NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
7678 |
1kuz   |
cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
ASSI { 268}
(( segid "B " and resid 14 and name HN ))
(( segid "B " and resid 14 and name HA ))
2.500 0.800 0.800 peak 268 weight 0.10000E+01 volume 0.33980E-02 ppm1 8.389 ppm2 4.404 CV 1
OR { 268}
(( segid "B " and resid 14 and name HN ))
(( segid "B " and resid 13 and name HA ))
ASSI { 12}
(( segid "B " and resid 20 and name HN ))
(( segid "B " and resid 19 and name HA ))
2.700 0.900 0.900 peak 12 weight 0.10000E+01 volume 0.29395E-02 ppm1 8.236 ppm2 4.626 CV 1
OR { 12}
(( segid "B " and resid 20 and name HN ))
(( segid "B " and resid 18 and name HA ))
ASSI { 14}
(( segid "B " and resid 19 and name HN ))
(( segid "B " and resid 19 and name HA ))
2.700 0.900 0.900 peak 14 weight 0.10000E+01 volume 0.26700E-02 ppm1 8.137 ppm2 4.622 CV 1
OR { 14}
(( segid "B " and resid 19 and name HN ))
(( segid "B " and resid 18 and name HA ))
ASSI { 29}
(( segid "B " and resid 29 and name HN ))
(( segid "B " and resid 29 and name HA ))
2.400 0.700 0.700 peak 29 weight 0.10000E+01 volume 0.56365E-02 ppm1 8.228 ppm2 4.170 CV 1
OR { 29}
(( segid "B " and resid 29 and name HN ))
(( segid "B " and resid 28 and name HA ))
ASSI { 33}
(( segid "B " and resid 19 and name HN ))
(( segid "B " and resid 15 and name HA ))
2.300 0.600 0.600 peak 33 weight 0.10000E+01 volume 0.90884E-02 ppm1 8.130 ppm2 4.207 CV 1
OR { 33}
(( segid "A " and resid 9 and name HN ))
(( segid "A " and resid 8 and name HA ))
ASSI { 34}
(( segid "B " and resid 23 and name HN ))
(( segid "B " and resid 22 and name HA ))
2.400 0.700 0.700 peak 34 weight 0.10000E+01 volume 0.60141E-02 ppm1 8.085 ppm2 4.214 CV 1
OR { 34}
(( segid "B " and resid 23 and name HN ))
(( segid "B " and resid 21 and name HA ))
ASSI { 37}
(( segid "B " and resid 33 and name HN ))
(( segid "B " and resid 30 and name HA ))
2.500 2.500 3.500 peak 37 weight 0.10000E+01 volume 0.50970E-02 ppm1 8.016 ppm2 4.175 CV 1
OR { 37}
(( segid "B " and resid 34 and name HN ))
(( segid "B " and resid 30 and name HA ))
ASSI { 39}
(( segid "B " and resid 32 and name HN ))
(( segid "B " and resid 32 and name HA ))
2.400 0.700 0.700 peak 39 weight 0.10000E+01 volume 0.48273E-02 ppm1 7.938 ppm2 4.213 CV 1
OR { 39}
(( segid "B " and resid 32 and name HN ))
(( segid "B " and resid 31 and name HA ))
ASSI { 40}
(( segid "B " and resid 32 and name HN ))
(( segid "B " and resid 31 and name HA ))
2.500 0.800 0.800 peak 40 weight 0.10000E+01 volume 0.42880E-02 ppm1 7.939 ppm2 4.176 CV 1
OR { 40}
(( segid "B " and resid 32 and name HN ))
(( segid "B " and resid 30 and name HA ))
ASSI { 89}
(( segid "B " and resid 14 and name HN ))
(( segid "B " and resid 14 and name HB2 ))
2.800 0.900 0.900 peak 89 weight 0.10000E+01 volume 0.42070E-02 ppm1 8.390 ppm2 1.596 CV 1
OR { 89}
(( segid "B " and resid 14 and name HN ))
(( segid "B " and resid 13 and name HB2 ))
ASSI { 103}
(( segid "B " and resid 30 and name HN ))
(( segid "B " and resid 30 and name HB2 ))
2.500 0.800 0.800 peak 103 weight 0.10000E+01 volume 0.25890E-02 ppm1 8.067 ppm2 1.803 CV 1
OR { 103}
(( segid "B " and resid 31 and name HN ))
(( segid "B " and resid 30 and name HB2 ))
ASSI { 104}
(( segid "B " and resid 30 and name HN ))
(( segid "B " and resid 30 and name HB1 ))
2.700 0.900 0.900 peak 104 weight 0.10000E+01 volume 0.34790E-02 ppm1 8.066 ppm2 1.739 CV 1
OR { 104}
(( segid "B " and resid 31 and name HN ))
(( segid "B " and resid 30 and name HB1 ))
ASSI { 106}
(( segid "B " and resid 26 and name HN ))
(( segid "B " and resid 25 and name HG2 ))
3.100 1.200 1.200 peak 106 weight 0.10000E+01 volume 0.37217E-02 ppm1 8.061 ppm2 1.413 CV 1
OR { 106}
(( segid "B " and resid 26 and name HN ))
(( segid "B " and resid 24 and name HB2 ))
OR { 106}
(( segid "B " and resid 26 and name HN ))
(( segid "B " and resid 24 and name HB1 ))
ASSI { 142}
( segid "B " and resid 23 and name HD% )
(( segid "B " and resid 25 and name HD1 ))
3.200 3.200 2.800 peak 142 weight 0.10000E+01 volume 0.18608E-02 ppm1 7.247 ppm2 1.613 CV 1
OR { 142}
(( segid "B " and resid 35 and name HD1 ))
(( segid "B " and resid 34 and name HD2 ))
ASSI { 148}
(( segid "B " and resid 22 and name HN ))
(( segid "B " and resid 22 and name HA ))
2.400 0.700 0.700 peak 148 weight 0.10000E+01 volume 0.66343E-02 ppm1 8.265 ppm2 4.214 CV 1
OR { 148}
(( segid "B " and resid 22 and name HN ))
(( segid "B " and resid 21 and name HA ))
ASSI { 174}
( segid "B " and resid 26 and name HE% )
(( segid "B " and resid 23 and name HA ))
3.300 3.300 2.700 peak 174 weight 0.10000E+01 volume 0.23463E-02 ppm1 7.344 ppm2 4.540 CV 1
OR { 174}
( segid "B " and resid 26 and name HE% )
(( segid "B " and resid 26 and name HA ))
ASSI { 178}
( segid "B " and resid 23 and name HD% )
(( segid "B " and resid 23 and name HA ))
2.700 0.900 0.900 peak 178 weight 0.10000E+01 volume 0.55017E-02 ppm1 7.243 ppm2 4.540 CV 1
OR { 178}
( segid "B " and resid 26 and name HD% )
(( segid "B " and resid 26 and name HA ))
ASSI { 187}
( segid "A " and resid 7 and name HE% )
( segid "A " and resid 7 and name HD% )
1.400 0.300 0.800 peak 187 weight 0.10000E+01 volume 0.93768E-01 ppm1 7.344 ppm2 7.222 CV 1
OR { 187}
( segid "B " and resid 26 and name HE% )
( segid "B " and resid 26 and name HD% )
ASSI { 206}
(( segid "B " and resid 27 and name HN ))
(( segid "B " and resid 26 and name HN ))
2.400 0.700 0.700 peak 206 weight 0.10000E+01 volume 0.18878E-02 ppm1 8.196 ppm2 8.056 CV 1
OR { 206}
(( segid "B " and resid 25 and name HN ))
(( segid "B " and resid 26 and name HN ))
ASSI { 209}
(( segid "A " and resid 9 and name HN ))
(( segid "A " and resid 8 and name HN ))
2.400 0.700 0.700 peak 209 weight 0.10000E+01 volume 0.33709E-02 ppm1 8.126 ppm2 7.991 CV 1
OR { 209}
(( segid "A " and resid 9 and name HN ))
(( segid "A " and resid 7 and name HN ))
ASSI { 212}
(( segid "B " and resid 35 and name HN ))
(( segid "B " and resid 36 and name HN ))
2.300 0.700 0.700 peak 212 weight 0.10000E+01 volume 0.52048E-02 ppm1 7.979 ppm2 8.023 CV 1
OR { 212}
(( segid "B " and resid 35 and name HN ))
(( segid "B " and resid 34 and name HN ))
ASSI { 214}
(( segid "B " and resid 32 and name HN ))
(( segid "B " and resid 31 and name HN ))
2.500 0.800 0.800 peak 214 weight 0.10000E+01 volume 0.30205E-02 ppm1 7.939 ppm2 8.059 CV 1
OR { 214}
(( segid "B " and resid 32 and name HN ))
(( segid "B " and resid 30 and name HN ))
ASSI { 383}
(( segid "A " and resid 6 and name HB1 ))
(( segid "A " and resid 10 and name HB2 ))
3.200 1.300 1.300 peak 383 weight 0.10000E+01 volume 0.15642E-02 ppm1 2.966 ppm2 2.736 CV 1
OR { 383}
(( segid "A " and resid 7 and name HB2 ))
(( segid "A " and resid 10 and name HB2 ))
ASSI { 403}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 26 and name HB2 ))
3.800 1.800 1.800 peak 403 weight 0.10000E+01 volume 0.12405E-02 ppm1 2.386 ppm2 3.130 CV 1
OR { 403}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 26 and name HB2 ))
ASSI { 433}
(( segid "B " and resid 31 and name HN ))
(( segid "B " and resid 27 and name HG1 ))
2.400 2.400 3.600 peak 433 weight 0.10000E+01 volume 0.10518E-02 ppm1 8.060 ppm2 2.386 CV 1
OR { 433}
(( segid "B " and resid 30 and name HN ))
(( segid "B " and resid 27 and name HG1 ))
ASSI { 458}
(( segid "B " and resid 17 and name HN ))
( segid "B " and resid 17 and name HG1%)
4.000 2.000 2.000 peak 458 weight 0.10000E+01 volume 0.86299E-03 ppm1 8.020 ppm2 1.112 CV 1
OR { 458}
(( segid "B " and resid 17 and name HN ))
(( segid "B " and resid 16 and name HG21))
OR { 458}
(( segid "B " and resid 17 and name HN ))
(( segid "B " and resid 16 and name HG22))
ASSI { 7}
(( segid "A " and resid 7 and name HN ))
(( segid "A " and resid 7 and name HA ))
2.100 0.600 0.600 peak 7 weight 0.10000E+01 volume 0.12810E-01 ppm1 7.991 ppm2 4.531 CV 1
OR { 7}
(( segid "B " and resid 36 and name HN ))
(( segid "B " and resid 36 and name HA ))
OR { 7}
(( segid "A " and resid 7 and name HN ))
(( segid "A " and resid 6 and name HA ))
OR { 7}
(( segid "B " and resid 24 and name HN ))
(( segid "B " and resid 23 and name HA ))
ASSI { 31}
(( segid "B " and resid 27 and name HN ))
(( segid "B " and resid 27 and name HA ))
2.700 0.900 0.900 peak 31 weight 0.10000E+01 volume 0.33709E-02 ppm1 8.187 ppm2 4.142 CV 1
OR { 31}
(( segid "B " and resid 28 and name HN ))
(( segid "B " and resid 28 and name HA ))
OR { 31}
(( segid "B " and resid 25 and name HN ))
(( segid "B " and resid 25 and name HA ))
OR { 31}
(( segid "B " and resid 29 and name HN ))
(( segid "B " and resid 29 and name HA ))
OR { 31}
(( segid "B " and resid 29 and name HN ))
(( segid "B " and resid 28 and name HA ))
OR { 31}
(( segid "B " and resid 28 and name HN ))
(( segid "B " and resid 27 and name HA ))
OR { 31}
(( segid "B " and resid 29 and name HN ))
(( segid "B " and resid 27 and name HA ))
ASSI { 35}
(( segid "B " and resid 31 and name HN ))
(( segid "B " and resid 31 and name HA ))
2.500 0.800 0.800 peak 35 weight 0.10000E+01 volume 0.60409E-02 ppm1 8.066 ppm2 4.221 CV 1
OR { 35}
(( segid "B " and resid 30 and name HN ))
(( segid "B " and resid 30 and name HA ))
OR { 35}
(( segid "B " and resid 36 and name HN ))
(( segid "B " and resid 33 and name HA ))
OR { 35}
(( segid "B " and resid 23 and name HN ))
(( segid "B " and resid 22 and name HA ))
OR { 35}
(( segid "B " and resid 30 and name HN ))
(( segid "B " and resid 29 and name HA ))
OR { 35}
(( segid "B " and resid 23 and name HN ))
(( segid "B " and resid 21 and name HA ))
OR { 35}
(( segid "B " and resid 26 and name HN ))
(( segid "B " and resid 24 and name HA ))
OR { 35}
(( segid "B " and resid 31 and name HN ))
(( segid "B " and resid 30 and name HA ))
OR { 35}
(( segid "B " and resid 36 and name HN ))
(( segid "B " and resid 34 and name HA ))
OR { 35}
(( segid "B " and resid 30 and name HN ))
(( segid "B " and resid 28 and name HA ))
ASSI { 36}
(( segid "B " and resid 17 and name HN ))
(( segid "B " and resid 16 and name HB ))
2.500 0.800 0.800 peak 36 weight 0.10000E+01 volume 0.56634E-02 ppm1 8.063 ppm2 4.172 CV 1
OR { 36}
(( segid "B " and resid 34 and name HN ))
(( segid "B " and resid 34 and name HA ))
OR { 36}
(( segid "B " and resid 31 and name HN ))
(( segid "B " and resid 31 and name HA ))
OR { 36}
(( segid "B " and resid 30 and name HN ))
(( segid "B " and resid 30 and name HA ))
OR { 36}
(( segid "B " and resid 31 and name HN ))
(( segid "B " and resid 27 and name HA ))
OR { 36}
(( segid "B " and resid 30 and name HN ))
(( segid "B " and resid 27 and name HA ))
OR { 36}
(( segid "B " and resid 36 and name HN ))
(( segid "B " and resid 33 and name HA ))
OR { 36}
(( segid "B " and resid 23 and name HN ))
(( segid "B " and resid 22 and name HA ))
OR { 36}
(( segid "B " and resid 30 and name HN ))
(( segid "B " and resid 29 and name HA ))
OR { 36}
(( segid "B " and resid 34 and name HN ))
(( segid "B " and resid 33 and name HA ))
OR { 36}
(( segid "B " and resid 26 and name HN ))
(( segid "B " and resid 24 and name HA ))
OR { 36}
(( segid "B " and resid 26 and name HN ))
(( segid "B " and resid 25 and name HA ))
OR { 36}
(( segid "B " and resid 31 and name HN ))
(( segid "B " and resid 30 and name HA ))
OR { 36}
(( segid "B " and resid 34 and name HN ))
(( segid "B " and resid 31 and name HA ))
ASSI { 38}
(( segid "B " and resid 33 and name HN ))
(( segid "B " and resid 33 and name HA ))
2.100 0.500 0.500 peak 38 weight 0.10000E+01 volume 0.12864E-01 ppm1 8.001 ppm2 4.212 CV 1
OR { 38}
(( segid "B " and resid 17 and name HN ))
(( segid "B " and resid 16 and name HB ))
OR { 38}
(( segid "A " and resid 8 and name HN ))
(( segid "A " and resid 8 and name HA ))
OR { 38}
(( segid "B " and resid 34 and name HN ))
(( segid "B " and resid 34 and name HA ))
OR { 38}
(( segid "B " and resid 24 and name HN ))
(( segid "B " and resid 24 and name HA ))
OR { 38}
(( segid "B " and resid 24 and name HN ))
(( segid "B " and resid 21 and name HA ))
OR { 38}
(( segid "B " and resid 36 and name HN ))
(( segid "B " and resid 33 and name HA ))
OR { 38}
(( segid "B " and resid 33 and name HN ))
(( segid "B " and resid 29 and name HA ))
OR { 38}
(( segid "B " and resid 34 and name HN ))
(( segid "B " and resid 33 and name HA ))
OR { 38}
(( segid "B " and resid 35 and name HN ))
(( segid "B " and resid 34 and name HA ))
OR { 38}
(( segid "B " and resid 33 and name HN ))
(( segid "B " and resid 32 and name HA ))
OR { 38}
(( segid "B " and resid 34 and name HN ))
(( segid "B " and resid 31 and name HA ))
ASSI { 48}
(( segid "B " and resid 32 and name HN ))
(( segid "B " and resid 32 and name HA ))
2.600 0.800 0.800 peak 48 weight 0.10000E+01 volume 0.40183E-02 ppm1 7.940 ppm2 4.240 CV 1
OR { 48}
(( segid "B " and resid 32 and name HN ))
(( segid "B " and resid 31 and name HA ))
OR { 48}
(( segid "B " and resid 35 and name HN ))
(( segid "B " and resid 34 and name HA ))
OR { 48}
(( segid "B " and resid 35 and name HN ))
(( segid "B " and resid 32 and name HA ))
ASSI { 56}
(( segid "A " and resid 8 and name HN ))
(( segid "A " and resid 7 and name HB1 ))
2.900 1.000 1.000 peak 56 weight 0.10000E+01 volume 0.26429E-02 ppm1 8.026 ppm2 3.085 CV 1
OR { 56}
(( segid "A " and resid 7 and name HN ))
(( segid "A " and resid 7 and name HB1 ))
OR { 56}
(( segid "B " and resid 26 and name HN ))
(( segid "B " and resid 26 and name HB2 ))
OR { 56}
(( segid "B " and resid 24 and name HN ))
(( segid "B " and resid 23 and name HB2 ))
ASSI { 58}
(( segid "A " and resid 8 and name HN ))
(( segid "A " and resid 7 and name HB1 ))
2.700 0.900 0.900 peak 58 weight 0.10000E+01 volume 0.29127E-02 ppm1 8.023 ppm2 3.155 CV 1
OR { 58}
(( segid "B " and resid 26 and name HN ))
(( segid "B " and resid 26 and name HB1 ))
OR { 58}
(( segid "B " and resid 24 and name HN ))
(( segid "B " and resid 23 and name HB1 ))
OR { 58}
(( segid "A " and resid 7 and name HN ))
(( segid "A " and resid 7 and name HB1 ))
OR { 58}
(( segid "B " and resid 26 and name HN ))
(( segid "B " and resid 26 and name HB2 ))
ASSI { 76}
(( segid "B " and resid 20 and name HN ))
(( segid "B " and resid 20 and name HB2 ))
2.200 0.600 0.600 peak 76 weight 0.10000E+01 volume 0.49621E-02 ppm1 8.202 ppm2 1.900 CV 1
OR { 76}
(( segid "B " and resid 27 and name HN ))
(( segid "B " and resid 27 and name HB1 ))
ASSI { 77}
(( segid "B " and resid 29 and name HN ))
(( segid "B " and resid 32 and name HB2 ))
3.300 1.300 1.300 peak 77 weight 0.10000E+01 volume 0.15911E-02 ppm1 8.203 ppm2 1.870 CV 1
OR { 77}
(( segid "B " and resid 28 and name HN ))
(( segid "B " and resid 32 and name HB2 ))
ASSI { 83}
(( segid "B " and resid 31 and name HN ))
(( segid "B " and resid 32 and name HB2 ))
3.700 1.700 1.700 peak 83 weight 0.10000E+01 volume 0.16451E-02 ppm1 8.077 ppm2 1.861 CV 1
OR { 83}
(( segid "B " and resid 30 and name HN ))
(( segid "B " and resid 32 and name HB2 ))
ASSI { 85}
(( segid "B " and resid 31 and name HN ))
(( segid "B " and resid 32 and name HB2 ))
3.400 1.500 1.500 peak 85 weight 0.10000E+01 volume 0.18608E-02 ppm1 8.067 ppm2 1.837 CV 1
OR { 85}
(( segid "B " and resid 30 and name HN ))
(( segid "B " and resid 32 and name HB2 ))
OR { 85}
(( segid "B " and resid 23 and name HN ))
(( segid "B " and resid 21 and name HB2 ))
ASSI { 105}
(( segid "B " and resid 26 and name HN ))
(( segid "B " and resid 25 and name HD1 ))
3.400 1.400 1.400 peak 105 weight 0.10000E+01 volume 0.15642E-02 ppm1 8.064 ppm2 1.662 CV 1
OR { 105}
(( segid "B " and resid 34 and name HN ))
(( segid "B " and resid 34 and name HD2 ))
OR { 105}
(( segid "B " and resid 17 and name HN ))
(( segid "B " and resid 14 and name HB2 ))
OR { 105}
(( segid "B " and resid 31 and name HN ))
(( segid "B " and resid 34 and name HD2 ))
ASSI { 111}
(( segid "B " and resid 35 and name HN ))
(( segid "B " and resid 34 and name HD2 ))
3.700 1.700 1.700 peak 111 weight 0.10000E+01 volume 0.17799E-02 ppm1 8.012 ppm2 1.596 CV 1
OR { 111}
(( segid "B " and resid 34 and name HN ))
(( segid "B " and resid 34 and name HD2 ))
OR { 111}
(( segid "B " and resid 33 and name HN ))
(( segid "B " and resid 32 and name HG2 ))
OR { 111}
(( segid "B " and resid 17 and name HN ))
(( segid "B " and resid 14 and name HB2 ))
OR { 111}
(( segid "B " and resid 24 and name HN ))
(( segid "B " and resid 25 and name HD1 ))
ASSI { 119}
(( segid "B " and resid 33 and name HN ))
(( segid "B " and resid 32 and name HB1 ))
2.900 1.000 1.000 peak 119 weight 0.10000E+01 volume 0.15642E-02 ppm1 7.987 ppm2 1.815 CV 1
OR { 119}
(( segid "B " and resid 32 and name HN ))
(( segid "B " and resid 32 and name HB2 ))
OR { 119}
(( segid "B " and resid 17 and name HN ))
(( segid "B " and resid 17 and name HB ))
OR { 119}
(( segid "B " and resid 33 and name HN ))
(( segid "B " and resid 32 and name HB2 ))
OR { 119}
(( segid "B " and resid 32 and name HN ))
(( segid "B " and resid 32 and name HB1 ))
ASSI { 126}
(( segid "B " and resid 32 and name HN ))
(( segid "B " and resid 31 and name HB1 ))
2.700 0.900 0.900 peak 126 weight 0.10000E+01 volume 0.39644E-02 ppm1 7.939 ppm2 1.417 CV 1
OR { 126}
(( segid "B " and resid 15 and name HN ))
(( segid "B " and resid 12 and name HG2 ))
ASSI { 139}
( segid "B " and resid 26 and name HE% )
(( segid "B " and resid 30 and name HG2 ))
3.300 1.300 1.300 peak 139 weight 0.10000E+01 volume 0.15642E-02 ppm1 7.340 ppm2 1.609 CV 1
OR { 139}
( segid "B " and resid 26 and name HE% )
(( segid "B " and resid 25 and name HD1 ))
ASSI { 155}
( segid "B " and resid 26 and name HD% )
(( segid "B " and resid 30 and name HB2 ))
3.000 1.100 1.100 peak 155 weight 0.10000E+01 volume 0.18069E-02 ppm1 7.245 ppm2 1.748 CV 1
OR { 155}
( segid "B " and resid 26 and name HD% )
(( segid "B " and resid 30 and name HB1 ))
OR { 155}
( segid "A " and resid 7 and name HD% )
(( segid "A " and resid 3 and name HB1 ))
OR { 155}
(( segid "B " and resid 30 and name HH21))
(( segid "B " and resid 30 and name HB1 ))
OR { 155}
(( segid "B " and resid 35 and name HD1 ))
(( segid "B " and resid 32 and name HB1 ))
OR { 155}
(( segid "B " and resid 30 and name HH21))
(( segid "B " and resid 30 and name HB2 ))
ASSI { 166}
( segid "A " and resid 7 and name HD% )
(( segid "A " and resid 7 and name HB1 ))
2.300 0.700 0.700 peak 166 weight 0.10000E+01 volume 0.60141E-02 ppm1 7.243 ppm2 3.170 CV 1
OR { 166}
( segid "B " and resid 23 and name HD% )
(( segid "B " and resid 23 and name HB1 ))
OR { 166}
( segid "B " and resid 26 and name HD% )
(( segid "B " and resid 26 and name HB1 ))
OR { 166}
( segid "A " and resid 7 and name HD% )
(( segid "A " and resid 11 and name HE ))
ASSI { 169}
( segid "B " and resid 23 and name HD% )
(( segid "B " and resid 23 and name HB1 ))
2.700 0.900 0.900 peak 169 weight 0.10000E+01 volume 0.32902E-02 ppm1 7.206 ppm2 3.185 CV 1
OR { 169}
( segid "B " and resid 26 and name HD% )
(( segid "B " and resid 26 and name HB1 ))
OR { 169}
( segid "A " and resid 7 and name HD% )
(( segid "A " and resid 11 and name HE ))
ASSI { 170}
( segid "A " and resid 7 and name HD% )
(( segid "A " and resid 7 and name HB1 ))
2.400 0.700 0.700 peak 170 weight 0.10000E+01 volume 0.29666E-02 ppm1 7.194 ppm2 3.128 CV 1
OR { 170}
(( segid "B " and resid 30 and name HH21))
(( segid "B " and resid 30 and name HD2 ))
ASSI { 171}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "A " and resid 7 and name HB1 ))
3.400 1.400 1.400 peak 171 weight 0.10000E+01 volume 0.19417E-02 ppm1 7.187 ppm2 3.158 CV 1
OR { 171}
(( segid "B " and resid 35 and name HZ3 ))
(( segid "B " and resid 32 and name HD2 ))
OR { 171}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "A " and resid 11 and name HE ))
ASSI { 175}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 15 and name HA ))
2.700 0.900 0.900 peak 175 weight 0.10000E+01 volume 0.16181E-02 ppm1 7.338 ppm2 4.220 CV 1
OR { 175}
( segid "A " and resid 6 and name HE% )
(( segid "A " and resid 3 and name HA ))
ASSI { 179}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 15 and name HA ))
2.700 0.900 0.900 peak 179 weight 0.10000E+01 volume 0.19957E-02 ppm1 7.243 ppm2 4.167 CV 1
OR { 179}
(( segid "B " and resid 35 and name HD1 ))
(( segid "B " and resid 32 and name HA ))
OR { 179}
( segid "B " and resid 23 and name HD% )
(( segid "B " and resid 24 and name HA ))
OR { 179}
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OR { 179}
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ASSI { 181}
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ASSI { 190}
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OR { 190}
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OR { 218}
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ASSI { 264}
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OR { 264}
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ASSI { 265}
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OR { 265}
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ASSI { 277}
