name HB2 ))
OR { 2337}
(( segid " " and resid 6 and name HG3 ))
(( segid " " and resid 6 and name HB3 ))
ASSI { 2343}
(( segid " " and resid 20 and name HG12))
(( segid " " and resid 17 and name HG13))
3.000 1.100 1.100 peak 2343 spectrum 1 weight 0.10000E+01 volume 0.22662E-02 ppm1 1.455 ppm2 1.351 CV 1
OR { 2343}
(( segid " " and resid 20 and name HG12))
(( segid " " and resid 65 and name HB2 ))
ASSI { 2348}
(( segid " " and resid 20 and name HG12))
( segid " " and resid 61 and name HD1%)
2.900 1.100 1.100 peak 2348 spectrum 1 weight 0.10000E+01 volume 0.22353E-02 ppm1 1.449 ppm2 0.572 CV 1
OR { 2348}
(( segid " " and resid 20 and name HG12))
( segid " " and resid 65 and name HD1%)
ASSI { 2349}
(( segid " " and resid 16 and name HD3 ))
(( segid " " and resid 70 and name HA ))
3.800 1.800 1.800 peak 2349 spectrum 1 weight 0.10000E+01 volume 0.10871E-02 ppm1 1.708 ppm2 5.250 CV 1
OR { 2349}
(( segid " " and resid 16 and name HD3 ))
(( segid " " and resid 16 and name HA ))
OR { 2349}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 16 and name HA ))
OR { 2349}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 70 and name HA ))
ASSI { 2350}
(( segid " " and resid 14 and name HD3 ))
(( segid " " and resid 72 and name HA ))
3.800 1.800 1.800 peak 2350 spectrum 1 weight 0.10000E+01 volume 0.82372E-03 ppm1 1.725 ppm2 4.886 CV 1
OR { 2350}
(( segid " " and resid 14 and name HD2 ))
(( segid " " and resid 72 and name HA ))
OR { 2350}
(( segid " " and resid 14 and name HD2 ))
(( segid " " and resid 13 and name HA ))
ASSI { 2351}
(( segid " " and resid 14 and name HD3 ))
(( segid " " and resid 71 and name HA ))
3.900 1.900 1.900 peak 2351 spectrum 1 weight 0.10000E+01 volume 0.62084E-03 ppm1 1.720 ppm2 4.657 CV 1
OR { 2351}
(( segid " " and resid 14 and name HD2 ))
(( segid " " and resid 71 and name HA ))
OR { 2351}
(( segid " " and resid 9 and name HD3 ))
(( segid " " and resid 11 and name HA ))
OR { 2351}
(( segid " " and resid 9 and name HD2 ))
(( segid " " and resid 11 and name HA ))
OR { 2351}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 29 and name HA ))
OR { 2351}
(( segid " " and resid 16 and name HD3 ))
(( segid " " and resid 71 and name HA ))
OR { 2351}
(( segid " " and resid 16 and name HD3 ))
(( segid " " and resid 29 and name HA ))
ASSI { 2352}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 45 and name HA ))
4.600 2.600 1.400 peak 2352 spectrum 1 weight 0.10000E+01 volume 0.45343E-03 ppm1 1.791 ppm2 4.098 CV 1
OR { 2352}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 47 and name HA ))
ASSI { 2354}
(( segid " " and resid 62 and name HD2 ))
(( segid " " and resid 22 and name HA ))
3.400 1.500 1.500 peak 2354 spectrum 1 weight 0.10000E+01 volume 0.12274E-02 ppm1 1.724 ppm2 4.190 CV 1
OR { 2354}
(( segid " " and resid 62 and name HD3 ))
(( segid " " and resid 62 and name HA ))
OR { 2354}
(( segid " " and resid 62 and name HD2 ))
(( segid " " and resid 62 and name HA ))
OR { 2354}
(( segid " " and resid 46 and name HB3 ))
(( segid " " and resid 51 and name HA ))
ASSI { 2355}
(( segid " " and resid 62 and name HD2 ))
(( segid " " and resid 22 and name HD2 ))
3.500 1.500 1.500 peak 2355 spectrum 1 weight 0.10000E+01 volume 0.45524E-03 ppm1 1.724 ppm2 3.914 CV 1
OR { 2355}
(( segid " " and resid 62 and name HD3 ))
(( segid " " and resid 22 and name HD2 ))
OR { 2355}