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OR { 277}
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ASSI { 286}
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OR { 286}
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OR { 286}
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OR { 286}
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ASSI { 288}
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OR { 288}
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ASSI { 290}
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3.500 1.600 1.600 peak 290 weight 0.10000E+01 volume 0.14024E-02 ppm1 7.245 ppm2 0.810 CV 1
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ASSI { 291}
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ASSI { 301}
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OR { 301}
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OR { 301}
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ASSI { 302}
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OR { 302}
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OR { 302}
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OR { 302}
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OR { 302}
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ASSI { 303}
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OR { 303}
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OR { 303}
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ASSI { 309}
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OR { 309}
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( segid "A " and resid 7 and name HE% )
ASSI { 311}
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OR { 311}
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ASSI { 314}
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3.900 1.900 1.900 peak 314 weight 0.10000E+01 volume 0.10248E-02 ppm1 7.236 ppm2 4.467 CV 1
OR { 314}
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ASSI { 316}
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OR { 316}
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ASSI { 318}
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OR { 318}
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OR { 318}
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ASSI { 335}
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4.500 2.600 1.500 peak 335 weight 0.10000E+01 volume 0.78209E-03 ppm1 1.051 ppm2 1.800 CV 1
OR { 335}
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ASSI { 343}
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OR { 343}
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OR { 343}
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OR { 343}
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ASSI { 344}
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OR { 344}
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OR { 344}
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ASSI { 358}
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OR { 358}
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ASSI { 364}
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OR { 364}
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OR { 364}
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ASSI { 365}
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3.700 1.700 1.700 peak 365 weight 0.10000E+01 volume 0.11596E-02 ppm1 1.796 ppm2 2.782 CV 1
OR { 365}
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OR { 365}
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ASSI { 379}
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OR { 379}
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ASSI { 389}
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4.100 2.100 1.900 peak 389 weight 0.10000E+01 volume 0.94389E-03 ppm1 1.368 ppm2 2.169 CV 1
OR { 389}
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ASSI { 409}
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(( segid "B " and resid 31 and name HA ))
2.000 0.500 0.500 peak 409 weight 0.10000E+01 volume 0.10922E-01 ppm1 1.294 ppm2 4.219 CV 1
OR { 409}
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ASSI { 413}
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(( segid "B " and resid 24 and name HA ))
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OR { 413}
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OR { 413}
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ASSI { 414}
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OR { 414}
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OR { 414}
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ASSI { 415}
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OR { 415}
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OR { 415}
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OR { 415}
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ASSI { 418}
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OR { 418}
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OR { 418}
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OR { 418}
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ASSI { 424}
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OR { 424}
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OR { 424}
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OR { 424}
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ASSI { 426}
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OR { 426}
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OR { 426}
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OR { 426}
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OR { 426}
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ASSI { 446}
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OR { 446}
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ASSI { 447}
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OR { 447}
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ASSI { 450}
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OR { 450}
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OR { 450}
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OR { 450}
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OR { 450}
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ASSI { 451}
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OR { 451}
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ASSI { 452}
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OR { 452}
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OR { 452}
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OR { 452}
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ASSI { 457}
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OR { 457}
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ASSI { 459}
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OR { 459}
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OR { 459}
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ASSI { 18}
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OR { 18}
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OR { 18}
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ASSI { 20}
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OR { 20}
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ASSI { 53}
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OR { 53}
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ASSI { 58}
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OR { 58}
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ASSI { 61}
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OR { 61}
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ASSI { 68}
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OR { 68}
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OR { 68}
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OR { 68}
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ASSI { 85}
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OR { 85}
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OR { 85}
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OR { 85}
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OR { 85}
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ASSI { 86}
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OR { 86}
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OR { 86}
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OR { 86}
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ASSI { 92}
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OR { 92}
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OR { 92}
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ASSI { 93}
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OR { 93}
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OR { 93}
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OR { 93}
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ASSI { 94}
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OR { 94}
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OR { 94}
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OR { 94}
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ASSI { 95}
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3.300 1.300 1.300 peak 95 weight 0.10000E+01 volume 0.11670E-02 ppm1 7.324 ppm2 1.742 CV 1
OR { 95}
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OR { 95}
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ASSI { 96}
( segid "A " and resid 6 and name HE% )
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3.000 1.100 1.100 peak 96 weight 0.10000E+01 volume 0.16078E-02 ppm1 7.322 ppm2 1.695 CV 1
OR { 96}
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OR { 96}
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ASSI { 97}
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(( segid "B " and resid 14 and name HB2 ))
3.200 1.300 1.300 peak 97 weight 0.10000E+01 volume 0.18153E-02 ppm1 7.324 ppm2 1.638 CV 1
OR { 97}
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(( segid "B " and resid 25 and name HD2 ))
OR { 97}
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(( segid "B " and resid 32 and name HG1 ))
OR { 97}
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(( segid "B " and resid 14 and name HG ))
OR { 97}
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(( segid "A " and resid 11 and name HG1 ))
ASSI { 98}
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(( segid "B " and resid 30 and name HG1 ))
3.400 1.400 1.400 peak 98 weight 0.10000E+01 volume 0.11929E-02 ppm1 7.323 ppm2 1.602 CV 1
OR { 98}
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(( segid "B " and resid 14 and name HB2 ))
OR { 98}
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(( segid "B " and resid 25 and name HD2 ))
OR { 98}
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(( segid "B " and resid 32 and name HG1 ))
OR { 98}
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(( segid "B " and resid 14 and name HG ))
ASSI { 99}
( segid "B " and resid 26 and name HE% )
(( segid "B " and resid 30 and name HG1 ))
3.500 1.500 1.500 peak 99 weight 0.10000E+01 volume 0.94655E-03 ppm1 7.322 ppm2 1.542 CV 1
OR { 99}
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(( segid "A " and resid 3 and name HD1 ))
ASSI { 100}
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(( segid "B " and resid 24 and name HB1 ))
3.600 1.600 1.600 peak 100 weight 0.10000E+01 volume 0.13096E-02 ppm1 7.324 ppm2 1.439 CV 1
OR { 100}
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OR { 100}
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(( segid "B " and resid 24 and name HB1 ))
ASSI { 101}
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(( segid "B " and resid 21 and name HG1 ))
3.800 1.800 1.800 peak 101 weight 0.10000E+01 volume 0.11929E-02 ppm1 7.320 ppm2 1.399 CV 1
OR { 101}
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(( segid "B " and resid 24 and name HB1 ))
OR { 101}
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OR { 101}
( segid "A " and resid 7 and name HE% )
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OR { 101}
( segid "B " and resid 26 and name HE% )
(( segid "B " and resid 31 and name HB1 ))
OR { 101}
( segid "B " and resid 26 and name HE% )
(( segid "B " and resid 24 and name HB1 ))
ASSI { 102}
(( segid "B " and resid 18 and name HD1 ))
(( segid "A " and resid 8 and name HG1 ))
4.400 2.400 1.600 peak 102 weight 0.10000E+01 volume 0.88172E-03 ppm1 7.325 ppm2 1.316 CV 1
OR { 102}
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(( segid "A " and resid 8 and name HG1 ))
ASSI { 105}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 15 and name HG21))
3.700 1.800 1.800 peak 105 weight 0.10000E+01 volume 0.14782E-02 ppm1 7.322 ppm2 0.885 CV 1
OR { 105}
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OR { 105}
( segid "A " and resid 7 and name HE% )
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ASSI { 107}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 18 and name HB1 ))
3.500 1.500 1.500 peak 107 weight 0.10000E+01 volume 0.11021E-02 ppm1 7.316 ppm2 3.215 CV 1
OR { 107}
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(( segid "A " and resid 11 and name HE ))
OR { 107}
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(( segid "B " and resid 32 and name HD2 ))
OR { 107}
( segid "B " and resid 23 and name HE% )
(( segid "B " and resid 23 and name HB1 ))
OR { 107}
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(( segid "B " and resid 32 and name HD2 ))
ASSI { 109}
( segid "B " and resid 26 and name HE% )
(( segid "B " and resid 30 and name HB2 ))
3.500 1.600 1.600 peak 109 weight 0.10000E+01 volume 0.12318E-02 ppm1 7.319 ppm2 1.768 CV 1
OR { 109}
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(( segid "B " and resid 30 and name HB1 ))
OR { 109}
( segid "A " and resid 7 and name HE% )
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OR { 109}
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(( segid "B " and resid 15 and name HB ))
ASSI { 115}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 15 and name HG21))
3.900 1.900 1.900 peak 115 weight 0.10000E+01 volume 0.13355E-02 ppm1 7.318 ppm2 0.846 CV 1
OR { 115}
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(( segid "B " and resid 15 and name HD11))
OR { 115}
( segid "A " and resid 7 and name HE% )
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ASSI { 118}
( segid "B " and resid 26 and name HE% )
(( segid "B " and resid 30 and name HB2 ))
3.700 1.700 1.700 peak 118 weight 0.10000E+01 volume 0.11151E-02 ppm1 7.312 ppm2 1.829 CV 1
OR { 118}
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(( segid "A " and resid 8 and name HB1 ))
OR { 118}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 15 and name HB ))
OR { 118}
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(( segid "B " and resid 15 and name HB ))
ASSI { 122}
( segid "B " and resid 23 and name HD% )
(( segid "B " and resid 23 and name HB1 ))
2.700 0.900 0.900 peak 122 weight 0.10000E+01 volume 0.33064E-02 ppm1 7.261 ppm2 3.190 CV 1
OR { 122}
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(( segid "B " and resid 26 and name HB1 ))
OR { 122}
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(( segid "B " and resid 18 and name HB1 ))
OR { 122}
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(( segid "A " and resid 11 and name HE ))
ASSI { 137}
(( segid "A " and resid 2 and name HH2 ))
( segid "B " and resid 15 and name HG1%)
3.500 1.500 1.500 peak 137 weight 0.10000E+01 volume 0.72613E-03 ppm1 7.265 ppm2 1.142 CV 1
OR { 137}
( segid "A " and resid 7 and name HD% )
( segid "B " and resid 15 and name HG1%)
ASSI { 139}
( segid "B " and resid 23 and name HD% )
(( segid "B " and resid 23 and name HB2 ))
3.300 1.300 1.300 peak 139 weight 0.10000E+01 volume 0.10762E-02 ppm1 7.261 ppm2 3.036 CV 1
OR { 139}
( segid "A " and resid 7 and name HD% )
(( segid "A " and resid 7 and name HB2 ))
ASSI { 200}
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(( segid "B " and resid 26 and name HB2 ))
1.900 0.500 0.500 peak 200 weight 0.10000E+01 volume 0.18127E-01 ppm1 4.549 ppm2 3.119 CV 1
OR { 200}
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(( segid "B " and resid 23 and name HB2 ))
OR { 200}
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(( segid "B " and resid 26 and name HB1 ))
ASSI { 211}
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(( segid "A " and resid 6 and name HB1 ))
2.200 0.600 0.600 peak 211 weight 0.10000E+01 volume 0.10710E-01 ppm1 4.542 ppm2 2.987 CV 1
OR { 211}
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(( segid "A " and resid 7 and name HB2 ))
ASSI { 221}
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(( segid "B " and resid 12 and name HB2 ))
4.200 2.200 1.800 peak 221 weight 0.10000E+01 volume 0.73909E-03 ppm1 4.443 ppm2 1.918 CV 1
OR { 221}
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(( segid "A " and resid 11 and name HB1 ))
ASSI { 222}
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(( segid "B " and resid 14 and name HB2 ))
2.800 1.000 1.000 peak 222 weight 0.10000E+01 volume 0.28655E-02 ppm1 4.439 ppm2 1.617 CV 1
OR { 222}
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(( segid "B " and resid 13 and name HB2 ))
OR { 222}
(( segid "B " and resid 13 and name HA ))
(( segid "B " and resid 13 and name HG ))
ASSI { 225}
(( segid "B " and resid 14 and name HA ))
(( segid "B " and resid 14 and name HB2 ))
3.400 1.400 1.400 peak 225 weight 0.10000E+01 volume 0.93358E-03 ppm1 4.402 ppm2 1.640 CV 1
OR { 225}
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(( segid "B " and resid 13 and name HB2 ))
ASSI { 270}
(( segid "A " and resid 9 and name HA ))
(( segid "A " and resid 8 and name HE2 ))
2.900 1.100 1.100 peak 270 weight 0.10000E+01 volume 0.40975E-02 ppm1 4.228 ppm2 2.996 CV 1
OR { 270}
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(( segid "A " and resid 7 and name HB2 ))
OR { 270}
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(( segid "A " and resid 8 and name HE2 ))
OR { 270}
(( segid "A " and resid 8 and name HA ))
(( segid "A " and resid 7 and name HB2 ))
ASSI { 271}
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(( segid "B " and resid 20 and name HG1 ))
2.000 0.500 0.500 peak 271 weight 0.10000E+01 volume 0.23832E-01 ppm1 4.226 ppm2 1.693 CV 1
OR { 271}
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(( segid "A " and resid 3 and name HB2 ))
OR { 271}
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(( segid "A " and resid 9 and name HB2 ))
OR { 271}
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(( segid "B " and resid 34 and name HB2 ))
ASSI { 273}
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(( segid "B " and resid 16 and name HG21))
3.500 1.500 1.500 peak 273 weight 0.10000E+01 volume 0.71316E-03 ppm1 4.224 ppm2 1.158 CV 1
OR { 273}
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( segid "B " and resid 15 and name HG1%)
ASSI { 275}
(( segid "B " and resid 15 and name HA ))
(( segid "A " and resid 3 and name HE1 ))
4.500 2.600 1.500 peak 275 weight 0.10000E+01 volume 0.67426E-03 ppm1 4.216 ppm2 2.890 CV 1
OR { 275}
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(( segid "A " and resid 3 and name HE1 ))
OR { 275}
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(( segid "A " and resid 10 and name HB1 ))
ASSI { 276}
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(( segid "B " and resid 30 and name HG1 ))
3.100 1.200 1.200 peak 276 weight 0.10000E+01 volume 0.17505E-02 ppm1 4.221 ppm2 1.564 CV 1
OR { 276}
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(( segid "A " and resid 9 and name HG1 ))
OR { 276}
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(( segid "A " and resid 3 and name HD1 ))
ASSI { 285}
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(( segid "B " and resid 27 and name HB1 ))
3.500 1.500 1.500 peak 285 weight 0.10000E+01 volume 0.10373E-02 ppm1 4.192 ppm2 1.973 CV 1
OR { 285}
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(( segid "B " and resid 22 and name HB2 ))
OR { 285}
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(( segid "B " and resid 27 and name HB1 ))
ASSI { 287}
(( segid "A " and resid 3 and name HA ))
(( segid "A " and resid 7 and name HB2 ))
2.800 1.000 1.000 peak 287 weight 0.10000E+01 volume 0.49661E-02 ppm1 4.182 ppm2 2.993 CV 1
OR { 287}
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(( segid "A " and resid 8 and name HE2 ))
OR { 287}
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(( segid "A " and resid 7 and name HB2 ))
OR { 287}
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(( segid "A " and resid 6 and name HB1 ))
ASSI { 294}
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(( segid "B " and resid 27 and name HB1 ))
3.500 1.500 1.500 peak 294 weight 0.10000E+01 volume 0.10503E-02 ppm1 4.162 ppm2 1.971 CV 1
OR { 294}
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ASSI { 295}
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(( segid "B " and resid 28 and name HB1 ))
3.500 1.500 1.500 peak 295 weight 0.10000E+01 volume 0.79096E-03 ppm1 4.155 ppm2 2.105 CV 1
OR { 295}
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(( segid "B " and resid 29 and name HB2 ))
ASSI { 309}
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(( segid "B " and resid 17 and name HB ))
3.500 1.500 1.500 peak 309 weight 0.10000E+01 volume 0.66130E-03 ppm1 4.031 ppm2 1.836 CV 1
OR { 309}
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(( segid "A " and resid 8 and name HB1 ))
ASSI { 311}
(( segid "A " and resid 4 and name HA ))
(( segid "A " and resid 8 and name HB1 ))
4.500 2.600 1.500 peak 311 weight 0.10000E+01 volume 0.71316E-03 ppm1 4.027 ppm2 1.782 CV 1
OR { 311}
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(( segid "B " and resid 15 and name HB ))
OR { 311}
(( segid "A " and resid 4 and name HA ))
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ASSI { 336}
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(( segid "B " and resid 21 and name HD2 ))
3.700 1.700 1.700 peak 336 weight 0.10000E+01 volume 0.90765E-03 ppm1 3.303 ppm2 1.686 CV 1
OR { 336}
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(( segid "A " and resid 3 and name HB2 ))
ASSI { 344}
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( segid "B " and resid 15 and name HG1%)
4.100 2.100 1.900 peak 344 weight 0.10000E+01 volume 0.75206E-03 ppm1 3.008 ppm2 1.147 CV 1
OR { 344}
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( segid "B " and resid 15 and name HG1%)
ASSI { 347}
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(( segid "A " and resid 11 and name HB1 ))
3.500 1.500 1.500 peak 347 weight 0.10000E+01 volume 0.24117E-02 ppm1 2.881 ppm2 1.917 CV 1
OR { 347}
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(( segid "B " and resid 12 and name HB2 ))
ASSI { 357}
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(( segid "B " and resid 13 and name HD11))
2.500 0.800 0.800 peak 357 weight 0.10000E+01 volume 0.24766E-02 ppm1 4.433 ppm2 0.916 CV 1
OR { 357}
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(( segid "B " and resid 14 and name HD11))
ASSI { 359}
(( segid "B " and resid 14 and name HA ))
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4.300 2.300 1.700 peak 359 weight 0.10000E+01 volume 0.68723E-03 ppm1 4.414 ppm2 0.840 CV 1
OR { 359}
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OR { 359}
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OR { 359}
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OR { 359}
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(( segid "B " and resid 17 and name HG21))
OR { 359}
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OR { 359}
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ASSI { 363}
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OR { 363}
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OR { 363}
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OR { 363}
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OR { 363}
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ASSI { 366}
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( segid "A " and resid 4 and name HG2%)
1.600 1.600 4.400 peak 366 weight 0.10000E+01 volume 0.29253E-01 ppm1 4.028 ppm2 0.946 CV 1
OR { 366}
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(( segid "B " and resid 14 and name HD21))
OR { 366}
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( segid "A " and resid 4 and name HG1%)
ASSI { 387}
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3.600 1.600 1.600 peak 387 weight 0.10000E+01 volume 0.10632E-02 ppm1 3.176 ppm2 0.915 CV 1
OR { 387}
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OR { 387}
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ASSI { 395}
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(( segid "B " and resid 13 and name HD11))
3.700 1.700 1.700 peak 395 weight 0.10000E+01 volume 0.10762E-02 ppm1 3.013 ppm2 0.882 CV 1
OR { 395}
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ASSI { 396}
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(( segid "B " and resid 13 and name HD11))
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OR { 396}
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OR { 396}
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( segid "A " and resid 4 and name HG1%)
ASSI { 405}
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(( segid "B " and resid 34 and name HD1 ))
3.800 1.800 1.800 peak 405 weight 0.10000E+01 volume 0.15171E-02 ppm1 4.706 ppm2 1.668 CV 1
OR { 405}
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ASSI { 430}
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(( segid "B " and resid 16 and name HB ))
3.100 1.200 1.200 peak 430 weight 0.10000E+01 volume 0.17634E-02 ppm1 4.407 ppm2 4.177 CV 1
OR { 430}
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(( segid "B " and resid 16 and name HB ))
ASSI { 436}
(( segid "A " and resid 10 and name HA ))
(( segid "A " and resid 6 and name HB1 ))
4.000 2.000 2.000 peak 436 weight 0.10000E+01 volume 0.82986E-03 ppm1 4.706 ppm2 2.999 CV 1
OR { 436}
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(( segid "A " and resid 7 and name HB2 ))
ASSI { 445}
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(( segid "A " and resid 3 and name HA ))
3.800 1.800 1.800 peak 445 weight 0.10000E+01 volume 0.60943E-03 ppm1 7.106 ppm2 4.229 CV 1
OR { 445}
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(( segid "A " and resid 3 and name HA ))
ASSI { 473}
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(( segid "B " and resid 15 and name HG21))
4.500 2.500 1.500 peak 473 weight 0.10000E+01 volume 0.47975E-03 ppm1 7.112 ppm2 0.887 CV 1
OR { 473}
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(( segid "B " and resid 14 and name HD11))
ASSI { 507}
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(( segid "A " and resid 4 and name HA ))
4.400 2.400 1.600 peak 507 weight 0.10000E+01 volume 0.62240E-03 ppm1 7.326 ppm2 4.028 CV 1
OR { 507}
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OR { 507}
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(( segid "A " and resid 4 and name HA ))
ASSI { 516}
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( segid "B " and resid 15 and name HG1%)
3.900 1.900 1.900 peak 516 weight 0.10000E+01 volume 0.75206E-03 ppm1 3.208 ppm2 1.144 CV 1
OR { 516}
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( segid "B " and resid 17 and name HG1%)
OR { 516}
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( segid "B " and resid 15 and name HG1%)
ASSI { 525}
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( segid "B " and resid 15 and name HG1%)
3.900 1.900 1.900 peak 525 weight 0.10000E+01 volume 0.40195E-03 ppm1 7.195 ppm2 1.121 CV 1
OR { 525}
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ASSI { 527}
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( segid "B " and resid 15 and name HG1%)
3.900 1.900 1.900 peak 527 weight 0.10000E+01 volume 0.37602E-03 ppm1 7.307 ppm2 1.187 CV 1
OR { 527}
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( segid "B " and resid 15 and name HG1%)
ASSI { 528}
(( segid "B " and resid 18 and name HD1 ))
( segid "B " and resid 15 and name HG1%)
4.800 2.900 1.200 peak 528 weight 0.10000E+01 volume 0.36305E-03 ppm1 7.337 ppm2 1.190 CV 1
OR { 528}
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( segid "B " and resid 15 and name HG1%)
ASSI { 536}
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(( segid "A " and resid 8 and name HG1 ))
4.600 2.700 1.400 peak 536 weight 0.10000E+01 volume 0.36305E-03 ppm1 7.143 ppm2 1.339 CV 1
OR { 536}
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(( segid "B " and resid 31 and name HB1 ))
ASSI { 541}
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4.500 2.500 1.500 peak 541 weight 0.10000E+01 volume 0.31119E-03 ppm1 7.142 ppm2 1.396 CV 1
OR { 541}
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(( segid "A " and resid 8 and name HG1 ))
ASSI { 543}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "B " and resid 15 and name HB ))
4.800 2.800 1.200 peak 543 weight 0.10000E+01 volume 0.47975E-03 ppm1 7.143 ppm2 1.773 CV 1
OR { 543}
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(( segid "A " and resid 8 and name HB1 ))
ASSI { 546}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "A " and resid 1 and name HB2 ))
4.400 2.500 1.600 peak 546 weight 0.10000E+01 volume 0.37602E-03 ppm1 7.143 ppm2 1.862 CV 1
OR { 546}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "B " and resid 15 and name HB ))
OR { 546}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "B " and resid 12 and name HB2 ))
ASSI { 547}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "A " and resid 1 and name HB2 ))
3.900 1.900 1.900 peak 547 weight 0.10000E+01 volume 0.55757E-03 ppm1 7.111 ppm2 1.887 CV 1
OR { 547}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "B " and resid 12 and name HB2 ))
ASSI { 548}
(( segid "A " and resid 2 and name HZ2 ))
(( segid "B " and resid 15 and name HB ))
4.000 2.000 2.000 peak 548 weight 0.10000E+01 volume 0.38898E-03 ppm1 7.509 ppm2 1.828 CV 1
OR { 548}
(( segid "A " and resid 2 and name HZ2 ))
(( segid "A " and resid 8 and name HB1 ))
ASSI { 551}
(( segid "A " and resid 2 and name HE3 ))
(( segid "B " and resid 14 and name HG ))
4.900 3.000 1.100 peak 551 weight 0.10000E+01 volume 0.36305E-03 ppm1 7.595 ppm2 1.644 CV 1
OR { 551}
(( segid "A " and resid 2 and name HE3 ))
(( segid "A " and resid 8 and name HD1 ))
ASSI { 554}
(( segid "A " and resid 4 and name HN ))
(( segid "A " and resid 3 and name HB2 ))
4.500 2.600 1.500 peak 554 weight 0.10000E+01 volume 0.38898E-03 ppm1 7.832 ppm2 1.693 CV 1
OR { 554}
(( segid "A " and resid 2 and name HN ))
(( segid "A " and resid 3 and name HB2 ))
ASSI { 555}
(( segid "A " and resid 2 and name HE3 ))
(( segid "B " and resid 12 and name HG2 ))
4.600 2.700 1.400 peak 555 weight 0.10000E+01 volume 0.38898E-03 ppm1 7.601 ppm2 1.400 CV 1
OR { 555}
(( segid "A " and resid 2 and name HE3 ))
(( segid "A " and resid 8 and name HG1 ))
ASSI { 557}
(( segid "A " and resid 2 and name HE3 ))
(( segid "A " and resid 3 and name HG2 ))
3.600 1.700 1.700 peak 557 weight 0.10000E+01 volume 0.27229E-03 ppm1 7.600 ppm2 1.115 CV 1
OR { 557}
(( segid "A " and resid 2 and name HE3 ))
( segid "B " and resid 15 and name HG1%)
ASSI { 558}
(( segid "A " and resid 2 and name HE3 ))
(( segid "B " and resid 15 and name HB ))
5.300 3.600 0.700 peak 558 weight 0.10000E+01 volume 0.33712E-03 ppm1 7.594 ppm2 1.822 CV 1
OR { 558}
(( segid "A " and resid 2 and name HE3 ))
(( segid "A " and resid 8 and name HB1 ))
ASSI { 565}
( segid "B " and resid 26 and name HE% )
(( segid "B " and resid 27 and name HG2 ))
3.800 1.800 1.800 peak 565 weight 0.10000E+01 volume 0.42788E-03 ppm1 7.327 ppm2 2.220 CV 1
OR { 565}
( segid "B " and resid 23 and name HE% )
(( segid "B " and resid 27 and name HG2 ))
ASSI { 573}
( segid "B " and resid 26 and name HE% )
(( segid "B " and resid 27 and name HG1 ))
4.500 2.500 1.500 peak 573 weight 0.10000E+01 volume 0.42788E-03 ppm1 7.310 ppm2 2.360 CV 1
OR { 573}
(( segid "A " and resid 2 and name HH2 ))
(( segid "A " and resid 1 and name HG2 ))
ASSI { 580}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 19 and name HB2 ))
4.100 2.100 1.900 peak 580 weight 0.10000E+01 volume 0.45381E-03 ppm1 7.273 ppm2 2.738 CV 1
OR { 580}
( segid "A " and resid 7 and name HD% )
(( segid "A " and resid 10 and name HB2 ))
OR { 580}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 19 and name HB1 ))
ASSI { 583}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "A " and resid 7 and name HB1 ))
4.400 2.500 1.600 peak 583 weight 0.10000E+01 volume 0.41492E-03 ppm1 7.151 ppm2 3.166 CV 1
OR { 583}
( segid "A " and resid 6 and name HD% )
(( segid "A " and resid 9 and name HD2 ))
OR { 583}
( segid "A " and resid 6 and name HD% )
(( segid "A " and resid 9 and name HD1 ))
OR { 583}
( segid "A " and resid 6 and name HD% )
(( segid "A " and resid 7 and name HB1 ))
OR { 583}
(( segid "B " and resid 35 and name HZ3 ))
(( segid "B " and resid 32 and name HD2 ))
ASSI { 585}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "A " and resid 2 and name HB2 ))
4.900 3.000 1.100 peak 585 weight 0.10000E+01 volume 0.44085E-03 ppm1 7.147 ppm2 3.233 CV 1
OR { 585}
( segid "A " and resid 6 and name HD% )
(( segid "A " and resid 9 and name HD2 ))
OR { 585}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "A " and resid 11 and name HE ))
ASSI { 588}
(( segid "B " and resid 35 and name HZ3 ))
(( segid "B " and resid 35 and name HB2 ))
3.400 3.400 2.600 peak 588 weight 0.10000E+01 volume 0.45381E-03 ppm1 7.180 ppm2 3.345 CV 1
OR { 588}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "B " and resid 18 and name HB2 ))
ASSI { 599}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "A " and resid 3 and name HB2 ))
4.400 2.400 1.600 peak 599 weight 0.10000E+01 volume 0.50568E-03 ppm1 7.177 ppm2 1.732 CV 1
OR { 599}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "B " and resid 12 and name HD2 ))
ASSI { 612}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 14 and name HA ))
4.300 2.300 1.700 peak 612 weight 0.10000E+01 volume 0.49271E-03 ppm1 7.267 ppm2 4.428 CV 1
OR { 612}
(( segid "A " and resid 2 and name HH2 ))
(( segid "B " and resid 13 and name HA ))
OR { 612}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 16 and name HA ))
OR { 612}
(( segid "A " and resid 2 and name HH2 ))
(( segid "B " and resid 14 and name HA ))
ASSI { 613}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 16 and name HA ))
4.700 2.700 1.300 peak 613 weight 0.10000E+01 volume 0.37602E-03 ppm1 7.265 ppm2 4.362 CV 1
OR { 613}
( segid "A " and resid 7 and name HD% )
(( segid "B " and resid 16 and name HA ))
ASSI { 614}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 14 and name HA ))
4.200 2.200 1.800 peak 614 weight 0.10000E+01 volume 0.36305E-03 ppm1 7.314 ppm2 4.461 CV 1
OR { 614}
( segid "A " and resid 7 and name HE% )
(( segid "B " and resid 13 and name HA ))
ASSI { 615}
( segid "A " and resid 6 and name HE% )
(( segid "A " and resid 6 and name HA ))
3.300 3.300 2.700 peak 615 weight 0.10000E+01 volume 0.33712E-03 ppm1 7.367 ppm2 4.491 CV 1
OR { 615}
( segid "A " and resid 7 and name HE% )
(( segid "A " and resid 6 and name HA ))
ASSI { 618}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 19 and name HA ))
4.000 2.000 2.000 peak 618 weight 0.10000E+01 volume 0.42788E-03 ppm1 7.258 ppm2 4.642 CV 1
OR { 618}
(( segid "A " and resid 2 and name HD1 ))
(( segid "A " and resid 2 and name HA ))
OR { 618}
(( segid "B " and resid 35 and name HD1 ))
(( segid "B " and resid 35 and name HA ))
ASSI { 621}
(( segid "A " and resid 2 and name HE3 ))
(( segid "A " and resid 3 and name HA ))
4.600 2.700 1.400 peak 621 weight 0.10000E+01 volume 0.40195E-03 ppm1 7.596 ppm2 4.212 CV 1
OR { 621}
(( segid "A " and resid 2 and name HE3 ))
(( segid "A " and resid 1 and name HA ))
ASSI { 623}
(( segid "A " and resid 9 and name HA ))
(( segid "A " and resid 10 and name HB1 ))
4.300 2.300 1.700 peak 623 weight 0.10000E+01 volume 0.58350E-03 ppm1 4.223 ppm2 2.831 CV 1
OR { 623}
(( segid "A " and resid 8 and name HA ))
(( segid "A " and resid 10 and name HB1 ))
ASSI { 624}
(( segid "A " and resid 8 and name HA ))
(( segid "A " and resid 10 and name HB1 ))
4.500 2.500 1.500 peak 624 weight 0.10000E+01 volume 0.40195E-03 ppm1 4.180 ppm2 2.832 CV 1
OR { 624}
(( segid "A " and resid 3 and name HA ))
(( segid "A " and resid 10 and name HB1 ))
ASSI { 635}
(( segid "B " and resid 15 and name HA ))
(( segid "B " and resid 15 and name HG21))
2.700 0.900 0.900 peak 635 weight 0.10000E+01 volume 0.13744E-02 ppm1 4.190 ppm2 0.867 CV 1
OR { 635}
(( segid "A " and resid 8 and name HA ))
(( segid "B " and resid 15 and name HG21))
ASSI { 636}
(( segid "B " and resid 15 and name HA ))
(( segid "B " and resid 15 and name HD11))
3.700 1.700 1.700 peak 636 weight 0.10000E+01 volume 0.57053E-03 ppm1 4.204 ppm2 0.808 CV 1
OR { 636}
(( segid "A " and resid 8 and name HA ))
(( segid "B " and resid 15 and name HD11))
ASSI { 656}
(( segid "A " and resid 4 and name HA ))
(( segid "A " and resid 7 and name HB1 ))
3.100 1.200 1.200 peak 656 weight 0.10000E+01 volume 0.41492E-03 ppm1 4.029 ppm2 3.165 CV 1
OR { 656}
(( segid "B " and resid 17 and name HA ))
(( segid "B " and resid 20 and name HD2 ))
ASSI { 657}
(( segid "B " and resid 17 and name HA ))
(( segid "B " and resid 20 and name HD2 ))
3.700 1.700 1.700 peak 657 weight 0.10000E+01 volume 0.44085E-03 ppm1 4.033 ppm2 3.198 CV 1
OR { 657}
(( segid "B " and resid 17 and name HA ))
(( segid "B " and resid 18 and name HB1 ))
ASSI { 659}
(( segid "B " and resid 26 and name HA ))
(( segid "B " and resid 26 and name HB1 ))
3.000 1.100 1.100 peak 659 weight 0.10000E+01 volume 0.19839E-02 ppm1 4.560 ppm2 3.193 CV 1
OR { 659}
(( segid "B " and resid 23 and name HA ))
(( segid "B " and resid 23 and name HB1 ))
OR { 659}
(( segid "A " and resid 6 and name HA ))
(( segid "A " and resid 9 and name HD1 ))
ASSI { 660}
(( segid "B " and resid 26 and name HA ))
(( segid "B " and resid 26 and name HB2 ))
3.000 1.100 1.100 peak 660 weight 0.10000E+01 volume 0.11540E-02 ppm1 4.563 ppm2 3.072 CV 1
OR { 660}
(( segid "B " and resid 23 and name HA ))
(( segid "B " and resid 23 and name HB2 ))
ASSI { 665}
(( segid "B " and resid 18 and name HB2 ))
(( segid "B " and resid 17 and name HG21))
4.500 2.500 1.500 peak 665 weight 0.10000E+01 volume 0.37602E-03 ppm1 3.330 ppm2 0.835 CV 1
OR { 665}
(( segid "B " and resid 18 and name HB2 ))
(( segid "B " and resid 17 and name HD11))
OR { 665}
(( segid "A " and resid 2 and name HB2 ))
(( segid "B " and resid 15 and name HD11))
ASSI { 666}
(( segid "B " and resid 18 and name HB2 ))
(( segid "B " and resid 14 and name HD11))
4.400 2.500 1.600 peak 666 weight 0.10000E+01 volume 0.51864E-03 ppm1 3.311 ppm2 0.920 CV 1
OR { 666}
(( segid "A " and resid 2 and name HB2 ))
( segid "A " and resid 4 and name HG1%)
ASSI { 667}
(( segid "B " and resid 18 and name HB2 ))
(( segid "B " and resid 17 and name HG21))
4.200 2.200 1.800 peak 667 weight 0.10000E+01 volume 0.44085E-03 ppm1 3.311 ppm2 0.897 CV 1
OR { 667}
(( segid "B " and resid 18 and name HB2 ))
(( segid "B " and resid 14 and name HD11))
ASSI { 668}
(( segid "B " and resid 18 and name HB1 ))
(( segid "B " and resid 17 and name HG21))
4.200 2.200 1.800 peak 668 weight 0.10000E+01 volume 0.44085E-03 ppm1 3.263 ppm2 0.903 CV 1
OR { 668}
(( segid "B " and resid 18 and name HB1 ))
(( segid "B " and resid 14 and name HD11))
OR { 668}
(( segid "B " and resid 18 and name HB2 ))
(( segid "B " and resid 17 and name HG21))
OR { 668}
(( segid "A " and resid 2 and name HB2 ))
( segid "A " and resid 4 and name HG1%)
ASSI { 671}
(( segid "A " and resid 7 and name HB1 ))
(( segid "B " and resid 15 and name HG21))
3.300 1.400 1.400 peak 671 weight 0.10000E+01 volume 0.50568E-03 ppm1 3.091 ppm2 0.909 CV 1
OR { 671}
(( segid "A " and resid 7 and name HB1 ))
( segid "A " and resid 4 and name HG1%)
ASSI { 672}
(( segid "A " and resid 3 and name HE1 ))
(( segid "B " and resid 15 and name HG21))
5.000 3.100 1.000 peak 672 weight 0.10000E+01 volume 0.45381E-03 ppm1 2.891 ppm2 0.857 CV 1
OR { 672}
(( segid "A " and resid 10 and name HB1 ))
(( segid "B " and resid 15 and name HG21))
ASSI { 676}
(( segid "B " and resid 12 and name HE2 ))
(( segid "B " and resid 12 and name HG2 ))
2.300 0.600 0.600 peak 676 weight 0.10000E+01 volume 0.56663E-02 ppm1 2.998 ppm2 1.393 CV 1
OR { 676}
(( segid "A " and resid 8 and name HE2 ))
(( segid "A " and resid 8 and name HG1 ))
ASSI { 680}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 25 and name HG2 ))
3.300 1.400 1.400 peak 680 weight 0.10000E+01 volume 0.16078E-02 ppm1 3.170 ppm2 1.437 CV 1
OR { 680}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 24 and name HB1 ))
OR { 680}
(( segid "A " and resid 7 and name HB1 ))
(( segid "B " and resid 12 and name HG2 ))
ASSI { 682}
(( segid "B " and resid 32 and name HD2 ))
(( segid "B " and resid 34 and name HG2 ))
3.500 1.500 1.500 peak 682 weight 0.10000E+01 volume 0.12966E-02 ppm1 3.173 ppm2 1.312 CV 1
OR { 682}
(( segid "A " and resid 11 and name HE ))
(( segid "A " and resid 8 and name HG1 ))
ASSI { 683}
(( segid "A " and resid 7 and name HB1 ))
(( segid "A " and resid 8 and name HG1 ))
3.800 1.800 1.800 peak 683 weight 0.10000E+01 volume 0.63536E-03 ppm1 3.148 ppm2 1.341 CV 1
OR { 683}