(( segid " " and resid 46 and name HB3 ))
(( segid " " and resid 96 and name HB2 ))
OR { 2355}
(( segid " " and resid 46 and name HB3 ))
(( segid " " and resid 96 and name HB3 ))
OR { 2355}
(( segid " " and resid 46 and name HB3 ))
(( segid " " and resid 92 and name HB3 ))
ASSI { 2356}
(( segid " " and resid 62 and name HD3 ))
( segid " " and resid 61 and name HD1%)
4.100 2.100 1.900 peak 2356 spectrum 1 weight 0.10000E+01 volume 0.46856E-03 ppm1 1.718 ppm2 0.574 CV 1
OR { 2356}
(( segid " " and resid 14 and name HD3 ))
( segid " " and resid 73 and name HG2%)
OR { 2356}
(( segid " " and resid 16 and name HD3 ))
( segid " " and resid 29 and name HG1%)
OR { 2356}
(( segid " " and resid 16 and name HD2 ))
( segid " " and resid 29 and name HG1%)
OR { 2356}
(( segid " " and resid 14 and name HD2 ))
( segid " " and resid 73 and name HG2%)
OR { 2356}
(( segid " " and resid 14 and name HD2 ))
( segid " " and resid 29 and name HG1%)
OR { 2356}
(( segid " " and resid 14 and name HD3 ))
( segid " " and resid 29 and name HG1%)
OR { 2356}
(( segid " " and resid 14 and name HD3 ))
( segid " " and resid 73 and name HG1%)
OR { 2356}
(( segid " " and resid 14 and name HD2 ))
( segid " " and resid 73 and name HG1%)
OR { 2356}
(( segid " " and resid 62 and name HD3 ))
( segid " " and resid 44 and name HD1%)
OR { 2356}
(( segid " " and resid 16 and name HD2 ))
( segid " " and resid 29 and name HG2%)
OR { 2356}
(( segid " " and resid 14 and name HD3 ))
( segid " " and resid 29 and name HG2%)
OR { 2356}
(( segid " " and resid 16 and name HD3 ))
( segid " " and resid 29 and name HG2%)
OR { 2356}
(( segid " " and resid 14 and name HD2 ))
( segid " " and resid 29 and name HG2%)
OR { 2356}
(( segid " " and resid 62 and name HD3 ))
( segid " " and resid 65 and name HD1%)
OR { 2356}
(( segid " " and resid 46 and name HB3 ))
( segid " " and resid 44 and name HD1%)
ASSI { 2358}
(( segid " " and resid 9 and name HD3 ))
(( segid " " and resid 9 and name HG2 ))
1.500 0.300 0.700 peak 2358 spectrum 1 weight 0.10000E+01 volume 0.10576E+00 ppm1 1.731 ppm2 1.497 CV 1
OR { 2358}
(( segid " " and resid 14 and name HD3 ))
(( segid " " and resid 14 and name HG2 ))
OR { 2358}
(( segid " " and resid 77 and name HD2 ))
(( segid " " and resid 77 and name HG2 ))
OR { 2358}
(( segid " " and resid 77 and name HD3 ))
(( segid " " and resid 77 and name HG3 ))
OR { 2358}
(( segid " " and resid 14 and name HD2 ))
(( segid " " and resid 14 and name HG2 ))
OR { 2358}
(( segid " " and resid 77 and name HD2 ))
(( segid " " and resid 77 and name HG3 ))
OR { 2358}
(( segid " " and resid 77 and name HD3 ))
(( segid " " and resid 77 and name HG2 ))
OR { 2358}
(( segid " " and resid 9 and name HD2 ))
(( segid " " and resid 9 and name HG2 ))
ASSI { 2367}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 9 and name HD2 ))
3.500 1.500 1.500 peak 2367 spectrum 1 weight 0.10000E+01 volume 0.14024E-02 ppm1 2.073 ppm2 1.707 CV 1
OR { 2367}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 9 and name HD3 ))
OR { 2367}
(( segid " " and resid 69 and name HB3 ))
(( segid " " and resid 66 and name HB3 ))
ASSI { 2369}
(( segid " " and resid 78 and name HB3 ))
(( segid " " and resid 77 and name HA ))
4.300 2.300 1.700 peak 2369 spectrum 1 weight 0.10000E+01 volume 0.69978E-03 ppm1 2.008 ppm2 4.549 CV 1
OR { 2369}
(( segid " " and resid 79 and name HB2 ))
(( segid " " and resid 80 and name HA ))