(( segid "B " and resid 32 and name HD2 ))
(( segid "B " and resid 31 and name HB1 ))
OR { 683}
(( segid "B " and resid 32 and name HD2 ))
(( segid "B " and resid 34 and name HG2 ))
OR { 683}
(( segid "B " and resid 30 and name HD2 ))
(( segid "B " and resid 31 and name HB1 ))
ASSI { 684}
(( segid "B " and resid 32 and name HD2 ))
(( segid "B " and resid 31 and name HB1 ))
3.200 1.300 1.300 peak 684 weight 0.10000E+01 volume 0.16986E-02 ppm1 3.202 ppm2 1.392 CV 1
OR { 684}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 25 and name HG2 ))
OR { 684}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 24 and name HB1 ))
OR { 684}
(( segid "B " and resid 18 and name HB1 ))
(( segid "B " and resid 21 and name HG1 ))
ASSI { 686}
(( segid "B " and resid 32 and name HD2 ))
(( segid "B " and resid 31 and name HB1 ))
3.500 1.500 1.500 peak 686 weight 0.10000E+01 volume 0.10114E-02 ppm1 3.206 ppm2 1.352 CV 1
OR { 686}
(( segid "B " and resid 18 and name HB1 ))
(( segid "B " and resid 21 and name HG1 ))
OR { 686}
(( segid "B " and resid 32 and name HD2 ))
(( segid "B " and resid 34 and name HG2 ))
ASSI { 687}
(( segid "B " and resid 26 and name HB2 ))
(( segid "B " and resid 25 and name HG2 ))
4.700 2.700 1.300 peak 687 weight 0.10000E+01 volume 0.47975E-03 ppm1 3.081 ppm2 1.456 CV 1
OR { 687}
(( segid "B " and resid 23 and name HB2 ))
(( segid "B " and resid 24 and name HB1 ))
OR { 687}
(( segid "B " and resid 23 and name HB2 ))
(( segid "B " and resid 25 and name HG2 ))
OR { 687}
(( segid "A " and resid 7 and name HB1 ))
(( segid "B " and resid 12 and name HG2 ))
ASSI { 688}
(( segid "B " and resid 18 and name HB1 ))
(( segid "B " and resid 14 and name HB2 ))
2.000 0.500 0.500 peak 688 weight 0.10000E+01 volume 0.14380E-01 ppm1 3.192 ppm2 1.624 CV 1
OR { 688}
(( segid "A " and resid 9 and name HD1 ))
(( segid "A " and resid 9 and name HG1 ))
OR { 688}
(( segid "A " and resid 11 and name HD1 ))
(( segid "A " and resid 11 and name HG1 ))
OR { 688}
(( segid "B " and resid 20 and name HD2 ))
(( segid "B " and resid 20 and name HG1 ))
OR { 688}
(( segid "B " and resid 32 and name HD2 ))
(( segid "B " and resid 32 and name HG1 ))
OR { 688}
(( segid "A " and resid 9 and name HD2 ))
(( segid "A " and resid 9 and name HG1 ))
ASSI { 689}
(( segid "A " and resid 7 and name HB1 ))
(( segid "A " and resid 8 and name HD1 ))
4.200 2.200 1.800 peak 689 weight 0.10000E+01 volume 0.10892E-02 ppm1 3.107 ppm2 1.654 CV 1
OR { 689}
(( segid "B " and resid 23 and name HB2 ))
(( segid "B " and resid 25 and name HD2 ))
OR { 689}
(( segid "B " and resid 26 and name HB2 ))
(( segid "B " and resid 25 and name HD2 ))
ASSI { 690}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 30 and name HG1 ))
4.200 2.200 1.800 peak 690 weight 0.10000E+01 volume 0.90765E-03 ppm1 3.191 ppm2 1.538 CV 1
OR { 690}
(( segid "B " and resid 32 and name HD2 ))
(( segid "B " and resid 33 and name HB1 ))
OR { 690}
(( segid "A " and resid 11 and name HE ))
(( segid "A " and resid 3 and name HD1 ))
ASSI { 691}
(( segid "B " and resid 12 and name HE2 ))
(( segid "A " and resid 3 and name HD1 ))
3.600 1.700 1.700 peak 691 weight 0.10000E+01 volume 0.71316E-03 ppm1 2.957 ppm2 1.566 CV 1
OR { 691}
(( segid "A " and resid 8 and name HE2 ))
(( segid "A " and resid 9 and name HG1 ))
OR { 691}
(( segid "A " and resid 7 and name HB2 ))
(( segid "A " and resid 3 and name HD1 ))
ASSI { 692}
(( segid "B " and resid 12 and name HE2 ))
(( segid "A " and resid 3 and name HD1 ))
3.000 1.200 1.200 peak 692 weight 0.10000E+01 volume 0.17505E-02 ppm1 2.995 ppm2 1.556 CV 1
OR { 692}
(( segid "A " and resid 7 and name HB2 ))
(( segid "A " and resid 3 and name HD1 ))
ASSI { 693}
(( segid "B " and resid 18 and name HB2 ))
(( segid "B " and resid 21 and name HG1 ))
4.700 2.800 1.300 peak 693 weight 0.10000E+01 volume 0.58350E-03 ppm1 3.303 ppm2 1.404 CV 1
OR { 693}
(( segid "A " and resid 2 and name HB2 ))
(( segid "B " and resid 12 and name HG2 ))
ASSI { 707}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 24 and name HB1 ))
3.700 1.700 1.700 peak 707 weight 0.10000E+01 volume 0.79096E-03 ppm1 2.404 ppm2 1.386 CV 1
OR { 707}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 31 and name HB1 ))
ASSI { 713}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 25 and name HD2 ))
4.000 2.000 2.000 peak 713 weight 0.10000E+01 volume 0.82986E-03 ppm1 2.422 ppm2 1.652 CV 1
OR { 713}
(( segid "A " and resid 1 and name HG2 ))
(( segid "B " and resid 14 and name HG ))
OR { 713}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 32 and name HG1 ))
OR { 713}
(( segid "A " and resid 1 and name HG2 ))
(( segid "A " and resid 8 and name HD1 ))
ASSI { 714}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 25 and name HD2 ))
3.900 1.900 1.900 peak 714 weight 0.10000E+01 volume 0.89469E-03 ppm1 2.360 ppm2 1.659 CV 1
OR { 714}
(( segid "A " and resid 1 and name HG2 ))
(( segid "B " and resid 14 and name HG ))
OR { 714}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 32 and name HG1 ))
OR { 714}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 32 and name HG1 ))
OR { 714}
(( segid "A " and resid 1 and name HG2 ))
(( segid "A " and resid 8 and name HD1 ))
ASSI { 715}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 25 and name HD2 ))
4.000 2.000 2.000 peak 715 weight 0.10000E+01 volume 0.82986E-03 ppm1 2.365 ppm2 1.621 CV 1
OR { 715}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 30 and name HG1 ))
OR { 715}
(( segid "A " and resid 1 and name HG2 ))
(( segid "B " and resid 14 and name HG ))
OR { 715}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 30 and name HG1 ))
OR { 715}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 32 and name HG1 ))
OR { 715}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 32 and name HG1 ))
OR { 715}
(( segid "A " and resid 1 and name HG2 ))
(( segid "A " and resid 8 and name HD1 ))
ASSI { 720}
(( segid "B " and resid 27 and name HG2 ))
(( segid "B " and resid 30 and name HB1 ))
3.900 1.900 1.900 peak 720 weight 0.10000E+01 volume 0.72613E-03 ppm1 2.284 ppm2 1.757 CV 1
OR { 720}
(( segid "B " and resid 27 and name HG2 ))
(( segid "B " and resid 30 and name HB2 ))
OR { 720}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 30 and name HB2 ))
OR { 720}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 30 and name HB1 ))
ASSI { 721}
(( segid "B " and resid 22 and name HG1 ))
(( segid "A " and resid 8 and name HB1 ))
3.000 1.100 1.100 peak 721 weight 0.10000E+01 volume 0.79096E-03 ppm1 2.277 ppm2 1.825 CV 1
OR { 721}
(( segid "B " and resid 27 and name HG2 ))
(( segid "B " and resid 30 and name HB2 ))
ASSI { 722}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 32 and name HB2 ))
3.800 1.800 1.800 peak 722 weight 0.10000E+01 volume 0.71316E-03 ppm1 2.288 ppm2 1.811 CV 1
OR { 722}
(( segid "B " and resid 27 and name HG2 ))
(( segid "B " and resid 30 and name HB2 ))
OR { 722}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 30 and name HB2 ))
ASSI { 725}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 30 and name HB2 ))
4.000 2.000 2.000 peak 725 weight 0.10000E+01 volume 0.75206E-03 ppm1 2.371 ppm2 1.822 CV 1
OR { 725}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 32 and name HB1 ))
OR { 725}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 30 and name HB2 ))
OR { 725}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 30 and name HB2 ))
OR { 725}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 32 and name HB1 ))
ASSI { 726}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 32 and name HB2 ))
4.000 2.000 2.000 peak 726 weight 0.10000E+01 volume 0.70019E-03 ppm1 2.403 ppm2 1.813 CV 1
OR { 726}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 30 and name HB2 ))
OR { 726}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 30 and name HB2 ))
OR { 726}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 32 and name HB1 ))
ASSI { 727}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 30 and name HB1 ))
4.100 2.100 1.900 peak 727 weight 0.10000E+01 volume 0.73909E-03 ppm1 2.412 ppm2 1.768 CV 1
OR { 727}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 32 and name HB2 ))
OR { 727}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 30 and name HB2 ))
OR { 727}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 30 and name HB1 ))
OR { 727}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 30 and name HB2 ))
ASSI { 728}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 32 and name HB2 ))
3.900 1.900 1.900 peak 728 weight 0.10000E+01 volume 0.88172E-03 ppm1 2.357 ppm2 1.770 CV 1
OR { 728}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 30 and name HB2 ))
OR { 728}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 30 and name HB1 ))
OR { 728}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 32 and name HB2 ))
OR { 728}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 30 and name HB1 ))
OR { 728}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 30 and name HB2 ))
ASSI { 737}
(( segid "B " and resid 19 and name HB2 ))
(( segid "A " and resid 11 and name HG1 ))
4.200 2.200 1.800 peak 737 weight 0.10000E+01 volume 0.54460E-03 ppm1 2.762 ppm2 1.673 CV 1
OR { 737}
(( segid "B " and resid 19 and name HB2 ))
(( segid "B " and resid 20 and name HG1 ))
OR { 737}
(( segid "A " and resid 10 and name HB2 ))
(( segid "A " and resid 11 and name HG1 ))
ASSI { 738}
(( segid "A " and resid 10 and name HB2 ))
(( segid "A " and resid 9 and name HG1 ))
3.900 1.900 1.900 peak 738 weight 0.10000E+01 volume 0.53161E-03 ppm1 2.785 ppm2 1.645 CV 1
OR { 738}
(( segid "B " and resid 19 and name HB2 ))
(( segid "A " and resid 11 and name HG1 ))
ASSI { 740}
(( segid "B " and resid 19 and name HB1 ))
(( segid "A " and resid 11 and name HG1 ))
3.900 1.900 1.900 peak 740 weight 0.10000E+01 volume 0.49271E-03 ppm1 2.715 ppm2 1.641 CV 1
OR { 740}
(( segid "B " and resid 19 and name HB1 ))
(( segid "B " and resid 20 and name HG1 ))
ASSI { 748}
(( segid "B " and resid 22 and name HG1 ))
(( segid "B " and resid 22 and name HB2 ))
3.100 1.200 1.200 peak 748 weight 0.10000E+01 volume 0.93358E-03 ppm1 2.208 ppm2 1.934 CV 1
OR { 748}
(( segid "B " and resid 22 and name HG2 ))
(( segid "B " and resid 22 and name HB2 ))
OR { 748}
(( segid "B " and resid 27 and name HG2 ))
(( segid "B " and resid 27 and name HB1 ))
ASSI { 750}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 28 and name HB1 ))
3.100 1.200 1.200 peak 750 weight 0.10000E+01 volume 0.22432E-02 ppm1 2.366 ppm2 2.102 CV 1
OR { 750}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 29 and name HB2 ))
OR { 750}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 28 and name HB1 ))
ASSI { 751}
(( segid "A " and resid 1 and name HG2 ))
(( segid "A " and resid 1 and name HE1 ))
3.400 1.500 1.500 peak 751 weight 0.10000E+01 volume 0.19579E-02 ppm1 2.423 ppm2 2.087 CV 1
OR { 751}
(( segid "A " and resid 1 and name HG2 ))
(( segid "A " and resid 4 and name HB ))
ASSI { 755}
(( segid "A " and resid 8 and name HD1 ))
( segid "A " and resid 4 and name HG2%)
3.200 1.300 1.300 peak 755 weight 0.10000E+01 volume 0.26841E-02 ppm1 1.694 ppm2 0.977 CV 1
OR { 755}
(( segid "A " and resid 8 and name HD1 ))
( segid "A " and resid 4 and name HG1%)
OR { 755}
(( segid "A " and resid 3 and name HB2 ))
( segid "A " and resid 4 and name HG2%)
ASSI { 756}
(( segid "A " and resid 8 and name HD1 ))
( segid "A " and resid 4 and name HG2%)
3.100 1.200 1.200 peak 756 weight 0.10000E+01 volume 0.30731E-02 ppm1 1.693 ppm2 0.944 CV 1
OR { 756}
(( segid "B " and resid 12 and name HD2 ))
(( segid "B " and resid 13 and name HD11))
OR { 756}
(( segid "A " and resid 8 and name HD1 ))
( segid "A " and resid 4 and name HG1%)
ASSI { 758}
(( segid "B " and resid 14 and name HB2 ))
(( segid "B " and resid 14 and name HD11))
2.300 0.700 0.700 peak 758 weight 0.10000E+01 volume 0.65998E-02 ppm1 1.619 ppm2 0.955 CV 1
OR { 758}
(( segid "B " and resid 14 and name HG ))
(( segid "B " and resid 14 and name HD21))
OR { 758}
(( segid "B " and resid 14 and name HG ))
(( segid "B " and resid 14 and name HD11))
OR { 758}
(( segid "B " and resid 13 and name HG ))
(( segid "B " and resid 13 and name HD11))
OR { 758}
(( segid "B " and resid 13 and name HB2 ))
(( segid "B " and resid 13 and name HD11))
OR { 758}
(( segid "B " and resid 14 and name HB2 ))
(( segid "B " and resid 14 and name HD21))
ASSI { 759}
(( segid "B " and resid 14 and name HB2 ))
(( segid "B " and resid 14 and name HD11))
2.300 0.700 0.700 peak 759 weight 0.10000E+01 volume 0.59127E-02 ppm1 1.619 ppm2 0.917 CV 1
OR { 759}
(( segid "B " and resid 14 and name HG ))
(( segid "B " and resid 14 and name HD21))
OR { 759}
(( segid "B " and resid 14 and name HG ))
(( segid "B " and resid 14 and name HD11))
OR { 759}
(( segid "B " and resid 13 and name HG ))
(( segid "B " and resid 13 and name HD11))
OR { 759}
(( segid "B " and resid 14 and name HB2 ))
(( segid "B " and resid 14 and name HD21))
ASSI { 761}
(( segid "B " and resid 15 and name HB ))
(( segid "B " and resid 15 and name HG21))
2.800 1.000 1.000 peak 761 weight 0.10000E+01 volume 0.32805E-02 ppm1 1.828 ppm2 0.865 CV 1
OR { 761}
(( segid "B " and resid 17 and name HB ))
(( segid "B " and resid 17 and name HG21))
ASSI { 762}
(( segid "A " and resid 1 and name HB2 ))
( segid "A " and resid 4 and name HG1%)
2.500 0.800 0.800 peak 762 weight 0.10000E+01 volume 0.24506E-02 ppm1 1.880 ppm2 0.908 CV 1
OR { 762}
(( segid "B " and resid 17 and name HB ))
(( segid "B " and resid 17 and name HG21))
ASSI { 764}
(( segid "A " and resid 8 and name HB1 ))
( segid "A " and resid 4 and name HG2%)
4.100 2.100 1.900 peak 764 weight 0.10000E+01 volume 0.97248E-03 ppm1 1.804 ppm2 0.944 CV 1
OR { 764}
(( segid "A " and resid 8 and name HB1 ))
( segid "A " and resid 4 and name HG1%)
OR { 764}
(( segid "B " and resid 15 and name HB ))
( segid "A " and resid 4 and name HG2%)
ASSI { 765}
(( segid "B " and resid 21 and name HD2 ))
(( segid "B " and resid 17 and name HG21))
3.200 1.300 1.300 peak 765 weight 0.10000E+01 volume 0.13355E-02 ppm1 1.698 ppm2 0.912 CV 1
OR { 765}
(( segid "B " and resid 12 and name HD2 ))
(( segid "B " and resid 13 and name HD11))
OR { 765}
(( segid "A " and resid 8 and name HD1 ))
( segid "A " and resid 4 and name HG1%)
OR { 765}
(( segid "A " and resid 3 and name HB2 ))
( segid "A " and resid 4 and name HG1%)
ASSI { 766}
(( segid "B " and resid 21 and name HD2 ))
(( segid "B " and resid 17 and name HG21))
3.300 1.400 1.400 peak 766 weight 0.10000E+01 volume 0.11151E-02 ppm1 1.726 ppm2 0.899 CV 1
OR { 766}
(( segid "B " and resid 12 and name HD2 ))
(( segid "B " and resid 13 and name HD11))
ASSI { 767}
(( segid "B " and resid 21 and name HD2 ))
(( segid "B " and resid 17 and name HG21))
3.200 1.300 1.300 peak 767 weight 0.10000E+01 volume 0.15171E-02 ppm1 1.694 ppm2 0.869 CV 1
OR { 767}
(( segid "B " and resid 12 and name HD2 ))
(( segid "B " and resid 13 and name HD11))
OR { 767}
(( segid "A " and resid 11 and name HG1 ))
(( segid "B " and resid 15 and name HG21))
ASSI { 768}
(( segid "B " and resid 21 and name HD2 ))
(( segid "B " and resid 17 and name HG21))
3.200 1.300 1.300 peak 768 weight 0.10000E+01 volume 0.10762E-02 ppm1 1.712 ppm2 0.831 CV 1
OR { 768}
(( segid "B " and resid 21 and name HD2 ))
(( segid "B " and resid 17 and name HD11))
OR { 768}
(( segid "B " and resid 20 and name HG1 ))
(( segid "B " and resid 17 and name HD11))
OR { 768}
(( segid "A " and resid 3 and name HB2 ))
(( segid "B " and resid 15 and name HD11))
OR { 768}
(( segid "A " and resid 3 and name HB2 ))
(( segid "B " and resid 15 and name HG21))
ASSI { 769}
(( segid "B " and resid 14 and name HG ))
(( segid "B " and resid 15 and name HD11))
3.600 1.600 1.600 peak 769 weight 0.10000E+01 volume 0.18023E-02 ppm1 1.625 ppm2 0.845 CV 1
OR { 769}
(( segid "B " and resid 14 and name HG ))
(( segid "B " and resid 15 and name HG21))
OR { 769}
(( segid "B " and resid 14 and name HB2 ))
(( segid "B " and resid 15 and name HD11))
OR { 769}
(( segid "A " and resid 11 and name HG1 ))
(( segid "B " and resid 15 and name HG21))
ASSI { 771}
(( segid "B " and resid 12 and name HG2 ))
(( segid "B " and resid 13 and name HD11))
2.600 0.800 0.800 peak 771 weight 0.10000E+01 volume 0.21654E-02 ppm1 1.392 ppm2 0.862 CV 1
OR { 771}
(( segid "B " and resid 21 and name HG1 ))
(( segid "B " and resid 17 and name HG21))
OR { 771}
(( segid "A " and resid 8 and name HG1 ))
(( segid "B " and resid 15 and name HG21))
ASSI { 772}
(( segid "B " and resid 21 and name HG1 ))
(( segid "B " and resid 17 and name HG21))
2.900 1.100 1.100 peak 772 weight 0.10000E+01 volume 0.19968E-02 ppm1 1.399 ppm2 0.839 CV 1
OR { 772}
(( segid "B " and resid 21 and name HG1 ))
(( segid "B " and resid 17 and name HD11))
OR { 772}
(( segid "A " and resid 8 and name HG1 ))
(( segid "B " and resid 15 and name HD11))
OR { 772}
(( segid "B " and resid 12 and name HG2 ))
(( segid "B " and resid 15 and name HD11))
ASSI { 777}
(( segid "B " and resid 12 and name HG2 ))
(( segid "B " and resid 13 and name HD11))
2.900 1.000 1.000 peak 777 weight 0.10000E+01 volume 0.12059E-02 ppm1 1.442 ppm2 0.955 CV 1
OR { 777}
(( segid "B " and resid 12 and name HG2 ))
(( segid "B " and resid 14 and name HD21))
ASSI { 779}
(( segid "B " and resid 21 and name HG1 ))
(( segid "B " and resid 17 and name HD11))
3.200 1.300 1.300 peak 779 weight 0.10000E+01 volume 0.68723E-03 ppm1 1.414 ppm2 0.796 CV 1
OR { 779}
(( segid "B " and resid 12 and name HG2 ))
(( segid "B " and resid 15 and name HD11))
ASSI { 784}
( segid "B " and resid 15 and name HG1%)
(( segid "B " and resid 15 and name HD11))
2.700 0.900 0.900 peak 784 weight 0.10000E+01 volume 0.18801E-02 ppm1 1.143 ppm2 0.842 CV 1
OR { 784}
( segid "B " and resid 15 and name HG1%)
(( segid "B " and resid 15 and name HG21))
OR { 784}
( segid "B " and resid 17 and name HG1%)
(( segid "B " and resid 17 and name HG21))
ASSI { 785}
( segid "B " and resid 15 and name HG1%)
(( segid "B " and resid 15 and name HG21))
2.800 1.000 1.000 peak 785 weight 0.10000E+01 volume 0.23599E-02 ppm1 1.148 ppm2 0.864 CV 1
OR { 785}
( segid "B " and resid 17 and name HG1%)
(( segid "B " and resid 17 and name HG21))
ASSI { 789}
(( segid "B " and resid 17 and name HB ))
( segid "B " and resid 17 and name HG1%)
2.900 1.100 1.100 peak 789 weight 0.10000E+01 volume 0.10632E-02 ppm1 1.823 ppm2 1.142 CV 1
OR { 789}
(( segid "B " and resid 15 and name HB ))
( segid "B " and resid 15 and name HG1%)
ASSI { 793}
(( segid "B " and resid 21 and name HD2 ))
(( segid "B " and resid 21 and name HG1 ))
2.100 0.500 0.500 peak 793 weight 0.10000E+01 volume 0.11190E-01 ppm1 1.686 ppm2 1.356 CV 1
OR { 793}
(( segid "A " and resid 8 and name HD1 ))
(( segid "A " and resid 8 and name HG1 ))
OR { 793}
(( segid "B " and resid 34 and name HB2 ))
(( segid "B " and resid 34 and name HG2 ))
ASSI { 794}
(( segid "B " and resid 21 and name HD2 ))
(( segid "B " and resid 21 and name HG1 ))
2.000 0.500 0.500 peak 794 weight 0.10000E+01 volume 0.14535E-01 ppm1 1.686 ppm2 1.394 CV 1
OR { 794}
(( segid "A " and resid 8 and name HD1 ))
(( segid "A " and resid 8 and name HG1 ))
OR { 794}
(( segid "B " and resid 12 and name HD2 ))
(( segid "B " and resid 12 and name HG2 ))
ASSI { 795}
(( segid "A " and resid 8 and name HB1 ))
(( segid "A " and resid 8 and name HG1 ))
2.300 0.600 0.600 peak 795 weight 0.10000E+01 volume 0.68204E-02 ppm1 1.801 ppm2 1.395 CV 1
OR { 795}
(( segid "B " and resid 25 and name HB1 ))
(( segid "B " and resid 25 and name HG2 ))
OR { 795}
(( segid "B " and resid 21 and name HB2 ))
(( segid "B " and resid 21 and name HG1 ))
ASSI { 796}
(( segid "A " and resid 8 and name HB1 ))
(( segid "A " and resid 8 and name HG1 ))
2.300 0.600 0.600 peak 796 weight 0.10000E+01 volume 0.61591E-02 ppm1 1.797 ppm2 1.348 CV 1
OR { 796}
(( segid "B " and resid 21 and name HB2 ))
(( segid "B " and resid 21 and name HG1 ))
ASSI { 803}
(( segid "A " and resid 4 and name HB ))
(( segid "A " and resid 8 and name HG1 ))
4.100 2.100 1.900 peak 803 weight 0.10000E+01 volume 0.98545E-03 ppm1 2.093 ppm2 1.400 CV 1
OR { 803}
(( segid "A " and resid 4 and name HB ))
(( segid "B " and resid 12 and name HG2 ))
ASSI { 804}
(( segid "B " and resid 27 and name HB2 ))
(( segid "B " and resid 24 and name HB1 ))
3.500 1.600 1.600 peak 804 weight 0.10000E+01 volume 0.72613E-03 ppm1 1.996 ppm2 1.396 CV 1
OR { 804}
(( segid "B " and resid 22 and name HB2 ))
(( segid "A " and resid 8 and name HG1 ))
ASSI { 805}
(( segid "A " and resid 4 and name HB ))
(( segid "B " and resid 14 and name HG ))
3.500 1.500 1.500 peak 805 weight 0.10000E+01 volume 0.15041E-02 ppm1 2.084 ppm2 1.666 CV 1
OR { 805}
(( segid "A " and resid 4 and name HB ))
(( segid "A " and resid 3 and name HB2 ))
OR { 805}
(( segid "A " and resid 4 and name HB ))
(( segid "A " and resid 8 and name HD1 ))
OR { 805}
(( segid "A " and resid 1 and name HE1 ))
(( segid "B " and resid 14 and name HG ))
OR { 805}
(( segid "B " and resid 28 and name HB1 ))
(( segid "B " and resid 32 and name HG1 ))
ASSI { 806}
(( segid "B " and resid 29 and name HB2 ))
(( segid "B " and resid 30 and name HB1 ))
3.800 1.800 1.800 peak 806 weight 0.10000E+01 volume 0.10114E-02 ppm1 2.092 ppm2 1.712 CV 1
OR { 806}
(( segid "A " and resid 4 and name HB ))
(( segid "A " and resid 3 and name HB2 ))
OR { 806}
(( segid "A " and resid 4 and name HB ))
(( segid "A " and resid 8 and name HD1 ))
ASSI { 807}
(( segid "B " and resid 29 and name HB2 ))
(( segid "B " and resid 30 and name HB2 ))
3.800 1.800 1.800 peak 807 weight 0.10000E+01 volume 0.73909E-03 ppm1 2.106 ppm2 1.763 CV 1
OR { 807}
(( segid "A " and resid 4 and name HB ))
(( segid "A " and resid 8 and name HB1 ))
OR { 807}
(( segid "B " and resid 29 and name HB2 ))
(( segid "B " and resid 30 and name HB1 ))
OR { 807}
(( segid "B " and resid 28 and name HB1 ))
(( segid "B " and resid 32 and name HB2 ))
OR { 807}
(( segid "B " and resid 29 and name HB2 ))
(( segid "B " and resid 32 and name HB2 ))
ASSI { 809}
(( segid "A " and resid 4 and name HB ))
(( segid "A " and resid 1 and name HB2 ))
2.800 1.000 1.000 peak 809 weight 0.10000E+01 volume 0.10892E-02 ppm1 2.086 ppm2 1.886 CV 1
OR { 809}
(( segid "A " and resid 1 and name HE1 ))
(( segid "A " and resid 1 and name HB2 ))
ASSI { 812}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 27 and name HB2 ))
3.300 1.400 1.400 peak 812 weight 0.10000E+01 volume 0.71316E-03 ppm1 2.427 ppm2 2.008 CV 1
OR { 812}
(( segid "A " and resid 1 and name HG2 ))
(( segid "A " and resid 1 and name HE1 ))
ASSI { 813}
(( segid "B " and resid 18 and name HB1 ))
(( segid "B " and resid 22 and name HG1 ))
3.700 1.700 1.700 peak 813 weight 0.10000E+01 volume 0.92062E-03 ppm1 3.199 ppm2 2.278 CV 1
OR { 813}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 27 and name HG2 ))
OR { 813}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 27 and name HG2 ))
ASSI { 814}
(( segid "B " and resid 18 and name HB1 ))
(( segid "B " and resid 22 and name HG1 ))
3.800 1.800 1.800 peak 814 weight 0.10000E+01 volume 0.71316E-03 ppm1 3.190 ppm2 2.206 CV 1
OR { 814}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 27 and name HG2 ))
OR { 814}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 27 and name HG2 ))
OR { 814}
(( segid "B " and resid 18 and name HB1 ))
(( segid "B " and resid 22 and name HG2 ))
ASSI { 815}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 27 and name HG1 ))
4.000 2.000 2.000 peak 815 weight 0.10000E+01 volume 0.79096E-03 ppm1 3.171 ppm2 2.355 CV 1
OR { 815}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 29 and name HG2 ))
OR { 815}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 28 and name HG2 ))
ASSI { 819}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 27 and name HG1 ))
3.900 1.900 1.900 peak 819 weight 0.10000E+01 volume 0.76503E-03 ppm1 3.209 ppm2 2.422 CV 1
OR { 819}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 28 and name HG2 ))
OR { 819}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 27 and name HG1 ))
ASSI { 821}
(( segid "B " and resid 26 and name HB2 ))
(( segid "B " and resid 28 and name HG2 ))
4.400 2.400 1.600 peak 821 weight 0.10000E+01 volume 0.57053E-03 ppm1 3.114 ppm2 2.411 CV 1
OR { 821}
(( segid "B " and resid 23 and name HB2 ))
(( segid "B " and resid 27 and name HG1 ))
OR { 821}
(( segid "B " and resid 26 and name HB2 ))
(( segid "B " and resid 27 and name HG1 ))
ASSI { 825}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 29 and name HB2 ))
3.700 1.700 1.700 peak 825 weight 0.10000E+01 volume 0.99842E-03 ppm1 3.178 ppm2 2.082 CV 1
OR { 825}
(( segid "A " and resid 11 and name HE ))
(( segid "A " and resid 4 and name HB ))
ASSI { 826}
(( segid "B " and resid 26 and name HB2 ))
(( segid "B " and resid 29 and name HB2 ))
3.700 1.700 1.700 peak 826 weight 0.10000E+01 volume 0.77799E-03 ppm1 3.111 ppm2 2.083 CV 1
OR { 826}
(( segid "A " and resid 7 and name HB1 ))
(( segid "A " and resid 4 and name HB ))
ASSI { 827}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 29 and name HB2 ))
3.800 1.800 1.800 peak 827 weight 0.10000E+01 volume 0.11151E-02 ppm1 3.179 ppm2 2.050 CV 1
OR { 827}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 27 and name HB2 ))
OR { 827}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 27 and name HB2 ))
ASSI { 828}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 22 and name HB2 ))
4.100 2.100 1.900 peak 828 weight 0.10000E+01 volume 0.59647E-03 ppm1 3.210 ppm2 2.001 CV 1
OR { 828}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 27 and name HB2 ))
OR { 828}
(( segid "B " and resid 18 and name HB1 ))
(( segid "B " and resid 22 and name HB2 ))
OR { 828}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 27 and name HB2 ))
ASSI { 829}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 22 and name HB2 ))
4.200 2.200 1.800 peak 829 weight 0.10000E+01 volume 0.57053E-03 ppm1 3.180 ppm2 1.995 CV 1
OR { 829}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 27 and name HB2 ))
OR { 829}
(( segid "B " and resid 18 and name HB1 ))
(( segid "B " and resid 22 and name HB2 ))
OR { 829}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 27 and name HB2 ))
OR { 829}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 27 and name HB1 ))
OR { 829}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 27 and name HB1 ))
ASSI { 830}
(( segid "B " and resid 26 and name HB2 ))
(( segid "B " and resid 29 and name HB2 ))
3.800 1.800 1.800 peak 830 weight 0.10000E+01 volume 0.80392E-03 ppm1 3.136 ppm2 2.051 CV 1
OR { 830}
(( segid "A " and resid 7 and name HB1 ))
(( segid "A " and resid 4 and name HB ))
OR { 830}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 29 and name HB2 ))
OR { 830}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 27 and name HB2 ))
ASSI { 839}
(( segid "B " and resid 12 and name HE2 ))
(( segid "B " and resid 12 and name HB2 ))
4.300 2.300 1.700 peak 839 weight 0.10000E+01 volume 0.60943E-03 ppm1 2.960 ppm2 1.947 CV 1
OR { 839}
(( segid "A " and resid 8 and name HE2 ))
(( segid "B " and resid 22 and name HB2 ))
ASSI { 842}
(( segid "A " and resid 8 and name HE2 ))
(( segid "A " and resid 9 and name HB1 ))
4.300 2.400 1.700 peak 842 weight 0.10000E+01 volume 0.59647E-03 ppm1 2.961 ppm2 1.868 CV 1
OR { 842}
(( segid "B " and resid 12 and name HE2 ))
(( segid "B " and resid 12 and name HB2 ))
ASSI { 843}
(( segid "A " and resid 8 and name HE2 ))
(( segid "A " and resid 9 and name HB1 ))
3.200 1.300 1.300 peak 843 weight 0.10000E+01 volume 0.32415E-02 ppm1 2.998 ppm2 1.800 CV 1
OR { 843}
(( segid "A " and resid 8 and name HE2 ))
(( segid "A " and resid 8 and name HB1 ))
ASSI { 844}
(( segid "A " and resid 11 and name HE ))
(( segid "A " and resid 11 and name HB2 ))
2.400 0.700 0.700 peak 844 weight 0.10000E+01 volume 0.49271E-02 ppm1 3.191 ppm2 1.839 CV 1
OR { 844}
(( segid "A " and resid 9 and name HD2 ))
(( segid "A " and resid 9 and name HB1 ))
OR { 844}
(( segid "A " and resid 11 and name HD1 ))
(( segid "A " and resid 11 and name HB2 ))
OR { 844}
(( segid "A " and resid 9 and name HD1 ))
(( segid "A " and resid 9 and name HB1 ))
OR { 844}
(( segid "B " and resid 32 and name HD2 ))
(( segid "B " and resid 32 and name HB1 ))
ASSI { 845}
(( segid "B " and resid 32 and name HD2 ))
(( segid "B " and resid 32 and name HB2 ))
2.300 0.700 0.700 peak 845 weight 0.10000E+01 volume 0.57183E-02 ppm1 3.194 ppm2 1.761 CV 1
OR { 845}
(( segid "A " and resid 9 and name HD1 ))
(( segid "A " and resid 9 and name HB2 ))
OR { 845}
(( segid "A " and resid 9 and name HD2 ))
(( segid "A " and resid 9 and name HB2 ))
ASSI { 846}
(( segid "A " and resid 8 and name HE2 ))
(( segid "A " and resid 8 and name HD1 ))
1.700 0.400 0.500 peak 846 weight 0.10000E+01 volume 0.21135E-01 ppm1 2.995 ppm2 1.689 CV 1
OR { 846}
(( segid "B " and resid 12 and name HE2 ))
(( segid "B " and resid 12 and name HD2 ))
OR { 846}
(( segid "A " and resid 8 and name HE2 ))
(( segid "A " and resid 9 and name HB2 ))
ASSI { 847}
(( segid "A " and resid 8 and name HE2 ))
(( segid "A " and resid 8 and name HD1 ))
2.200 0.600 0.600 peak 847 weight 0.10000E+01 volume 0.73648E-02 ppm1 2.958 ppm2 1.656 CV 1
OR { 847}
(( segid "A " and resid 8 and name HE2 ))
(( segid "A " and resid 9 and name HG1 ))
ASSI { 849}
(( segid "A " and resid 2 and name HB2 ))
(( segid "A " and resid 3 and name HB2 ))
4.700 2.700 1.300 peak 849 weight 0.10000E+01 volume 0.58350E-03 ppm1 3.301 ppm2 1.746 CV 1
OR { 849}
(( segid "B " and resid 35 and name HB2 ))
(( segid "B " and resid 34 and name HB2 ))
ASSI { 852}
(( segid "B " and resid 18 and name HB1 ))
( segid "B " and resid 15 and name HG1%)
4.800 2.900 1.200 peak 852 weight 0.10000E+01 volume 0.50568E-03 ppm1 3.259 ppm2 1.146 CV 1
OR { 852}
(( segid "B " and resid 18 and name HB1 ))
( segid "B " and resid 17 and name HG1%)
OR { 852}
(( segid "A " and resid 2 and name HB2 ))
( segid "B " and resid 15 and name HG1%)
OR { 852}
(( segid "B " and resid 18 and name HB2 ))
( segid "B " and resid 17 and name HG1%)
ASSI { 857}
(( segid "B " and resid 15 and name HB ))
(( segid "A " and resid 3 and name HG2 ))
4.800 2.800 1.200 peak 857 weight 0.10000E+01 volume 0.51864E-03 ppm1 1.802 ppm2 1.091 CV 1
OR { 857}
(( segid "A " and resid 8 and name HB1 ))
(( segid "A " and resid 3 and name HG2 ))
ASSI { 858}
(( segid "B " and resid 12 and name HD2 ))
( segid "B " and resid 15 and name HG1%)
4.000 2.000 2.000 peak 858 weight 0.10000E+01 volume 0.10243E-02 ppm1 1.693 ppm2 1.205 CV 1
OR { 858}
(( segid "B " and resid 20 and name HG1 ))
( segid "B " and resid 17 and name HG1%)
OR { 858}
(( segid "A " and resid 3 and name HB2 ))
( segid "B " and resid 15 and name HG1%)
ASSI { 860}
(( segid "A " and resid 8 and name HG1 ))
(( segid "A " and resid 3 and name HG2 ))
4.600 2.700 1.400 peak 860 weight 0.10000E+01 volume 0.77799E-03 ppm1 1.388 ppm2 1.092 CV 1
OR { 860}
(( segid "B " and resid 12 and name HG2 ))
(( segid "A " and resid 3 and name HG2 ))
ASSI { 872}
(( segid "B " and resid 17 and name HA ))
(( segid "B " and resid 17 and name HD11))
3.400 1.500 1.500 peak 872 weight 0.10000E+01 volume 0.53161E-03 ppm1 4.042 ppm2 0.788 CV 1
OR { 872}
(( segid "A " and resid 4 and name HA ))
(( segid "B " and resid 15 and name HD11))
ASSI { 873}
(( segid "B " and resid 22 and name HG1 ))
(( segid "B " and resid 15 and name HG21))
2.700 2.700 3.300 peak 873 weight 0.10000E+01 volume 0.55757E-03 ppm1 2.269 ppm2 0.878 CV 1
OR { 873}
(( segid "B " and resid 22 and name HG1 ))
(( segid "B " and resid 17 and name HG21))
ASSI { 883}
(( segid "B " and resid 17 and name HB ))
(( segid "B " and resid 17 and name HG21))
3.400 1.400 1.400 peak 883 weight 0.10000E+01 volume 0.11410E-02 ppm1 1.871 ppm2 0.835 CV 1
OR { 883}
(( segid "B " and resid 20 and name HB2 ))
(( segid "B " and resid 17 and name HD11))
OR { 883}
(( segid "B " and resid 17 and name HB ))
(( segid "B " and resid 17 and name HD11))
ASSI { 884}
(( segid "B " and resid 17 and name HB ))
(( segid "B " and resid 17 and name HD11))
3.900 1.900 1.900 peak 884 weight 0.10000E+01 volume 0.75206E-03 ppm1 1.827 ppm2 0.804 CV 1
OR { 884}
(( segid "B " and resid 15 and name HB ))
(( segid "B " and resid 15 and name HD11))
ASSI { 885}
(( segid "A " and resid 8 and name HB1 ))
(( segid "B " and resid 15 and name HD11))
4.300 2.300 1.700 peak 885 weight 0.10000E+01 volume 0.38898E-03 ppm1 1.772 ppm2 0.818 CV 1
OR { 885}
(( segid "B " and resid 15 and name HB ))
(( segid "B " and resid 15 and name HD11))
ASSI { 887}
(( segid "B " and resid 14 and name HG ))
(( segid "B " and resid 15 and name HD11))
4.100 2.100 1.900 peak 887 weight 0.10000E+01 volume 0.71316E-03 ppm1 1.621 ppm2 0.806 CV 1
OR { 887}
(( segid "B " and resid 20 and name HG1 ))
(( segid "B " and resid 17 and name HD11))
ASSI { 888}
(( segid "B " and resid 21 and name HD2 ))
(( segid "B " and resid 17 and name HD11))
3.700 1.700 1.700 peak 888 weight 0.10000E+01 volume 0.60943E-03 ppm1 1.727 ppm2 0.806 CV 1
OR { 888}
(( segid "A " and resid 3 and name HB2 ))
(( segid "B " and resid 15 and name HD11))
OR { 888}
(( segid "B " and resid 12 and name HD2 ))
(( segid "B " and resid 15 and name HD11))
ASSI { 894}
(( segid "A " and resid 8 and name HD1 ))
(( segid "A " and resid 8 and name HG1 ))
2.400 0.700 0.700 peak 894 weight 0.10000E+01 volume 0.31248E-02 ppm1 1.641 ppm2 1.307 CV 1
OR { 894}
(( segid "B " and resid 34 and name HD1 ))
(( segid "B " and resid 34 and name HG2 ))
ASSI { 900}
(( segid "A " and resid 3 and name HD1 ))
(( segid "B " and resid 12 and name HG2 ))
3.600 1.600 1.600 peak 900 weight 0.10000E+01 volume 0.18542E-02 ppm1 1.558 ppm2 1.413 CV 1
OR { 900}
(( segid "B " and resid 30 and name HG1 ))
(( segid "B " and resid 31 and name HB1 ))
OR { 900}
(( segid "B " and resid 13 and name HG ))
(( segid "B " and resid 12 and name HG2 ))
ASSI { 901}
(( segid "B " and resid 14 and name HG ))
(( segid "B " and resid 12 and name HG2 ))
3.700 1.700 1.700 peak 901 weight 0.10000E+01 volume 0.10243E-02 ppm1 1.627 ppm2 1.463 CV 1
OR { 901}
(( segid "B " and resid 13 and name HG ))
(( segid "B " and resid 12 and name HG2 ))
OR { 901}
(( segid "B " and resid 13 and name HB2 ))
(( segid "B " and resid 12 and name HG2 ))
OR { 901}
(( segid "B " and resid 32 and name HG1 ))
(( segid "B " and resid 33 and name HB1 ))
OR { 901}
(( segid "B " and resid 25 and name HD2 ))
(( segid "B " and resid 24 and name HB1 ))
ASSI { 904}
(( segid "B " and resid 32 and name HB1 ))
(( segid "B " and resid 32 and name HG1 ))
2.200 0.600 0.600 peak 904 weight 0.10000E+01 volume 0.11034E-01 ppm1 1.839 ppm2 1.647 CV 1
OR { 904}
(( segid "A " and resid 11 and name HB2 ))
(( segid "A " and resid 11 and name HG1 ))
OR { 904}
(( segid "A " and resid 9 and name HB1 ))
(( segid "A " and resid 9 and name HG1 ))
OR { 904}
(( segid "B " and resid 21 and name HB2 ))
(( segid "B " and resid 21 and name HD2 ))
ASSI { 905}
(( segid "B " and resid 34 and name HB2 ))
(( segid "B " and resid 34 and name HD1 ))
2.000 0.500 0.500 peak 905 weight 0.10000E+01 volume 0.14068E-01 ppm1 1.756 ppm2 1.631 CV 1
OR { 905}
(( segid "A " and resid 9 and name HB2 ))
(( segid "A " and resid 9 and name HG1 ))
OR { 905}
(( segid "B " and resid 32 and name HB2 ))
(( segid "B " and resid 32 and name HG1 ))
OR { 905}
(( segid "B " and resid 25 and name HB1 ))
(( segid "B " and resid 25 and name HD2 ))
ASSI { 908}
(( segid "B " and resid 27 and name HB2 ))
(( segid "B " and resid 25 and name HD2 ))
4.000 2.000 2.000 peak 908 weight 0.10000E+01 volume 0.49271E-03 ppm1 1.999 ppm2 1.661 CV 1
OR { 908}
(( segid "B " and resid 22 and name HB2 ))
(( segid "B " and resid 25 and name HD2 ))
ASSI { 909}
(( segid "B " and resid 27 and name HB1 ))
(( segid "B " and resid 30 and name HG1 ))
4.100 2.100 1.900 peak 909 weight 0.10000E+01 volume 0.55757E-03 ppm1 1.965 ppm2 1.599 CV 1
OR { 909}
(( segid "B " and resid 22 and name HB2 ))
(( segid "B " and resid 25 and name HD2 ))
OR { 909}
(( segid "B " and resid 27 and name HB1 ))
(( segid "B " and resid 25 and name HD2 ))
ASSI { 912}
(( segid "A " and resid 4 and name HB ))
(( segid "A " and resid 3 and name HD1 ))
4.300 2.300 1.700 peak 912 weight 0.10000E+01 volume 0.73909E-03 ppm1 2.079 ppm2 1.540 CV 1
OR { 912}
(( segid "B " and resid 29 and name HB2 ))
(( segid "B " and resid 33 and name HB1 ))
ASSI { 913}
(( segid "A " and resid 4 and name HB ))
(( segid "A " and resid 3 and name HD1 ))
4.400 2.500 1.600 peak 913 weight 0.10000E+01 volume 0.75206E-03 ppm1 2.084 ppm2 1.585 CV 1
OR { 913}
(( segid "A " and resid 4 and name HB ))
(( segid "B " and resid 14 and name HG ))
OR { 913}
(( segid "B " and resid 29 and name HB2 ))
(( segid "B " and resid 30 and name HG1 ))
ASSI { 916}
(( segid "B " and resid 27 and name HB1 ))
(( segid "B " and resid 31 and name HB1 ))
3.600 1.600 1.600 peak 916 weight 0.10000E+01 volume 0.46678E-03 ppm1 1.958 ppm2 1.340 CV 1
OR { 916}
(( segid "B " and resid 20 and name HB2 ))
(( segid "B " and resid 21 and name HG1 ))
OR { 916}
(( segid "B " and resid 22 and name HB2 ))
(( segid "A " and resid 8 and name HG1 ))
ASSI { 920}
(( segid "B " and resid 21 and name HD2 ))
(( segid "B " and resid 17 and name HD11))
4.100 2.100 1.900 peak 920 weight 0.10000E+01 volume 0.45381E-03 ppm1 1.680 ppm2 0.767 CV 1
OR { 920}
(( segid "B " and resid 14 and name HB2 ))
(( segid "B " and resid 15 and name HD11))
OR { 920}
(( segid "B " and resid 20 and name HG1 ))
(( segid "B " and resid 17 and name HD11))
OR { 920}
(( segid "A " and resid 3 and name HB2 ))
(( segid "B " and resid 15 and name HD11))
ASSI { 922}
(( segid "A " and resid 7 and name HB2 ))
(( segid "B " and resid 15 and name HD11))
4.300 2.300 1.700 peak 922 weight 0.10000E+01 volume 0.53161E-03 ppm1 2.999 ppm2 0.814 CV 1
OR { 922}
(( segid "B " and resid 12 and name HE2 ))
(( segid "B " and resid 15 and name HD11))
ASSI { 927}
(( segid "B " and resid 19 and name HB2 ))
(( segid "B " and resid 21 and name HG1 ))
4.800 2.900 1.200 peak 927 weight 0.10000E+01 volume 0.38898E-03 ppm1 2.813 ppm2 1.403 CV 1
OR { 927}
(( segid "A " and resid 10 and name HB1 ))
(( segid "B " and resid 12 and name HG2 ))
ASSI { 928}
(( segid "B " and resid 19 and name HB1 ))
(( segid "B " and resid 21 and name HG1 ))
4.300 2.300 1.700 peak 928 weight 0.10000E+01 volume 0.63536E-03 ppm1 2.737 ppm2 1.398 CV 1
OR { 928}
(( segid "B " and resid 19 and name HB2 ))
(( segid "B " and resid 21 and name HG1 ))
OR { 928}
(( segid "B " and resid 19 and name HB2 ))
(( segid "A " and resid 8 and name HG1 ))
ASSI { 934}
(( segid "A " and resid 3 and name HE1 ))
(( segid "B " and resid 15 and name HB ))
4.500 2.600 1.500 peak 934 weight 0.10000E+01 volume 0.44085E-03 ppm1 2.840 ppm2 1.831 CV 1
OR { 934}
(( segid "A " and resid 10 and name HB1 ))
(( segid "A " and resid 11 and name HB2 ))
ASSI { 935}
(( segid "B " and resid 23 and name HB2 ))
(( segid "B " and resid 22 and name HB2 ))
3.900 1.900 1.900 peak 935 weight 0.10000E+01 volume 0.44085E-03 ppm1 3.090 ppm2 1.946 CV 1
OR { 935}
(( segid "A " and resid 7 and name HB1 ))
(( segid "A " and resid 11 and name HB1 ))
OR { 935}
(( segid "B " and resid 26 and name HB2 ))
(( segid "B " and resid 27 and name HB1 ))
OR { 935}
(( segid "B " and resid 23 and name HB2 ))
(( segid "B " and resid 27 and name HB1 ))
ASSI { 936}
(( segid "A " and resid 7 and name HB1 ))
(( segid "A " and resid 11 and name HB1 ))
4.300 2.300 1.700 peak 936 weight 0.10000E+01 volume 0.53161E-03 ppm1 3.122 ppm2 1.911 CV 1
OR { 936}
(( segid "B " and resid 26 and name HB2 ))
(( segid "B " and resid 27 and name HB1 ))
OR { 936}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 27 and name HB1 ))
ASSI { 938}
(( segid "B " and resid 18 and name HB2 ))
(( segid "B " and resid 21 and name HB2 ))
4.300 2.300 1.700 peak 938 weight 0.10000E+01 volume 0.59647E-03 ppm1 3.302 ppm2 1.829 CV 1
OR { 938}
(( segid "B " and resid 18 and name HB2 ))
(( segid "A " and resid 8 and name HB1 ))
OR { 938}
(( segid "B " and resid 18 and name HB2 ))
(( segid "B " and resid 15 and name HB ))
OR { 938}
(( segid "A " and resid 2 and name HB2 ))
(( segid "B " and resid 15 and name HB ))
ASSI { 941}
(( segid "B " and resid 18 and name HB2 ))
(( segid "B " and resid 22 and name HB2 ))
4.500 2.500 1.500 peak 941 weight 0.10000E+01 volume 0.41492E-03 ppm1 3.295 ppm2 1.958 CV 1
OR { 941}
(( segid "B " and resid 18 and name HB2 ))
(( segid "B " and resid 20 and name HB2 ))
ASSI { 945}
(( segid "B " and resid 13 and name HA ))
(( segid "B " and resid 15 and name HB ))
3.700 1.700 1.700 peak 945 weight 0.10000E+01 volume 0.60943E-03 ppm1 4.365 ppm2 1.816 CV 1
OR { 945}
(( segid "B " and resid 16 and name HA ))
(( segid "B " and resid 15 and name HB ))
OR { 945}
(( segid "B " and resid 16 and name HA ))
(( segid "B " and resid 17 and name HB ))
ASSI { 956}
(( segid "B " and resid 19 and name HA ))
(( segid "A " and resid 8 and name HA ))
4.000 2.000 2.000 peak 956 weight 0.10000E+01 volume 0.47975E-03 ppm1 4.616 ppm2 4.237 CV 1
OR { 956}
(( segid "A " and resid 2 and name HA ))
(( segid "A " and resid 1 and name HA ))
OR { 956}
(( segid "B " and resid 19 and name HA ))
(( segid "B " and resid 20 and name HA ))
OR { 956}
(( segid "B " and resid 19 and name HA ))
(( segid "B " and resid 22 and name HA ))
OR { 956}
(( segid "B " and resid 18 and name HA ))
(( segid "B " and resid 21 and name HA ))
ASSI { 958}
(( segid "B " and resid 18 and name HA ))
(( segid "B " and resid 14 and name HB2 ))
4.600 2.700 1.400 peak 958 weight 0.10000E+01 volume 0.37602E-03 ppm1 4.620 ppm2 1.640 CV 1
OR { 958}
(( segid "B " and resid 19 and name HA ))
(( segid "B " and resid 20 and name HG1 ))
OR { 958}
(( segid "B " and resid 19 and name HA ))
(( segid "A " and resid 11 and name HG1 ))
ASSI { 959}