ASSI { 2373}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 9 and name HB3 ))
3.100 3.100 2.900 peak 2373 spectrum 1 weight 0.10000E+01 volume 0.19677E-02 ppm1 2.002 ppm2 1.801 CV 1
OR { 2373}
(( segid " " and resid 79 and name HB2 ))
(( segid " " and resid 80 and name HB3 ))
ASSI { 2375}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 9 and name HD2 ))
3.400 1.500 1.500 peak 2375 spectrum 1 weight 0.10000E+01 volume 0.14785E-02 ppm1 2.008 ppm2 1.704 CV 1
OR { 2375}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 9 and name HD3 ))
OR { 2375}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 5 and name HB2 ))
OR { 2375}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 5 and name HB3 ))
ASSI { 2376}
(( segid " " and resid 78 and name HB2 ))
( segid " " and resid 85 and name HB% )
4.300 2.300 1.700 peak 2376 spectrum 1 weight 0.10000E+01 volume 0.52464E-03 ppm1 2.142 ppm2 1.484 CV 1
OR { 2376}
(( segid " " and resid 78 and name HB2 ))
(( segid " " and resid 77 and name HG2 ))
OR { 2376}
(( segid " " and resid 78 and name HB2 ))
(( segid " " and resid 77 and name HG3 ))
ASSI { 2377}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 9 and name HG2 ))
3.500 1.500 1.500 peak 2377 spectrum 1 weight 0.10000E+01 volume 0.11971E-02 ppm1 2.012 ppm2 1.482 CV 1
OR { 2377}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 9 and name HG3 ))
OR { 2377}
(( segid " " and resid 79 and name HB2 ))
( segid " " and resid 85 and name HB% )
OR { 2377}
(( segid " " and resid 78 and name HB3 ))
( segid " " and resid 85 and name HB% )
ASSI { 2379}
(( segid " " and resid 78 and name HB3 ))
( segid " " and resid 75 and name HG2%)
3.900 1.900 1.900 peak 2379 spectrum 1 weight 0.10000E+01 volume 0.70628E-03 ppm1 2.008 ppm2 0.851 CV 1
OR { 2379}
(( segid " " and resid 79 and name HB2 ))
( segid " " and resid 75 and name HG2%)
ASSI { 2380}
(( segid " " and resid 78 and name HB2 ))
( segid " " and resid 86 and name HB% )
4.000 2.000 2.000 peak 2380 spectrum 1 weight 0.10000E+01 volume 0.52595E-03 ppm1 2.159 ppm2 1.684 CV 1
OR { 2380}
(( segid " " and resid 78 and name HB2 ))
(( segid " " and resid 80 and name HG2 ))
ASSI { 2381}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HN ))
3.500 1.500 1.500 peak 2381 spectrum 1 weight 0.10000E+01 volume 0.87957E-03 ppm1 2.143 ppm2 8.357 CV 1
OR { 2381}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 8 and name HN ))
ASSI { 2383}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 6 and name HN ))
3.200 1.300 1.300 peak 2383 spectrum 1 weight 0.10000E+01 volume 0.15019E-02 ppm1 2.081 ppm2 8.377 CV 1
OR { 2383}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 7 and name HN ))
ASSI { 2384}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 6 and name HN ))
3.200 1.300 1.300 peak 2384 spectrum 1 weight 0.10000E+01 volume 0.15539E-02 ppm1 2.010 ppm2 8.384 CV 1
OR { 2384}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 7 and name HN ))
ASSI { 2395}
(( segid " " and resid 58 and name HB3 ))
(( segid " " and resid 42 and name HB2 ))
3.500 3.500 2.500 peak 2395 spectrum 1 weight 0.10000E+01 volume 0.64618E-03 ppm1 1.777 ppm2 2.100 CV 1
OR { 2395}
(( segid " " and resid 58 and name HB3 ))
(( segid " " and resid 44 and name HB ))
ASSI { 2433}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 63 and name HB3 ))
4.200 2.200 1.800 peak 2433 spectrum 1 weight 0.10000E+01 volume 0.41693E-03 ppm1 1.825 ppm2 2.836 CV 1
OR { 2433}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 63 and name HB3 ))
OR { 2433}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 63 and name HB2 ))
OR { 2433}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 60 and name HB2 ))
OR { 2433}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 63 and name HB2 ))
ASSI { 2435}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 49 and name HB2 ))
4.200 2.200 1.800 peak 2435 spectrum 1 weight 0.10000E+01 volume 0.53310E-03 ppm1 1.734 ppm2 2.839 CV 1
OR { 2435}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 60 and name HB2 ))
ASSI { 2437}
(( segid " " and resid 64 and name HB ))
(( segid " " and resid 62 and name HA ))
3.400 3.400 2.600 peak 2437 spectrum 1 weight 0.10000E+01 volume 0.40810E-03 ppm1 1.626 ppm2 4.154 CV 1
OR { 2437}
(( segid " " and resid 64 and name HB ))
(( segid " " and resid 50 and name HD3 ))
ASSI { 2451}
(( segid " " and resid 66 and name HB2 ))
(( segid " " and resid 66 and name HB3 ))
1.600 0.300 0.600 peak 2451 spectrum 1 weight 0.10000E+01 volume 0.25148E-01 ppm1 1.828 ppm2 1.706 CV 1
OR { 2451}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 9 and name HD2 ))
ASSI { 2453}
(( segid " " and resid 9 and name HB3 ))
( segid " " and resid 12 and name HD1%)
4.100 2.100 1.900 peak 2453 spectrum 1 weight 0.10000E+01 volume 0.46380E-03 ppm1 1.817 ppm2 0.816 CV 1
OR { 2453}
(( segid " " and resid 66 and name HB2 ))
(( segid " " and resid 20 and name HG13))
ASSI { 2471}
(( segid " " and resid 69 and name HG2 ))
(( segid " " and resid 16 and name HB3 ))
4.200 2.200 1.800 peak 2471 spectrum 1 weight 0.10000E+01 volume 0.69855E-03 ppm1 2.475 ppm2 1.688 CV 1
OR { 2471}
(( segid " " and resid 69 and name HG3 ))
(( segid " " and resid 16 and name HB3 ))
OR { 2471}
(( segid " " and resid 69 and name HG3 ))
(( segid " " and resid 66 and name HB3 ))
OR { 2471}
(( segid " " and resid 69 and name HG3 ))
(( segid " " and resid 16 and name HD3 ))
OR { 2471}
(( segid " " and resid 69 and name HG3 ))
(( segid " " and resid 16 and name HD2 ))
OR { 2471}
(( segid " " and resid 69 and name HG2 ))
(( segid " " and resid 66 and name HB3 ))
OR { 2471}
(( segid " " and resid 69 and name HG2 ))
(( segid " " and resid 16 and name HB2 ))
OR { 2471}
(( segid " " and resid 69 and name HG3 ))
(( segid " " and resid 16 and name HB2 ))
ASSI { 2474}
(( segid " " and resid 69 and name HG2 ))
( segid " " and resid 17 and name HD1%)
4.000 2.000 2.000 peak 2474 spectrum 1 weight 0.10000E+01 volume 0.66511E-03 ppm1 2.480 ppm2 0.554 CV 1
OR { 2474}
(( segid " " and resid 69 and name HG3 ))
( segid " " and resid 17 and name HD1%)
OR { 2474}
(( segid " " and resid 69 and name HG2 ))
( segid " " and resid 65 and name HD1%)
ASSI { 2481}
(( segid " " and resid 74 and name HG2 ))
( segid " " and resid 10 and name HB% )
3.800 1.800 1.800 peak 2481 spectrum 1 weight 0.10000E+01 volume 0.43885E-03 ppm1 2.192 ppm2 1.410 CV 1
OR { 2481}
(( segid " " and resid 74 and name HG2 ))
(( segid " " and resid 91 and name HG13))
ASSI { 2484}
(( segid " " and resid 74 and name HG3 ))
( segid " " and resid 91 and name HG2%)
3.900 1.900 1.900 peak 2484 spectrum 1 weight 0.10000E+01 volume 0.72517E-03 ppm1 2.309 ppm2 0.846 CV 1
OR { 2484}
(( segid " " and resid 74 and name HG3 ))