(( segid "A " and resid 2 and name HA ))
(( segid "A " and resid 4 and name HB ))
4.300 2.300 1.700 peak 959 weight 0.10000E+01 volume 0.72613E-03 ppm1 4.623 ppm2 2.048 CV 1
OR { 959}
(( segid "A " and resid 2 and name HA ))
(( segid "A " and resid 1 and name HE1 ))
ASSI { 3}
( segid "A " and resid 7 and name HE% )
(( segid "A " and resid 7 and name HA ))
3.300 1.400 1.400 peak 3 weight 0.10000E+01 volume 0.26710E-02 ppm1 7.362 ppm2 4.550 CV 1
OR { 3}
( segid "B " and resid 23 and name HE% )
(( segid "B " and resid 23 and name HA ))
ASSI { 30}
(( segid "A " and resid 3 and name HN ))
(( segid "A " and resid 2 and name HB2 ))
2.300 0.600 0.600 peak 30 weight 0.10000E+01 volume 0.75206E-03 ppm1 7.668 ppm2 3.300 CV 1
OR { 30}
(( segid "B " and resid 35 and name HE3 ))
(( segid "B " and resid 35 and name HB2 ))
ASSI { 49}
( segid "A " and resid 7 and name HE% )
(( segid "A " and resid 7 and name HB1 ))
3.500 1.500 1.500 peak 49 weight 0.10000E+01 volume 0.26061E-02 ppm1 7.361 ppm2 3.112 CV 1
OR { 49}
( segid "B " and resid 26 and name HE% )
(( segid "B " and resid 26 and name HB2 ))
ASSI { 73}
( segid "B " and resid 23 and name HE% )
(( segid "B " and resid 23 and name HB1 ))
3.800 1.800 1.800 peak 73 weight 0.10000E+01 volume 0.19320E-02 ppm1 7.356 ppm2 3.201 CV 1
OR { 73}
( segid "B " and resid 26 and name HE% )
(( segid "B " and resid 26 and name HB1 ))
ASSI { 80}
(( segid "A " and resid 7 and name HZ ))
(( segid "A " and resid 10 and name HB1 ))
4.300 2.300 1.700 peak 80 weight 0.10000E+01 volume 0.66130E-03 ppm1 7.330 ppm2 2.893 CV 1
OR { 80}
(( segid "A " and resid 7 and name HZ ))
(( segid "A " and resid 3 and name HE1 ))
ASSI { 82}
( segid "B " and resid 26 and name HE% )
(( segid "B " and resid 27 and name HG2 ))
3.300 1.400 1.400 peak 82 weight 0.10000E+01 volume 0.67426E-03 ppm1 7.332 ppm2 2.276 CV 1
OR { 82}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 22 and name HG1 ))
ASSI { 104}
( segid "A " and resid 6 and name HE% )
( segid "A " and resid 4 and name HG1%)
2.000 2.000 4.000 peak 104 weight 0.10000E+01 volume 0.31248E-02 ppm1 7.323 ppm2 0.946 CV 1
OR { 104}
(( segid "B " and resid 18 and name HD1 ))
( segid "A " and resid 4 and name HG1%)
ASSI { 114}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 15 and name HD13))
3.000 1.100 1.100 peak 114 weight 0.10000E+01 volume 0.15171E-02 ppm1 7.315 ppm2 0.868 CV 1
OR { 114}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 15 and name HD13))
OR { 114}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 14 and name HD12))
OR { 114}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 15 and name HD11))
OR { 114}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 15 and name HD11))
OR { 114}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 14 and name HD11))
OR { 114}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 15 and name HD12))
OR { 114}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 15 and name HD12))
ASSI { 123}
( segid "B " and resid 26 and name HD% )
(( segid "B " and resid 26 and name HB2 ))
3.000 1.100 1.100 peak 123 weight 0.10000E+01 volume 0.15560E-02 ppm1 7.262 ppm2 3.081 CV 1
OR { 123}
( segid "B " and resid 23 and name HD% )
(( segid "B " and resid 23 and name HB2 ))
ASSI { 127}
( segid "A " and resid 7 and name HD% )
(( segid "A " and resid 4 and name HB ))
3.500 3.500 2.500 peak 127 weight 0.10000E+01 volume 0.31896E-02 ppm1 7.263 ppm2 2.049 CV 1
OR { 127}
(( segid "A " and resid 2 and name HD1 ))
(( segid "A " and resid 4 and name HB ))
ASSI { 155}
( segid "A " and resid 7 and name HD% )
(( segid "A " and resid 8 and name HG1 ))
3.900 1.900 1.900 peak 155 weight 0.10000E+01 volume 0.11670E-02 ppm1 7.251 ppm2 1.357 CV 1
OR { 155}
(( segid "B " and resid 35 and name HD1 ))
(( segid "B " and resid 33 and name HB2 ))
ASSI { 156}
( segid "A " and resid 7 and name HD% )
(( segid "A " and resid 7 and name HB1 ))
2.100 0.600 0.600 peak 156 weight 0.10000E+01 volume 0.62240E-02 ppm1 7.242 ppm2 3.118 CV 1
OR { 156}
( segid "B " and resid 26 and name HD% )
(( segid "B " and resid 26 and name HB2 ))
ASSI { 189}
(( segid "B " and resid 23 and name HA ))
(( segid "B " and resid 22 and name HB2 ))
3.900 1.900 1.900 peak 189 weight 0.10000E+01 volume 0.76503E-03 ppm1 4.560 ppm2 1.886 CV 1
OR { 189}
(( segid "A " and resid 7 and name HA ))
(( segid "A " and resid 11 and name HB1 ))
ASSI { 191}
(( segid "B " and resid 26 and name HA ))
(( segid "B " and resid 25 and name HB1 ))
3.400 1.500 1.500 peak 191 weight 0.10000E+01 volume 0.82986E-03 ppm1 4.562 ppm2 1.767 CV 1
OR { 191}
(( segid "B " and resid 26 and name HA ))
(( segid "B " and resid 30 and name HB1 ))
ASSI { 205}
(( segid "B " and resid 23 and name HA ))
(( segid "B " and resid 25 and name HB1 ))
3.400 1.400 1.400 peak 205 weight 0.10000E+01 volume 0.10762E-02 ppm1 4.550 ppm2 1.792 CV 1
OR { 205}
(( segid "B " and resid 26 and name HA ))
(( segid "B " and resid 25 and name HB1 ))
ASSI { 208}
(( segid "B " and resid 23 and name HA ))
(( segid "B " and resid 25 and name HD2 ))
3.000 1.100 1.100 peak 208 weight 0.10000E+01 volume 0.11670E-02 ppm1 4.552 ppm2 1.636 CV 1
OR { 208}
(( segid "B " and resid 26 and name HA ))
(( segid "B " and resid 25 and name HD2 ))
ASSI { 209}
(( segid "B " and resid 23 and name HA ))
(( segid "B " and resid 25 and name HG2 ))
3.800 1.800 1.800 peak 209 weight 0.10000E+01 volume 0.98545E-03 ppm1 4.550 ppm2 1.399 CV 1
OR { 209}
(( segid "B " and resid 26 and name HA ))
(( segid "B " and resid 25 and name HG2 ))
ASSI { 238}
(( segid "A " and resid 11 and name HA ))
(( segid "A " and resid 11 and name HG1 ))
2.600 0.800 0.800 peak 238 weight 0.10000E+01 volume 0.96339E-02 ppm1 4.285 ppm2 1.634 CV 1
OR { 238}
(( segid "A " and resid 9 and name HA ))
(( segid "A " and resid 9 and name HG1 ))
ASSI { 244}
(( segid "B " and resid 21 and name HA ))
(( segid "B " and resid 22 and name HB2 ))
3.500 1.500 1.500 peak 244 weight 0.10000E+01 volume 0.18412E-02 ppm1 4.257 ppm2 1.996 CV 1
OR { 244}
(( segid "B " and resid 20 and name HA ))
(( segid "B " and resid 22 and name HB2 ))
ASSI { 262}
(( segid "A " and resid 8 and name HA ))
(( segid "A " and resid 8 and name HB1 ))
2.200 0.600 0.600 peak 262 weight 0.10000E+01 volume 0.10697E-01 ppm1 4.233 ppm2 1.796 CV 1
OR { 262}
(( segid "B " and resid 21 and name HA ))
(( segid "B " and resid 21 and name HB2 ))
ASSI { 265}
(( segid "B " and resid 21 and name HA ))
(( segid "B " and resid 24 and name HB3 ))
2.400 0.700 0.700 peak 265 weight 0.10000E+01 volume 0.79354E-02 ppm1 4.234 ppm2 1.394 CV 1
OR { 265}
(( segid "B " and resid 21 and name HA ))
(( segid "B " and resid 21 and name HG1 ))
OR { 265}
(( segid "B " and resid 21 and name HA ))
(( segid "B " and resid 24 and name HB2 ))
ASSI { 291}
(( segid "B " and resid 30 and name HA ))
(( segid "B " and resid 30 and name HG1 ))
2.300 0.700 0.700 peak 291 weight 0.10000E+01 volume 0.10827E-01 ppm1 4.182 ppm2 1.545 CV 1
OR { 291}
(( segid "A " and resid 3 and name HA ))
(( segid "A " and resid 3 and name HD1 ))
ASSI { 343}
(( segid "B " and resid 20 and name HD2 ))
(( segid "B " and resid 20 and name HB2 ))
2.200 0.600 0.600 peak 343 weight 0.10000E+01 volume 0.49271E-02 ppm1 3.204 ppm2 1.911 CV 1
OR { 343}
(( segid "A " and resid 11 and name HE ))
(( segid "A " and resid 11 and name HB1 ))
ASSI { 369}
(( segid "B " and resid 12 and name HA ))
(( segid "B " and resid 15 and name HD12))
4.100 2.100 1.900 peak 369 weight 0.10000E+01 volume 0.80392E-03 ppm1 4.031 ppm2 0.847 CV 1
OR { 369}
(( segid "B " and resid 12 and name HA ))
(( segid "B " and resid 14 and name HD13))
OR { 369}
(( segid "B " and resid 12 and name HA ))
(( segid "B " and resid 14 and name HD12))
OR { 369}
(( segid "B " and resid 12 and name HA ))
(( segid "B " and resid 15 and name HD13))
OR { 369}
(( segid "B " and resid 12 and name HA ))
(( segid "B " and resid 15 and name HD11))
ASSI { 429}
(( segid "A " and resid 6 and name HA ))
(( segid "A " and resid 3 and name HA ))
3.900 3.900 2.100 peak 429 weight 0.10000E+01 volume 0.95952E-03 ppm1 4.509 ppm2 4.178 CV 1
OR { 429}
(( segid "A " and resid 6 and name HA ))
(( segid "A " and resid 8 and name HA ))
ASSI { 446}
( segid "B " and resid 26 and name HD% )
(( segid "B " and resid 27 and name HA ))
4.100 2.100 1.900 peak 446 weight 0.10000E+01 volume 0.54460E-03 ppm1 7.264 ppm2 4.132 CV 1
OR { 446}
( segid "B " and resid 26 and name HD% )
(( segid "B " and resid 25 and name HA ))
ASSI { 626}
(( segid "B " and resid 20 and name HA ))
(( segid "B " and resid 19 and name HB2 ))
4.300 2.300 1.700 peak 626 weight 0.10000E+01 volume 0.55757E-03 ppm1 4.238 ppm2 2.777 CV 1
OR { 626}
(( segid "A " and resid 9 and name HA ))
(( segid "A " and resid 10 and name HB2 ))
ASSI { 640}
(( segid "A " and resid 11 and name HA ))
( segid "B " and resid 15 and name HG1%)
4.600 2.600 1.400 peak 640 weight 0.10000E+01 volume 0.66130E-03 ppm1 4.297 ppm2 1.146 CV 1
OR { 640}
(( segid "B " and resid 20 and name HA ))
( segid "B " and resid 17 and name HG1%)
ASSI { 716}
(( segid "B " and resid 27 and name HG2 ))
(( segid "B " and resid 25 and name HD2 ))
3.700 1.700 1.700 peak 716 weight 0.10000E+01 volume 0.76503E-03 ppm1 2.280 ppm2 1.624 CV 1
OR { 716}
(( segid "B " and resid 27 and name HG2 ))
(( segid "B " and resid 30 and name HG1 ))
ASSI { 729}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 32 and name HB2 ))
3.900 1.900 1.900 peak 729 weight 0.10000E+01 volume 0.72613E-03 ppm1 2.359 ppm2 1.725 CV 1
OR { 729}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 30 and name HB1 ))
ASSI { 743}
(( segid "B " and resid 19 and name HB1 ))
(( segid "B " and resid 20 and name HB2 ))
4.500 2.500 1.500 peak 743 weight 0.10000E+01 volume 0.41492E-03 ppm1 2.728 ppm2 1.934 CV 1
OR { 743}
(( segid "B " and resid 19 and name HB1 ))
(( segid "B " and resid 22 and name HB2 ))
ASSI { 808}
(( segid "B " and resid 22 and name HG2 ))
(( segid "B " and resid 21 and name HB2 ))
3.300 1.400 1.400 peak 808 weight 0.10000E+01 volume 0.71316E-03 ppm1 2.123 ppm2 1.832 CV 1
OR { 808}
(( segid "B " and resid 28 and name HB1 ))
(( segid "B " and resid 32 and name HB1 ))
ASSI { 868}
(( segid "A " and resid 9 and name HA ))
(( segid "B " and resid 22 and name HG1 ))
4.100 2.100 1.900 peak 868 weight 0.10000E+01 volume 0.71316E-03 ppm1 4.298 ppm2 2.256 CV 1
OR { 868}
(( segid "B " and resid 20 and name HA ))
(( segid "B " and resid 22 and name HG1 ))
ASSI { 268}
(( segid "B " and resid 14 and name HN ))
(( segid "B " and resid 14 and name HA ))
2.500 0.800 0.800 peak 268 weight 0.10000E+01 volume 0.33980E-02 ppm1 8.389 ppm2 4.404 CV 1
OR { 268}
(( segid "B " and resid 14 and name HN ))
(( segid "B " and resid 13 and name HA ))
ASSI { 12}
(( segid "B " and resid 20 and name HN ))
(( segid "B " and resid 19 and name HA ))
2.700 0.900 0.900 peak 12 weight 0.10000E+01 volume 0.29395E-02 ppm1 8.236 ppm2 4.626 CV 1
OR { 12}
(( segid "B " and resid 20 and name HN ))
(( segid "B " and resid 18 and name HA ))
ASSI { 14}
(( segid "B " and resid 19 and name HN ))
(( segid "B " and resid 19 and name HA ))
2.700 0.900 0.900 peak 14 weight 0.10000E+01 volume 0.26700E-02 ppm1 8.137 ppm2 4.622 CV 1
OR { 14}
(( segid "B " and resid 19 and name HN ))
(( segid "B " and resid 18 and name HA ))
ASSI { 29}
(( segid "B " and resid 29 and name HN ))
(( segid "B " and resid 29 and name HA ))
2.400 0.700 0.700 peak 29 weight 0.10000E+01 volume 0.56365E-02 ppm1 8.228 ppm2 4.170 CV 1
OR { 29}
(( segid "B " and resid 29 and name HN ))
(( segid "B " and resid 28 and name HA ))
ASSI { 33}
(( segid "B " and resid 19 and name HN ))
(( segid "B " and resid 15 and name HA ))
2.300 0.600 0.600 peak 33 weight 0.10000E+01 volume 0.90884E-02 ppm1 8.130 ppm2 4.207 CV 1
OR { 33}
(( segid "A " and resid 9 and name HN ))
(( segid "A " and resid 8 and name HA ))
ASSI { 34}
(( segid "B " and resid 23 and name HN ))
(( segid "B " and resid 22 and name HA ))
2.400 0.700 0.700 peak 34 weight 0.10000E+01 volume 0.60141E-02 ppm1 8.085 ppm2 4.214 CV 1
OR { 34}
(( segid "B " and resid 23 and name HN ))
(( segid "B " and resid 21 and name HA ))
ASSI { 37}
(( segid "B " and resid 33 and name HN ))
(( segid "B " and resid 30 and name HA ))
2.500 2.500 3.500 peak 37 weight 0.10000E+01 volume 0.50970E-02 ppm1 8.016 ppm2 4.175 CV 1
OR { 37}
(( segid "B " and resid 34 and name HN ))
(( segid "B " and resid 30 and name HA ))
ASSI { 39}
(( segid "B " and resid 32 and name HN ))
(( segid "B " and resid 32 and name HA ))
2.400 0.700 0.700 peak 39 weight 0.10000E+01 volume 0.48273E-02 ppm1 7.938 ppm2 4.213 CV 1
OR { 39}
(( segid "B " and resid 32 and name HN ))
(( segid "B " and resid 31 and name HA ))
ASSI { 40}
(( segid "B " and resid 32 and name HN ))
(( segid "B " and resid 31 and name HA ))
2.500 0.800 0.800 peak 40 weight 0.10000E+01 volume 0.42880E-02 ppm1 7.939 ppm2 4.176 CV 1
OR { 40}
(( segid "B " and resid 32 and name HN ))
(( segid "B " and resid 30 and name HA ))
ASSI { 89}
(( segid "B " and resid 14 and name HN ))
(( segid "B " and resid 14 and name HB2 ))
2.800 0.900 0.900 peak 89 weight 0.10000E+01 volume 0.42070E-02 ppm1 8.390 ppm2 1.596 CV 1
OR { 89}
(( segid "B " and resid 14 and name HN ))
(( segid "B " and resid 13 and name HB2 ))
ASSI { 103}
(( segid "B " and resid 30 and name HN ))
(( segid "B " and resid 30 and name HB2 ))
2.500 0.800 0.800 peak 103 weight 0.10000E+01 volume 0.25890E-02 ppm1 8.067 ppm2 1.803 CV 1
OR { 103}
(( segid "B " and resid 31 and name HN ))
(( segid "B " and resid 30 and name HB2 ))
ASSI { 104}
(( segid "B " and resid 30 and name HN ))
(( segid "B " and resid 30 and name HB1 ))
2.700 0.900 0.900 peak 104 weight 0.10000E+01 volume 0.34790E-02 ppm1 8.066 ppm2 1.739 CV 1
OR { 104}
(( segid "B " and resid 31 and name HN ))
(( segid "B " and resid 30 and name HB1 ))
ASSI { 106}
(( segid "B " and resid 26 and name HN ))
(( segid "B " and resid 25 and name HG2 ))
3.100 1.200 1.200 peak 106 weight 0.10000E+01 volume 0.37217E-02 ppm1 8.061 ppm2 1.413 CV 1
OR { 106}
(( segid "B " and resid 26 and name HN ))
(( segid "B " and resid 24 and name HB2 ))
OR { 106}
(( segid "B " and resid 26 and name HN ))
(( segid "B " and resid 24 and name HB1 ))
ASSI { 142}
( segid "B " and resid 23 and name HD% )
(( segid "B " and resid 25 and name HD1 ))
3.200 3.200 2.800 peak 142 weight 0.10000E+01 volume 0.18608E-02 ppm1 7.247 ppm2 1.613 CV 1
OR { 142}
(( segid "B " and resid 35 and name HD1 ))
(( segid "B " and resid 34 and name HD2 ))
ASSI { 148}
(( segid "B " and resid 22 and name HN ))
(( segid "B " and resid 22 and name HA ))
2.400 0.700 0.700 peak 148 weight 0.10000E+01 volume 0.66343E-02 ppm1 8.265 ppm2 4.214 CV 1
OR { 148}
(( segid "B " and resid 22 and name HN ))
(( segid "B " and resid 21 and name HA ))
ASSI { 174}
( segid "B " and resid 26 and name HE% )
(( segid "B " and resid 23 and name HA ))
3.300 3.300 2.700 peak 174 weight 0.10000E+01 volume 0.23463E-02 ppm1 7.344 ppm2 4.540 CV 1
OR { 174}
( segid "B " and resid 26 and name HE% )
(( segid "B " and resid 26 and name HA ))
ASSI { 178}
( segid "B " and resid 23 and name HD% )
(( segid "B " and resid 23 and name HA ))
2.700 0.900 0.900 peak 178 weight 0.10000E+01 volume 0.55017E-02 ppm1 7.243 ppm2 4.540 CV 1
OR { 178}
( segid "B " and resid 26 and name HD% )
(( segid "B " and resid 26 and name HA ))
ASSI { 187}
( segid "A " and resid 7 and name HE% )
( segid "A " and resid 7 and name HD% )
1.400 0.300 0.800 peak 187 weight 0.10000E+01 volume 0.93768E-01 ppm1 7.344 ppm2 7.222 CV 1
OR { 187}
( segid "B " and resid 26 and name HE% )
( segid "B " and resid 26 and name HD% )
ASSI { 206}
(( segid "B " and resid 27 and name HN ))
(( segid "B " and resid 26 and name HN ))
2.400 0.700 0.700 peak 206 weight 0.10000E+01 volume 0.18878E-02 ppm1 8.196 ppm2 8.056 CV 1
OR { 206}
(( segid "B " and resid 25 and name HN ))
(( segid "B " and resid 26 and name HN ))
ASSI { 209}
(( segid "A " and resid 9 and name HN ))
(( segid "A " and resid 8 and name HN ))
2.400 0.700 0.700 peak 209 weight 0.10000E+01 volume 0.33709E-02 ppm1 8.126 ppm2 7.991 CV 1
OR { 209}
(( segid "A " and resid 9 and name HN ))
(( segid "A " and resid 7 and name HN ))
ASSI { 212}
(( segid "B " and resid 35 and name HN ))
(( segid "B " and resid 36 and name HN ))
2.300 0.700 0.700 peak 212 weight 0.10000E+01 volume 0.52048E-02 ppm1 7.979 ppm2 8.023 CV 1
OR { 212}
(( segid "B " and resid 35 and name HN ))
(( segid "B " and resid 34 and name HN ))
ASSI { 214}
(( segid "B " and resid 32 and name HN ))
(( segid "B " and resid 31 and name HN ))
2.500 0.800 0.800 peak 214 weight 0.10000E+01 volume 0.30205E-02 ppm1 7.939 ppm2 8.059 CV 1
OR { 214}
(( segid "B " and resid 32 and name HN ))
(( segid "B " and resid 30 and name HN ))
ASSI { 383}
(( segid "A " and resid 6 and name HB1 ))
(( segid "A " and resid 10 and name HB2 ))
3.200 1.300 1.300 peak 383 weight 0.10000E+01 volume 0.15642E-02 ppm1 2.966 ppm2 2.736 CV 1
OR { 383}
(( segid "A " and resid 7 and name HB2 ))
(( segid "A " and resid 10 and name HB2 ))
ASSI { 403}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 26 and name HB2 ))
3.800 1.800 1.800 peak 403 weight 0.10000E+01 volume 0.12405E-02 ppm1 2.386 ppm2 3.130 CV 1
OR { 403}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 26 and name HB2 ))
ASSI { 433}
(( segid "B " and resid 31 and name HN ))
(( segid "B " and resid 27 and name HG1 ))
2.400 2.400 3.600 peak 433 weight 0.10000E+01 volume 0.10518E-02 ppm1 8.060 ppm2 2.386 CV 1
OR { 433}
(( segid "B " and resid 30 and name HN ))
(( segid "B " and resid 27 and name HG1 ))
ASSI { 458}
(( segid "B " and resid 17 and name HN ))
( segid "B " and resid 17 and name HG1%)
4.000 2.000 2.000 peak 458 weight 0.10000E+01 volume 0.86299E-03 ppm1 8.020 ppm2 1.112 CV 1
OR { 458}
(( segid "B " and resid 17 and name HN ))
(( segid "B " and resid 16 and name HG21))
OR { 458}
(( segid "B " and resid 17 and name HN ))
(( segid "B " and resid 16 and name HG22))
ASSI { 7}
(( segid "A " and resid 7 and name HN ))
(( segid "A " and resid 7 and name HA ))
2.100 0.600 0.600 peak 7 weight 0.10000E+01 volume 0.12810E-01 ppm1 7.991 ppm2 4.531 CV 1
OR { 7}
(( segid "B " and resid 36 and name HN ))
(( segid "B " and resid 36 and name HA ))
OR { 7}
(( segid "A " and resid 7 and name HN ))
(( segid "A " and resid 6 and name HA ))
OR { 7}
(( segid "B " and resid 24 and name HN ))
(( segid "B " and resid 23 and name HA ))
ASSI { 31}
(( segid "B " and resid 27 and name HN ))
(( segid "B " and resid 27 and name HA ))
2.700 0.900 0.900 peak 31 weight 0.10000E+01 volume 0.33709E-02 ppm1 8.187 ppm2 4.142 CV 1
OR { 31}
(( segid "B " and resid 28 and name HN ))
(( segid "B " and resid 28 and name HA ))
OR { 31}
(( segid "B " and resid 25 and name HN ))
(( segid "B " and resid 25 and name HA ))
OR { 31}
(( segid "B " and resid 29 and name HN ))
(( segid "B " and resid 29 and name HA ))
OR { 31}
(( segid "B " and resid 29 and name HN ))
(( segid "B " and resid 28 and name HA ))
OR { 31}
(( segid "B " and resid 28 and name HN ))
(( segid "B " and resid 27 and name HA ))
OR { 31}
(( segid "B " and resid 29 and name HN ))
(( segid "B " and resid 27 and name HA ))
ASSI { 35}
(( segid "B " and resid 31 and name HN ))
(( segid "B " and resid 31 and name HA ))
2.500 0.800 0.800 peak 35 weight 0.10000E+01 volume 0.60409E-02 ppm1 8.066 ppm2 4.221 CV 1
OR { 35}
(( segid "B " and resid 30 and name HN ))
(( segid "B " and resid 30 and name HA ))
OR { 35}
(( segid "B " and resid 36 and name HN ))
(( segid "B " and resid 33 and name HA ))
OR { 35}
(( segid "B " and resid 23 and name HN ))
(( segid "B " and resid 22 and name HA ))
OR { 35}
(( segid "B " and resid 30 and name HN ))
(( segid "B " and resid 29 and name HA ))
OR { 35}
(( segid "B " and resid 23 and name HN ))
(( segid "B " and resid 21 and name HA ))
OR { 35}
(( segid "B " and resid 26 and name HN ))
(( segid "B " and resid 24 and name HA ))
OR { 35}
(( segid "B " and resid 31 and name HN ))
(( segid "B " and resid 30 and name HA ))
OR { 35}
(( segid "B " and resid 36 and name HN ))
(( segid "B " and resid 34 and name HA ))
OR { 35}
(( segid "B " and resid 30 and name HN ))
(( segid "B " and resid 28 and name HA ))
ASSI { 36}
(( segid "B " and resid 17 and name HN ))
(( segid "B " and resid 16 and name HB ))
2.500 0.800 0.800 peak 36 weight 0.10000E+01 volume 0.56634E-02 ppm1 8.063 ppm2 4.172 CV 1
OR { 36}
(( segid "B " and resid 34 and name HN ))
(( segid "B " and resid 34 and name HA ))
OR { 36}
(( segid "B " and resid 31 and name HN ))
(( segid "B " and resid 31 and name HA ))
OR { 36}
(( segid "B " and resid 30 and name HN ))
(( segid "B " and resid 30 and name HA ))
OR { 36}
(( segid "B " and resid 31 and name HN ))
(( segid "B " and resid 27 and name HA ))
OR { 36}
(( segid "B " and resid 30 and name HN ))
(( segid "B " and resid 27 and name HA ))
OR { 36}
(( segid "B " and resid 36 and name HN ))