( segid " " and resid 75 and name HG2%)
ASSI { 2485}
(( segid " " and resid 74 and name HG2 ))
( segid " " and resid 75 and name HG2%)
3.700 1.700 1.700 peak 2485 spectrum 1 weight 0.10000E+01 volume 0.85411E-03 ppm1 2.194 ppm2 0.847 CV 1
OR { 2485}
(( segid " " and resid 74 and name HG2 ))
( segid " " and resid 91 and name HG2%)
ASSI { 2514}
(( segid " " and resid 7 and name HG2 ))
(( segid " " and resid 7 and name HN ))
3.700 1.700 1.700 peak 2514 spectrum 1 weight 0.10000E+01 volume 0.78033E-03 ppm1 2.405 ppm2 8.355 CV 1
OR { 2514}
(( segid " " and resid 7 and name HG3 ))
(( segid " " and resid 7 and name HN ))
OR { 2514}
(( segid " " and resid 7 and name HG3 ))
(( segid " " and resid 8 and name HN ))
OR { 2514}
(( segid " " and resid 7 and name HG2 ))
(( segid " " and resid 8 and name HN ))
ASSI { 2520}
(( segid " " and resid 43 and name HG2 ))
(( segid " " and resid 39 and name HB3 ))
3.500 3.500 2.500 peak 2520 spectrum 1 weight 0.10000E+01 volume 0.64474E-03 ppm1 2.922 ppm2 1.686 CV 1
OR { 2520}
(( segid " " and resid 43 and name HG2 ))
(( segid " " and resid 61 and name HB ))
ASSI { 2537}
(( segid " " and resid 70 and name HG2 ))
(( segid " " and resid 16 and name HD3 ))
3.500 1.600 1.600 peak 2537 spectrum 1 weight 0.10000E+01 volume 0.80483E-03 ppm1 2.429 ppm2 1.699 CV 1
OR { 2537}
(( segid " " and resid 70 and name HG2 ))
(( segid " " and resid 14 and name HD3 ))
OR { 2537}
(( segid " " and resid 70 and name HG2 ))
(( segid " " and resid 14 and name HD2 ))
ASSI { 2562}
(( segid " " and resid 43 and name HG3 ))
(( segid " " and resid 39 and name HB3 ))
3.300 3.300 2.700 peak 2562 spectrum 1 weight 0.10000E+01 volume 0.56979E-03 ppm1 2.202 ppm2 1.690 CV 1
OR { 2562}
(( segid " " and resid 43 and name HG3 ))
(( segid " " and resid 61 and name HB ))
ASSI { 2574}
(( segid " " and resid 67 and name HG3 ))
(( segid " " and resid 66 and name HB3 ))
4.400 2.400 1.600 peak 2574 spectrum 1 weight 0.10000E+01 volume 0.86451E-03 ppm1 2.261 ppm2 1.690 CV 1
OR { 2574}
(( segid " " and resid 67 and name HG2 ))
(( segid " " and resid 66 and name HB3 ))
OR { 2574}
(( segid " " and resid 67 and name HG2 ))
(( segid " " and resid 16 and name HB3 ))
ASSI { 2579}
(( segid " " and resid 67 and name HG2 ))
( segid " " and resid 17 and name HD1%)
3.900 1.900 1.900 peak 2579 spectrum 1 weight 0.10000E+01 volume 0.11305E-02 ppm1 2.261 ppm2 0.563 CV 1
OR { 2579}
(( segid " " and resid 67 and name HG3 ))
( segid " " and resid 17 and name HD1%)
OR { 2579}
(( segid " " and resid 67 and name HG3 ))
( segid " " and resid 65 and name HD1%)
ASSI { 2581}
(( segid " " and resid 29 and name HB ))
(( segid " " and resid 29 and name HN ))
3.000 1.100 1.100 peak 2581 spectrum 1 weight 0.10000E+01 volume 0.17928E-02 ppm1 1.677 ppm2 8.997 CV 1
OR { 2581}
(( segid " " and resid 29 and name HB ))
(( segid " " and resid 30 and name HN ))
ASSI { 2595}
(( segid " " and resid 70 and name HG2 ))
(( segid " " and resid 70 and name HA ))
3.600 1.600 1.600 peak 2595 spectrum 1 weight 0.10000E+01 volume 0.15627E-02 ppm1 2.428 ppm2 5.234 CV 1
OR { 2595}
(( segid " " and resid 70 and name HG2 ))
(( segid " " and resid 16 and name HA ))
ASSI { 2604}
(( segid " " and resid 67 and name HG2 ))
(( segid " " and resid 18 and name HN ))
3.500 1.600 1.600 peak 2604 spectrum 1 weight 0.10000E+01 volume 0.20536E-02 ppm1 2.260 ppm2 9.233 CV 1
OR { 2604}