(( segid "B " and resid 33 and name HA ))
OR { 36}
(( segid "B " and resid 23 and name HN ))
(( segid "B " and resid 22 and name HA ))
OR { 36}
(( segid "B " and resid 30 and name HN ))
(( segid "B " and resid 29 and name HA ))
OR { 36}
(( segid "B " and resid 34 and name HN ))
(( segid "B " and resid 33 and name HA ))
OR { 36}
(( segid "B " and resid 26 and name HN ))
(( segid "B " and resid 24 and name HA ))
OR { 36}
(( segid "B " and resid 26 and name HN ))
(( segid "B " and resid 25 and name HA ))
OR { 36}
(( segid "B " and resid 31 and name HN ))
(( segid "B " and resid 30 and name HA ))
OR { 36}
(( segid "B " and resid 34 and name HN ))
(( segid "B " and resid 31 and name HA ))
ASSI { 38}
(( segid "B " and resid 33 and name HN ))
(( segid "B " and resid 33 and name HA ))
2.100 0.500 0.500 peak 38 weight 0.10000E+01 volume 0.12864E-01 ppm1 8.001 ppm2 4.212 CV 1
OR { 38}
(( segid "B " and resid 17 and name HN ))
(( segid "B " and resid 16 and name HB ))
OR { 38}
(( segid "A " and resid 8 and name HN ))
(( segid "A " and resid 8 and name HA ))
OR { 38}
(( segid "B " and resid 34 and name HN ))
(( segid "B " and resid 34 and name HA ))
OR { 38}
(( segid "B " and resid 24 and name HN ))
(( segid "B " and resid 24 and name HA ))
OR { 38}
(( segid "B " and resid 24 and name HN ))
(( segid "B " and resid 21 and name HA ))
OR { 38}
(( segid "B " and resid 36 and name HN ))
(( segid "B " and resid 33 and name HA ))
OR { 38}
(( segid "B " and resid 33 and name HN ))
(( segid "B " and resid 29 and name HA ))
OR { 38}
(( segid "B " and resid 34 and name HN ))
(( segid "B " and resid 33 and name HA ))
OR { 38}
(( segid "B " and resid 35 and name HN ))
(( segid "B " and resid 34 and name HA ))
OR { 38}
(( segid "B " and resid 33 and name HN ))
(( segid "B " and resid 32 and name HA ))
OR { 38}
(( segid "B " and resid 34 and name HN ))
(( segid "B " and resid 31 and name HA ))
ASSI { 48}
(( segid "B " and resid 32 and name HN ))
(( segid "B " and resid 32 and name HA ))
2.600 0.800 0.800 peak 48 weight 0.10000E+01 volume 0.40183E-02 ppm1 7.940 ppm2 4.240 CV 1
OR { 48}
(( segid "B " and resid 32 and name HN ))
(( segid "B " and resid 31 and name HA ))
OR { 48}
(( segid "B " and resid 35 and name HN ))
(( segid "B " and resid 34 and name HA ))
OR { 48}
(( segid "B " and resid 35 and name HN ))
(( segid "B " and resid 32 and name HA ))
ASSI { 56}
(( segid "A " and resid 8 and name HN ))
(( segid "A " and resid 7 and name HB1 ))
2.900 1.000 1.000 peak 56 weight 0.10000E+01 volume 0.26429E-02 ppm1 8.026 ppm2 3.085 CV 1
OR { 56}
(( segid "A " and resid 7 and name HN ))
(( segid "A " and resid 7 and name HB1 ))
OR { 56}
(( segid "B " and resid 26 and name HN ))
(( segid "B " and resid 26 and name HB2 ))
OR { 56}
(( segid "B " and resid 24 and name HN ))
(( segid "B " and resid 23 and name HB2 ))
ASSI { 58}
(( segid "A " and resid 8 and name HN ))
(( segid "A " and resid 7 and name HB1 ))
2.700 0.900 0.900 peak 58 weight 0.10000E+01 volume 0.29127E-02 ppm1 8.023 ppm2 3.155 CV 1
OR { 58}
(( segid "B " and resid 26 and name HN ))
(( segid "B " and resid 26 and name HB1 ))
OR { 58}
(( segid "B " and resid 24 and name HN ))
(( segid "B " and resid 23 and name HB1 ))
OR { 58}
(( segid "A " and resid 7 and name HN ))
(( segid "A " and resid 7 and name HB1 ))
OR { 58}
(( segid "B " and resid 26 and name HN ))
(( segid "B " and resid 26 and name HB2 ))
ASSI { 76}
(( segid "B " and resid 20 and name HN ))
(( segid "B " and resid 20 and name HB2 ))
2.200 0.600 0.600 peak 76 weight 0.10000E+01 volume 0.49621E-02 ppm1 8.202 ppm2 1.900 CV 1
OR { 76}
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(( segid "B " and resid 27 and name HB1 ))
ASSI { 77}
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(( segid "B " and resid 32 and name HB2 ))
3.300 1.300 1.300 peak 77 weight 0.10000E+01 volume 0.15911E-02 ppm1 8.203 ppm2 1.870 CV 1
OR { 77}
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(( segid "B " and resid 32 and name HB2 ))
ASSI { 83}
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(( segid "B " and resid 32 and name HB2 ))
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OR { 83}
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(( segid "B " and resid 32 and name HB2 ))
ASSI { 85}
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(( segid "B " and resid 32 and name HB2 ))
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OR { 85}
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(( segid "B " and resid 32 and name HB2 ))
OR { 85}
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ASSI { 105}
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OR { 105}
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OR { 105}
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OR { 105}
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ASSI { 111}
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3.700 1.700 1.700 peak 111 weight 0.10000E+01 volume 0.17799E-02 ppm1 8.012 ppm2 1.596 CV 1
OR { 111}
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OR { 111}
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OR { 111}
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OR { 111}
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ASSI { 119}
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2.900 1.000 1.000 peak 119 weight 0.10000E+01 volume 0.15642E-02 ppm1 7.987 ppm2 1.815 CV 1
OR { 119}
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(( segid "B " and resid 32 and name HB2 ))
OR { 119}
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(( segid "B " and resid 17 and name HB ))
OR { 119}
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OR { 119}
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ASSI { 126}
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OR { 126}
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ASSI { 139}
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3.300 1.300 1.300 peak 139 weight 0.10000E+01 volume 0.15642E-02 ppm1 7.340 ppm2 1.609 CV 1
OR { 139}
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ASSI { 155}
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OR { 155}
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OR { 155}
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OR { 155}
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(( segid "B " and resid 30 and name HB1 ))
OR { 155}
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OR { 155}
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ASSI { 166}
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OR { 166}
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OR { 166}
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OR { 166}
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ASSI { 169}
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OR { 169}
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OR { 169}
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ASSI { 170}
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OR { 170}
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ASSI { 171}
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OR { 171}
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OR { 171}
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ASSI { 175}
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OR { 175}
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ASSI { 179}
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OR { 179}
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OR { 179}
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OR { 179}
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OR { 179}
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OR { 179}
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OR { 179}
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OR { 179}
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OR { 179}
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(( segid "B " and resid 32 and name HA ))
ASSI { 181}
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OR { 181}
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ASSI { 190}
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( segid "B " and resid 23 and name HD% )
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OR { 190}
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( segid "B " and resid 26 and name HD% )
OR { 190}
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(( segid "A " and resid 6 and name HZ ))
ASSI { 218}
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(( segid "B " and resid 29 and name HN ))
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OR { 218}
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(( segid "B " and resid 22 and name HN ))
ASSI { 264}
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(( segid "B " and resid 32 and name HN ))
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OR { 264}
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(( segid "B " and resid 32 and name HN ))
ASSI { 265}
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(( segid "A " and resid 4 and name HN ))
3.100 1.200 1.200 peak 265 weight 0.10000E+01 volume 0.88997E-03 ppm1 8.245 ppm2 7.826 CV 1
OR { 265}
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(( segid "A " and resid 2 and name HN ))
ASSI { 277}
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OR { 277}
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ASSI { 286}
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3.400 1.500 1.500 peak 286 weight 0.10000E+01 volume 0.11596E-02 ppm1 7.248 ppm2 0.829 CV 1
OR { 286}
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OR { 286}
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OR { 286}
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ASSI { 288}
( segid "A " and resid 7 and name HD% )
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3.300 1.300 1.300 peak 288 weight 0.10000E+01 volume 0.13754E-02 ppm1 7.245 ppm2 0.868 CV 1
OR { 288}
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ASSI { 290}
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3.500 1.600 1.600 peak 290 weight 0.10000E+01 volume 0.14024E-02 ppm1 7.245 ppm2 0.810 CV 1
OR { 290}
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OR { 290}
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ASSI { 291}
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3.600 1.600 1.600 peak 291 weight 0.10000E+01 volume 0.78209E-03 ppm1 7.236 ppm2 0.892 CV 1
OR { 291}
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ASSI { 301}
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OR { 301}
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OR { 301}
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OR { 301}
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OR { 301}
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ASSI { 302}
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OR { 302}
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OR { 302}
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OR { 302}
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OR { 302}
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ASSI { 303}
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3.100 1.200 1.200 peak 303 weight 0.10000E+01 volume 0.70119E-03 ppm1 7.292 ppm2 4.146 CV 1
OR { 303}
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OR { 303}
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ASSI { 309}
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OR { 309}
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( segid "A " and resid 7 and name HE% )
ASSI { 311}
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OR { 311}
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ASSI { 314}
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3.900 1.900 1.900 peak 314 weight 0.10000E+01 volume 0.10248E-02 ppm1 7.236 ppm2 4.467 CV 1
OR { 314}
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ASSI { 316}
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OR { 316}
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ASSI { 318}
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OR { 318}
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OR { 318}
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ASSI { 335}
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OR { 335}
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ASSI { 343}
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OR { 343}
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OR { 343}
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OR { 343}
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ASSI { 344}
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OR { 344}
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OR { 344}
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ASSI { 358}
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OR { 358}
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ASSI { 364}
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OR { 364}
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OR { 364}
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ASSI { 365}
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OR { 365}
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OR { 365}
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ASSI { 379}
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OR { 379}
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ASSI { 389}
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OR { 389}
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ASSI { 409}
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OR { 409}
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ASSI { 413}
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OR { 413}
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OR { 413}
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ASSI { 414}
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OR { 414}
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OR { 414}
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ASSI { 415}
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OR { 415}
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OR { 415}
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OR { 415}
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ASSI { 418}
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OR { 418}
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OR { 418}
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OR { 418}
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ASSI { 424}
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OR { 424}
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OR { 424}
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OR { 424}
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ASSI { 426}
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3.000 1.200 1.200 peak 426 weight 0.10000E+01 volume 0.11866E-02 ppm1 7.292 ppm2 1.593 CV 1
OR { 426}
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OR { 426}
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OR { 426}
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OR { 426}
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ASSI { 446}
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OR { 446}
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OR { 446}
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ASSI { 447}
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4.000 2.000 2.000 peak 447 weight 0.10000E+01 volume 0.83602E-03 ppm1 7.994 ppm2 3.048 CV 1
OR { 447}
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ASSI { 450}
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OR { 450}
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OR { 450}
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OR { 450}
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OR { 450}
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ASSI { 451}
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3.600 1.600 1.600 peak 451 weight 0.10000E+01 volume 0.83602E-03 ppm1 8.019 ppm2 3.227 CV 1
OR { 451}
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ASSI { 452}
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3.600 1.600 1.600 peak 452 weight 0.10000E+01 volume 0.14833E-02 ppm1 7.938 ppm2 3.158 CV 1
OR { 452}
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OR { 452}
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OR { 452}
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ASSI { 457}
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3.600 1.600 1.600 peak 457 weight 0.10000E+01 volume 0.12675E-02 ppm1 8.017 ppm2 0.863 CV 1
OR { 457}
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ASSI { 459}
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( segid "B " and resid 17 and name HG1%)
4.400 2.400 1.600 peak 459 weight 0.10000E+01 volume 0.59331E-03 ppm1 8.017 ppm2 1.188 CV 1
OR { 459}
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OR { 459}
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ASSI { 18}
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OR { 18}
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OR { 18}
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ASSI { 20}
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3.700 1.700 1.700 peak 20 weight 0.10000E+01 volume 0.64833E-03 ppm1 7.243 ppm2 4.486 CV 1
OR { 20}
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ASSI { 53}
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3.300 1.400 1.400 peak 53 weight 0.10000E+01 volume 0.88172E-03 ppm1 7.361 ppm2 2.425 CV 1
OR { 53}
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ASSI { 58}
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OR { 58}
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ASSI { 61}
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OR { 61}
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ASSI { 68}
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3.600 1.600 1.600 peak 68 weight 0.10000E+01 volume 0.14522E-02 ppm1 7.359 ppm2 1.394 CV 1
OR { 68}
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OR { 68}
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OR { 68}
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ASSI { 85}
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(( segid "B " and resid 18 and name HB1 ))
3.200 1.300 1.300 peak 85 weight 0.10000E+01 volume 0.18153E-02 ppm1 7.321 ppm2 3.192 CV 1
OR { 85}
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OR { 85}
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OR { 85}
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(( segid "B " and resid 26 and name HB1 ))
OR { 85}
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ASSI { 86}
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3.900 1.900 1.900 peak 86 weight 0.10000E+01 volume 0.11670E-02 ppm1 7.323 ppm2 3.128 CV 1
OR { 86}
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OR { 86}
( segid "B " and resid 26 and name HE% )
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OR { 86}
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ASSI { 92}
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OR { 92}
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OR { 92}
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ASSI { 93}
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OR { 93}
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OR { 93}
( segid "B " and resid 23 and name HE% )
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OR { 93}
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ASSI { 94}
( segid "B " and resid 23 and name HE% )
(( segid "B " and resid 27 and name HB1 ))
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OR { 94}
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OR { 94}
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OR { 94}
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ASSI { 95}
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3.300 1.300 1.300 peak 95 weight 0.10000E+01 volume 0.11670E-02 ppm1 7.324 ppm2 1.742 CV 1
OR { 95}
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OR { 95}
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ASSI { 96}
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3.000 1.100 1.100 peak 96 weight 0.10000E+01 volume 0.16078E-02 ppm1 7.322 ppm2 1.695 CV 1
OR { 96}
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OR { 96}
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ASSI { 97}
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3.200 1.300 1.300 peak 97 weight 0.10000E+01 volume 0.18153E-02 ppm1 7.324 ppm2 1.638 CV 1