(( segid " " and resid 67 and name HG2 ))
(( segid " " and resid 68 and name HN ))
OR { 2604}
(( segid " " and resid 67 and name HG3 ))
(( segid " " and resid 68 and name HN ))
ASSI { 2614}
(( segid " " and resid 79 and name HG3 ))
(( segid " " and resid 79 and name HN ))
3.100 1.200 1.200 peak 2614 spectrum 1 weight 0.10000E+01 volume 0.32818E-02 ppm1 2.348 ppm2 8.670 CV 1
OR { 2614}
(( segid " " and resid 79 and name HG2 ))
(( segid " " and resid 79 and name HN ))
OR { 2614}
(( segid " " and resid 78 and name HG2 ))
(( segid " " and resid 79 and name HN ))
ASSI { 2615}
(( segid " " and resid 79 and name HG2 ))
(( segid " " and resid 85 and name HN ))
3.200 1.200 1.200 peak 2615 spectrum 1 weight 0.10000E+01 volume 0.18203E-02 ppm1 2.345 ppm2 8.432 CV 1
OR { 2615}
(( segid " " and resid 79 and name HG3 ))
(( segid " " and resid 85 and name HN ))
OR { 2615}
(( segid " " and resid 79 and name HG2 ))
(( segid " " and resid 84 and name HN ))
OR { 2615}
(( segid " " and resid 79 and name HG3 ))
(( segid " " and resid 84 and name HN ))
ASSI { 2618}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 24 and name HN ))
4.100 2.100 1.900 peak 2618 spectrum 1 weight 0.10000E+01 volume 0.47760E-03 ppm1 2.342 ppm2 7.315 CV 1
OR { 2618}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 24 and name HN ))
OR { 2618}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 26 and name HN ))
ASSI { 2622}
(( segid " " and resid 78 and name HG3 ))
(( segid " " and resid 77 and name HA ))
3.700 1.700 1.700 peak 2622 spectrum 1 weight 0.10000E+01 volume 0.10762E-02 ppm1 2.345 ppm2 4.547 CV 1
OR { 2622}
(( segid " " and resid 78 and name HG2 ))
(( segid " " and resid 77 and name HA ))
OR { 2622}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 35 and name HA ))
OR { 2622}
(( segid " " and resid 79 and name HG2 ))
(( segid " " and resid 80 and name HA ))
ASSI { 2623}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 40 and name HA ))
3.700 1.700 1.700 peak 2623 spectrum 1 weight 0.10000E+01 volume 0.62749E-03 ppm1 2.342 ppm2 4.444 CV 1
OR { 2623}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 40 and name HA ))
OR { 2623}
(( segid " " and resid 79 and name HG2 ))
(( segid " " and resid 83 and name HA ))
OR { 2623}
(( segid " " and resid 79 and name HG3 ))
(( segid " " and resid 83 and name HA ))
ASSI { 2629}
(( segid " " and resid 79 and name HG2 ))
(( segid " " and resid 35 and name HD3 ))
3.600 1.600 1.600 peak 2629 spectrum 1 weight 0.10000E+01 volume 0.48756E-03 ppm1 2.347 ppm2 2.993 CV 1
OR { 2629}
(( segid " " and resid 79 and name HG3 ))
(( segid " " and resid 35 and name HD3 ))
OR { 2629}
(( segid " " and resid 79 and name HG2 ))
(( segid " " and resid 38 and name HB3 ))
OR { 2629}
(( segid " " and resid 79 and name HG3 ))
(( segid " " and resid 38 and name HB3 ))
ASSI { 2650}
(( segid " " and resid 15 and name HA1 ))
(( segid " " and resid 16 and name HA ))
3.200 1.300 1.300 peak 2650 spectrum 1 weight 0.10000E+01 volume 0.22107E-02 ppm1 5.016 ppm2 5.261 CV 1
OR { 2650}
(( segid " " and resid 15 and name HA1 ))
(( segid " " and resid 31 and name HA ))
ASSI { 2931}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 75 and name HN ))
2.500 0.800 0.800 peak 2931 spectrum 1 weight 0.10000E+01 volume 0.42427E-02 ppm1 5.130 ppm2 8.635 CV 1
OR { 2931}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 74 and name HN ))
ASSI { 8}
( segid " " and resid 31 and name HE% )
(( segid " " and resid 36 and name HA ))
3.700 1.700 1.700 peak 8 spectrum 1 weight 0.10000E+01 volume 0.15878E-02 ppm1 6.380 ppm2 5.103 CV 1
OR { 8}
( segid " " and resid 31 and name HE% )
(( segid " " and resid 30 and name HA ))
ASSI { 14}
( segid " " and resid 53 and name HD% )
(( segid " " and resid 50 and name HG2 ))
3.100 3.100 2.900 peak 14 spectrum 1 weight 0.10000E+01 volume 0.16081E-02 ppm1 7.093 ppm2 2.185 CV 1
OR { 14}
( segid " " and resid 53 and name HD% )
(( segid " " and resid 59 and name HB2 ))
ASSI { 15}
( segid " " and resid 28 and name HD% )
( segid " " and resid 24 and name HD1%)
3.600 3.600 2.400 peak 15 spectrum 1 weight 0.10000E+01 volume 0.74228E-03 ppm1 7.115 ppm2 1.110 CV 1
OR { 15}
( segid " " and resid 28 and name HD% )
( segid " " and resid 33 and name HB% )
ASSI { 17}
(( segid " " and resid 38 and name HZ ))
( segid " " and resid 61 and name HG2%)
3.300 3.300 2.700 peak 17 spectrum 1 weight 0.10000E+01 volume 0.47751E-03 ppm1 7.222 ppm2 0.900 CV 1
OR { 17}
(( segid " " and resid 38 and name HZ ))
( segid " " and resid 41 and name HD2%)
ASSI { 22}
( segid " " and resid 31 and name HD% )
( segid " " and resid 85 and name HB% )
4.000 2.000 2.000 peak 22 spectrum 1 weight 0.10000E+01 volume 0.61227E-03 ppm1 6.571 ppm2 1.501 CV 1
OR { 22}
( segid " " and resid 31 and name HD% )
(( segid " " and resid 87 and name HG ))
OR { 22}
( segid " " and resid 31 and name HD% )
(( segid " " and resid 87 and name HB2 ))
ASSI { 25}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 28 and name HN ))
3.900 1.900 1.900 peak 25 spectrum 1 weight 0.10000E+01 volume 0.50325E-03 ppm1 6.851 ppm2 9.006 CV 1
OR { 25}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 29 and name HN ))
ASSI { 28}
( segid " " and resid 38 and name HD% )
( segid " " and resid 86 and name HB% )
3.900 1.900 1.900 peak 28 spectrum 1 weight 0.10000E+01 volume 0.67813E-03 ppm1 6.856 ppm2 1.666 CV 1
OR { 28}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 39 and name HB3 ))
ASSI { 29}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 39 and name HA ))
3.700 1.700 1.700 peak 29 spectrum 1 weight 0.10000E+01 volume 0.59434E-03 ppm1 6.850 ppm2 4.979 CV 1
OR { 29}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 86 and name HA ))
ASSI { 34}
( segid " " and resid 38 and name HD% )
( segid " " and resid 85 and name HB% )
3.300 3.300 2.700 peak 34 spectrum 1 weight 0.10000E+01 volume 0.43990E-03 ppm1 6.853 ppm2 1.463 CV 1
OR { 34}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 20 and name HG12))
OR { 34}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 77 and name HG3 ))
ASSI { 54}
( segid " " and resid 13 and name HD% )
(( segid " " and resid 75 and name HG13))
3.500 1.500 1.500 peak 54 spectrum 1 weight 0.10000E+01 volume 0.11840E-02 ppm1 7.086 ppm2 1.515 CV 1
OR { 54}
( segid " " and resid 13 and name HD% )
(( segid " " and resid 12 and name HG13))
ASSI { 61}
( segid " " and resid 48 and name HD% )
(( segid " " and resid 65 and name HG ))
4.100 2.100 1.900 peak 61 spectrum 1 weight 0.10000E+01 volume 0.42512E-03 ppm1 7.307 ppm2 1.416 CV 1
OR { 61}
( segid " " and resid 48 and name HD% )
(( segid " " and resid 71 and name HB ))
OR { 61}
( segid " " and resid 48 and name HD% )
( segid " " and resid 94 and name HB% )
ASSI { 64}
( segid " " and resid 48 and name HD% )
( segid " " and resid 65 and name HD2%)
3.400 1.500 1.500 peak 64 spectrum 1 weight 0.10000E+01 volume 0.66970E-03 ppm1 7.304 ppm2 0.595 CV 1
OR { 64}
( segid " " and resid 48 and name HD% )
( segid " " and resid 44 and name HD1%)
ASSI { 65}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 19 and name HB3 ))
4.000 2.000 2.000 peak 65 spectrum 1 weight 0.10000E+01 volume 0.40902E-03 ppm1 6.854 ppm2 1.856 CV 1
OR { 65}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 24 and name HB3 ))
ASSI { 89}
( segid " " and resid 28 and name HE% )
(( segid " " and resid 21 and name HG3 ))
3.200 3.200 2.800 peak 89 spectrum 1 weight 0.10000E+01 volume 0.85267E-03 ppm1 7.347 ppm2 2.338 CV 1
OR { 89}
( segid " " and resid 28 and name HE% )
(( segid " " and resid 21 and name HG2 ))
OR { 89}
( segid " " and resid 28 and name HE% )
(( segid " " and resid 79 and name HG2 ))
OR { 89}
( segid " " and resid 28 and name HE% )
(( segid " " and resid 79 and name HG3 ))
ASSI { 95}
( segid " " and resid 48 and name HE% )
(( segid " " and resid 71 and name HB ))
3.300 1.400 1.400 peak 95 spectrum 1 weight 0.10000E+01 volume 0.10543E-02 ppm1 7.008 ppm2 1.419 CV 1
OR { 95}
( segid " " and resid 48 and name HE% )
( segid " " and resid 94 and name HB% )
ASSI { 96}
( segid " " and resid 28 and name HD% )
( segid " " and resid 29 and name HG2%)
3.900 1.900 1.900 peak 96 spectrum 1 weight 0.10000E+01 volume 0.62913E-03 ppm1 7.116 ppm2 0.606 CV 1
OR { 96}
( segid " " and resid 28 and name HD% )
( segid " " and resid 39 and name HD1%)
ASSI { 97}
( segid " " and resid 48 and name HE% )
( segid " " and resid 44 and name HD1%)
3.700 1.700 1.700 peak 97 spectrum 1 weight 0.10000E+01 volume 0.70040E-03 ppm1 7.009 ppm2 0.603 CV 1
OR { 97}
( segid " " and resid 48 and name HE% )
( segid " " and resid 65 and name HD2%)
OR { 97}
( segid " " and resid 48 and name HE% )
( segid " " and resid 39 and name HD1%)
ASSI { 107}
( segid " " and resid 13 and name HE% )
(( segid " " and resid 75 and name HB ))
3.500 1.500 1.500 peak 107 spectrum 1 weight 0.10000E+01 volume 0.91974E-03 ppm1 6.873 ppm2 1.932 CV 1
OR { 107}
( segid " " and resid 13 and name HE% )
(( segid " " and resid 74 and name HB2 ))
ASSI { 109}
(( segid " " and resid 38 and name HZ ))
(( segid " " and resid 26 and name HA ))
3.100 3.100 2.900 peak 109 spectrum 1 weight 0.10000E+01 volume 0.64493E-03 ppm1 7.215 ppm2 4.644 CV 1
OR { 109}
(( segid " " and resid 38 and name HZ ))
(( segid " " and resid 24 and name HA ))
OR { 109}
(( segid " " and resid 38 and name HZ ))
(( segid " " and resid 38 and name HA ))
ASSI { 121}
( segid " " and resid 13 and name HD% )
(( segid " " and resid 75 and name HB ))
3.600 1.600 1.600 peak 121 spectrum 1 weight 0.10000E+01 volume 0.10339E-02 ppm1 7.088 ppm2 1.958 CV 1
OR { 121}
( segid " " and resid 13 and name HD% )
(( segid " " and resid 74 and name HB2 ))
OR { 121}
( segid " " and resid 13 and name HD% )
(( segid " " and resid 74 and name HB3 ))
ASSI { 128}
( segid " " and resid 49 and name HE% )
(( segid " " and resid 54 and name HA ))
4.600 2.700 1.400 peak 128 spectrum 1 weight 0.10000E+01 volume 0.37076E-03 ppm1 7.077 ppm2 4.351 CV 1
OR { 128}
( segid " " and resid 49 and name HE% )
(( segid " " and resid 48 and name HA ))
Contact the webmaster for help, if required. Friday, May 10, 2024 9:12:53 AM GMT (wattos1)