OR { 97}
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OR { 97}
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OR { 97}
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OR { 97}
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ASSI { 98}
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3.400 1.400 1.400 peak 98 weight 0.10000E+01 volume 0.11929E-02 ppm1 7.323 ppm2 1.602 CV 1
OR { 98}
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OR { 98}
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OR { 98}
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OR { 98}
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ASSI { 99}
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3.500 1.500 1.500 peak 99 weight 0.10000E+01 volume 0.94655E-03 ppm1 7.322 ppm2 1.542 CV 1
OR { 99}
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ASSI { 100}
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3.600 1.600 1.600 peak 100 weight 0.10000E+01 volume 0.13096E-02 ppm1 7.324 ppm2 1.439 CV 1
OR { 100}
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OR { 100}
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ASSI { 101}
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3.800 1.800 1.800 peak 101 weight 0.10000E+01 volume 0.11929E-02 ppm1 7.320 ppm2 1.399 CV 1
OR { 101}
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OR { 101}
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OR { 101}
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OR { 101}
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OR { 101}
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ASSI { 102}
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4.400 2.400 1.600 peak 102 weight 0.10000E+01 volume 0.88172E-03 ppm1 7.325 ppm2 1.316 CV 1
OR { 102}
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ASSI { 105}
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3.700 1.800 1.800 peak 105 weight 0.10000E+01 volume 0.14782E-02 ppm1 7.322 ppm2 0.885 CV 1
OR { 105}
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OR { 105}
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ASSI { 107}
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(( segid "B " and resid 18 and name HB1 ))
3.500 1.500 1.500 peak 107 weight 0.10000E+01 volume 0.11021E-02 ppm1 7.316 ppm2 3.215 CV 1
OR { 107}
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OR { 107}
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OR { 107}
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OR { 107}
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ASSI { 109}
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3.500 1.600 1.600 peak 109 weight 0.10000E+01 volume 0.12318E-02 ppm1 7.319 ppm2 1.768 CV 1
OR { 109}
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OR { 109}
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OR { 109}
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ASSI { 115}
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3.900 1.900 1.900 peak 115 weight 0.10000E+01 volume 0.13355E-02 ppm1 7.318 ppm2 0.846 CV 1
OR { 115}
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OR { 115}
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ASSI { 118}
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OR { 118}
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OR { 118}
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OR { 118}
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ASSI { 122}
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OR { 122}
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OR { 122}
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OR { 122}
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ASSI { 137}
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OR { 137}
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ASSI { 139}
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OR { 139}
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ASSI { 200}
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OR { 200}
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OR { 200}
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ASSI { 211}
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2.200 0.600 0.600 peak 211 weight 0.10000E+01 volume 0.10710E-01 ppm1 4.542 ppm2 2.987 CV 1
OR { 211}
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ASSI { 221}
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OR { 221}
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ASSI { 222}
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OR { 222}
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OR { 222}
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ASSI { 225}
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OR { 225}
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ASSI { 270}
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OR { 270}
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OR { 270}
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OR { 270}
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ASSI { 271}
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OR { 271}
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OR { 271}
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OR { 271}
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ASSI { 273}
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OR { 273}
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ASSI { 275}
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OR { 275}
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OR { 275}
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ASSI { 276}
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OR { 276}
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OR { 276}
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ASSI { 285}
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OR { 285}
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OR { 285}
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ASSI { 287}
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OR { 287}
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OR { 287}
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OR { 287}
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ASSI { 294}
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OR { 294}
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ASSI { 295}
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3.500 1.500 1.500 peak 295 weight 0.10000E+01 volume 0.79096E-03 ppm1 4.155 ppm2 2.105 CV 1
OR { 295}
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ASSI { 309}
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3.500 1.500 1.500 peak 309 weight 0.10000E+01 volume 0.66130E-03 ppm1 4.031 ppm2 1.836 CV 1
OR { 309}
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ASSI { 311}
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4.500 2.600 1.500 peak 311 weight 0.10000E+01 volume 0.71316E-03 ppm1 4.027 ppm2 1.782 CV 1
OR { 311}
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OR { 311}
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ASSI { 336}
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3.700 1.700 1.700 peak 336 weight 0.10000E+01 volume 0.90765E-03 ppm1 3.303 ppm2 1.686 CV 1
OR { 336}
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ASSI { 344}
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4.100 2.100 1.900 peak 344 weight 0.10000E+01 volume 0.75206E-03 ppm1 3.008 ppm2 1.147 CV 1
OR { 344}
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( segid "B " and resid 15 and name HG1%)
ASSI { 347}
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3.500 1.500 1.500 peak 347 weight 0.10000E+01 volume 0.24117E-02 ppm1 2.881 ppm2 1.917 CV 1
OR { 347}
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ASSI { 357}
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2.500 0.800 0.800 peak 357 weight 0.10000E+01 volume 0.24766E-02 ppm1 4.433 ppm2 0.916 CV 1
OR { 357}
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ASSI { 359}
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4.300 2.300 1.700 peak 359 weight 0.10000E+01 volume 0.68723E-03 ppm1 4.414 ppm2 0.840 CV 1
OR { 359}
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OR { 359}
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OR { 359}
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OR { 359}
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OR { 359}
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OR { 359}
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(( segid "B " and resid 15 and name HG21))
ASSI { 363}
(( segid "B " and resid 16 and name HA ))
(( segid "B " and resid 15 and name HG21))
4.100 2.100 1.900 peak 363 weight 0.10000E+01 volume 0.86875E-03 ppm1 4.371 ppm2 0.839 CV 1
OR { 363}
(( segid "B " and resid 13 and name HA ))
(( segid "B " and resid 15 and name HD11))
OR { 363}
(( segid "B " and resid 16 and name HA ))
(( segid "B " and resid 17 and name HG21))
OR { 363}
(( segid "B " and resid 13 and name HA ))
(( segid "B " and resid 15 and name HG21))
OR { 363}
(( segid "B " and resid 16 and name HA ))
(( segid "B " and resid 15 and name HD11))
ASSI { 366}
(( segid "A " and resid 4 and name HA ))
( segid "A " and resid 4 and name HG2%)
1.600 1.600 4.400 peak 366 weight 0.10000E+01 volume 0.29253E-01 ppm1 4.028 ppm2 0.946 CV 1
OR { 366}
(( segid "B " and resid 12 and name HA ))
(( segid "B " and resid 14 and name HD21))
OR { 366}
(( segid "A " and resid 4 and name HA ))
( segid "A " and resid 4 and name HG1%)
ASSI { 387}
(( segid "A " and resid 11 and name HE ))
(( segid "B " and resid 15 and name HG21))
3.600 1.600 1.600 peak 387 weight 0.10000E+01 volume 0.10632E-02 ppm1 3.176 ppm2 0.915 CV 1
OR { 387}
(( segid "B " and resid 18 and name HB1 ))
(( segid "B " and resid 17 and name HG21))
OR { 387}
(( segid "A " and resid 11 and name HD1 ))
(( segid "B " and resid 15 and name HG21))
ASSI { 395}
(( segid "B " and resid 12 and name HE2 ))
(( segid "B " and resid 13 and name HD11))
3.700 1.700 1.700 peak 395 weight 0.10000E+01 volume 0.10762E-02 ppm1 3.013 ppm2 0.882 CV 1
OR { 395}
(( segid "A " and resid 7 and name HB2 ))
(( segid "B " and resid 15 and name HG21))
ASSI { 396}
(( segid "B " and resid 12 and name HE2 ))
(( segid "B " and resid 13 and name HD11))
3.800 1.800 1.800 peak 396 weight 0.10000E+01 volume 0.10373E-02 ppm1 3.004 ppm2 0.917 CV 1
OR { 396}
(( segid "A " and resid 7 and name HB2 ))
(( segid "B " and resid 15 and name HG21))
OR { 396}
(( segid "A " and resid 7 and name HB2 ))
( segid "A " and resid 4 and name HG1%)
ASSI { 405}
(( segid "B " and resid 35 and name HA ))
(( segid "B " and resid 34 and name HD1 ))
3.800 1.800 1.800 peak 405 weight 0.10000E+01 volume 0.15171E-02 ppm1 4.706 ppm2 1.668 CV 1
OR { 405}
(( segid "A " and resid 10 and name HA ))
(( segid "A " and resid 11 and name HG1 ))
ASSI { 430}
(( segid "B " and resid 16 and name HA ))
(( segid "B " and resid 16 and name HB ))
3.100 1.200 1.200 peak 430 weight 0.10000E+01 volume 0.17634E-02 ppm1 4.407 ppm2 4.177 CV 1
OR { 430}
(( segid "B " and resid 14 and name HA ))
(( segid "B " and resid 16 and name HB ))
ASSI { 436}
(( segid "A " and resid 10 and name HA ))
(( segid "A " and resid 6 and name HB1 ))
4.000 2.000 2.000 peak 436 weight 0.10000E+01 volume 0.82986E-03 ppm1 4.706 ppm2 2.999 CV 1
OR { 436}
(( segid "A " and resid 10 and name HA ))
(( segid "A " and resid 7 and name HB2 ))
ASSI { 445}
( segid "A " and resid 6 and name HD% )
(( segid "A " and resid 3 and name HA ))
3.800 1.800 1.800 peak 445 weight 0.10000E+01 volume 0.60943E-03 ppm1 7.106 ppm2 4.229 CV 1
OR { 445}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "A " and resid 3 and name HA ))
ASSI { 473}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "B " and resid 15 and name HG21))
4.500 2.500 1.500 peak 473 weight 0.10000E+01 volume 0.47975E-03 ppm1 7.112 ppm2 0.887 CV 1
OR { 473}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "B " and resid 14 and name HD11))
ASSI { 507}
( segid "A " and resid 7 and name HE% )
(( segid "A " and resid 4 and name HA ))
4.400 2.400 1.600 peak 507 weight 0.10000E+01 volume 0.62240E-03 ppm1 7.326 ppm2 4.028 CV 1
OR { 507}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 17 and name HA ))
OR { 507}
(( segid "B " and resid 18 and name HD1 ))
(( segid "A " and resid 4 and name HA ))
ASSI { 516}
(( segid "A " and resid 11 and name HE ))
( segid "B " and resid 15 and name HG1%)
3.900 1.900 1.900 peak 516 weight 0.10000E+01 volume 0.75206E-03 ppm1 3.208 ppm2 1.144 CV 1
OR { 516}
(( segid "B " and resid 18 and name HB1 ))
( segid "B " and resid 17 and name HG1%)
OR { 516}
(( segid "A " and resid 11 and name HD1 ))
( segid "B " and resid 15 and name HG1%)
ASSI { 525}
( segid "A " and resid 7 and name HD% )
( segid "B " and resid 15 and name HG1%)
3.900 1.900 1.900 peak 525 weight 0.10000E+01 volume 0.40195E-03 ppm1 7.195 ppm2 1.121 CV 1
OR { 525}
( segid "A " and resid 7 and name HD% )
(( segid "A " and resid 3 and name HG2 ))
ASSI { 527}
(( segid "A " and resid 2 and name HH2 ))
( segid "B " and resid 15 and name HG1%)
3.900 1.900 1.900 peak 527 weight 0.10000E+01 volume 0.37602E-03 ppm1 7.307 ppm2 1.187 CV 1
OR { 527}
(( segid "B " and resid 18 and name HD1 ))
( segid "B " and resid 15 and name HG1%)
ASSI { 528}
(( segid "B " and resid 18 and name HD1 ))
( segid "B " and resid 15 and name HG1%)
4.800 2.900 1.200 peak 528 weight 0.10000E+01 volume 0.36305E-03 ppm1 7.337 ppm2 1.190 CV 1
OR { 528}
( segid "A " and resid 7 and name HE% )
( segid "B " and resid 15 and name HG1%)
ASSI { 536}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "A " and resid 8 and name HG1 ))
4.600 2.700 1.400 peak 536 weight 0.10000E+01 volume 0.36305E-03 ppm1 7.143 ppm2 1.339 CV 1
OR { 536}
(( segid "B " and resid 35 and name HZ3 ))
(( segid "B " and resid 31 and name HB1 ))
ASSI { 541}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "B " and resid 12 and name HG2 ))
4.500 2.500 1.500 peak 541 weight 0.10000E+01 volume 0.31119E-03 ppm1 7.142 ppm2 1.396 CV 1
OR { 541}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "A " and resid 8 and name HG1 ))
ASSI { 543}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "B " and resid 15 and name HB ))
4.800 2.800 1.200 peak 543 weight 0.10000E+01 volume 0.47975E-03 ppm1 7.143 ppm2 1.773 CV 1
OR { 543}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "A " and resid 8 and name HB1 ))
ASSI { 546}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "A " and resid 1 and name HB2 ))
4.400 2.500 1.600 peak 546 weight 0.10000E+01 volume 0.37602E-03 ppm1 7.143 ppm2 1.862 CV 1
OR { 546}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "B " and resid 15 and name HB ))
OR { 546}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "B " and resid 12 and name HB2 ))
ASSI { 547}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "A " and resid 1 and name HB2 ))
3.900 1.900 1.900 peak 547 weight 0.10000E+01 volume 0.55757E-03 ppm1 7.111 ppm2 1.887 CV 1
OR { 547}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "B " and resid 12 and name HB2 ))
ASSI { 548}
(( segid "A " and resid 2 and name HZ2 ))
(( segid "B " and resid 15 and name HB ))
4.000 2.000 2.000 peak 548 weight 0.10000E+01 volume 0.38898E-03 ppm1 7.509 ppm2 1.828 CV 1
OR { 548}
(( segid "A " and resid 2 and name HZ2 ))
(( segid "A " and resid 8 and name HB1 ))
ASSI { 551}
(( segid "A " and resid 2 and name HE3 ))
(( segid "B " and resid 14 and name HG ))
4.900 3.000 1.100 peak 551 weight 0.10000E+01 volume 0.36305E-03 ppm1 7.595 ppm2 1.644 CV 1
OR { 551}
(( segid "A " and resid 2 and name HE3 ))
(( segid "A " and resid 8 and name HD1 ))
ASSI { 554}
(( segid "A " and resid 4 and name HN ))
(( segid "A " and resid 3 and name HB2 ))
4.500 2.600 1.500 peak 554 weight 0.10000E+01 volume 0.38898E-03 ppm1 7.832 ppm2 1.693 CV 1
OR { 554}
(( segid "A " and resid 2 and name HN ))
(( segid "A " and resid 3 and name HB2 ))
ASSI { 555}
(( segid "A " and resid 2 and name HE3 ))
(( segid "B " and resid 12 and name HG2 ))
4.600 2.700 1.400 peak 555 weight 0.10000E+01 volume 0.38898E-03 ppm1 7.601 ppm2 1.400 CV 1
OR { 555}
(( segid "A " and resid 2 and name HE3 ))
(( segid "A " and resid 8 and name HG1 ))
ASSI { 557}
(( segid "A " and resid 2 and name HE3 ))
(( segid "A " and resid 3 and name HG2 ))
3.600 1.700 1.700 peak 557 weight 0.10000E+01 volume 0.27229E-03 ppm1 7.600 ppm2 1.115 CV 1
OR { 557}
(( segid "A " and resid 2 and name HE3 ))
( segid "B " and resid 15 and name HG1%)
ASSI { 558}
(( segid "A " and resid 2 and name HE3 ))
(( segid "B " and resid 15 and name HB ))
5.300 3.600 0.700 peak 558 weight 0.10000E+01 volume 0.33712E-03 ppm1 7.594 ppm2 1.822 CV 1
OR { 558}
(( segid "A " and resid 2 and name HE3 ))
(( segid "A " and resid 8 and name HB1 ))
ASSI { 565}
( segid "B " and resid 26 and name HE% )
(( segid "B " and resid 27 and name HG2 ))
3.800 1.800 1.800 peak 565 weight 0.10000E+01 volume 0.42788E-03 ppm1 7.327 ppm2 2.220 CV 1
OR { 565}
( segid "B " and resid 23 and name HE% )
(( segid "B " and resid 27 and name HG2 ))
ASSI { 573}
( segid "B " and resid 26 and name HE% )
(( segid "B " and resid 27 and name HG1 ))
4.500 2.500 1.500 peak 573 weight 0.10000E+01 volume 0.42788E-03 ppm1 7.310 ppm2 2.360 CV 1
OR { 573}
(( segid "A " and resid 2 and name HH2 ))
(( segid "A " and resid 1 and name HG2 ))
ASSI { 580}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 19 and name HB2 ))
4.100 2.100 1.900 peak 580 weight 0.10000E+01 volume 0.45381E-03 ppm1 7.273 ppm2 2.738 CV 1
OR { 580}
( segid "A " and resid 7 and name HD% )
(( segid "A " and resid 10 and name HB2 ))
OR { 580}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 19 and name HB1 ))
ASSI { 583}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "A " and resid 7 and name HB1 ))
4.400 2.500 1.600 peak 583 weight 0.10000E+01 volume 0.41492E-03 ppm1 7.151 ppm2 3.166 CV 1
OR { 583}
( segid "A " and resid 6 and name HD% )
(( segid "A " and resid 9 and name HD2 ))
OR { 583}
( segid "A " and resid 6 and name HD% )
(( segid "A " and resid 9 and name HD1 ))
OR { 583}
( segid "A " and resid 6 and name HD% )
(( segid "A " and resid 7 and name HB1 ))
OR { 583}
(( segid "B " and resid 35 and name HZ3 ))
(( segid "B " and resid 32 and name HD2 ))
ASSI { 585}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "A " and resid 2 and name HB2 ))
4.900 3.000 1.100 peak 585 weight 0.10000E+01 volume 0.44085E-03 ppm1 7.147 ppm2 3.233 CV 1
OR { 585}
( segid "A " and resid 6 and name HD% )
(( segid "A " and resid 9 and name HD2 ))
OR { 585}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "A " and resid 11 and name HE ))
ASSI { 588}
(( segid "B " and resid 35 and name HZ3 ))
(( segid "B " and resid 35 and name HB2 ))
3.400 3.400 2.600 peak 588 weight 0.10000E+01 volume 0.45381E-03 ppm1 7.180 ppm2 3.345 CV 1
OR { 588}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "B " and resid 18 and name HB2 ))
ASSI { 599}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "A " and resid 3 and name HB2 ))
4.400 2.400 1.600 peak 599 weight 0.10000E+01 volume 0.50568E-03 ppm1 7.177 ppm2 1.732 CV 1
OR { 599}
(( segid "A " and resid 2 and name HZ3 ))
(( segid "B " and resid 12 and name HD2 ))
ASSI { 612}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 14 and name HA ))
4.300 2.300 1.700 peak 612 weight 0.10000E+01 volume 0.49271E-03 ppm1 7.267 ppm2 4.428 CV 1
OR { 612}
(( segid "A " and resid 2 and name HH2 ))
(( segid "B " and resid 13 and name HA ))
OR { 612}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 16 and name HA ))
OR { 612}
(( segid "A " and resid 2 and name HH2 ))
(( segid "B " and resid 14 and name HA ))
ASSI { 613}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 16 and name HA ))
4.700 2.700 1.300 peak 613 weight 0.10000E+01 volume 0.37602E-03 ppm1 7.265 ppm2 4.362 CV 1
OR { 613}
( segid "A " and resid 7 and name HD% )
(( segid "B " and resid 16 and name HA ))
ASSI { 614}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 14 and name HA ))
4.200 2.200 1.800 peak 614 weight 0.10000E+01 volume 0.36305E-03 ppm1 7.314 ppm2 4.461 CV 1
OR { 614}
( segid "A " and resid 7 and name HE% )
(( segid "B " and resid 13 and name HA ))
ASSI { 615}
( segid "A " and resid 6 and name HE% )
(( segid "A " and resid 6 and name HA ))
3.300 3.300 2.700 peak 615 weight 0.10000E+01 volume 0.33712E-03 ppm1 7.367 ppm2 4.491 CV 1
OR { 615}
( segid "A " and resid 7 and name HE% )
(( segid "A " and resid 6 and name HA ))
ASSI { 618}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 19 and name HA ))
4.000 2.000 2.000 peak 618 weight 0.10000E+01 volume 0.42788E-03 ppm1 7.258 ppm2 4.642 CV 1
OR { 618}
(( segid "A " and resid 2 and name HD1 ))
(( segid "A " and resid 2 and name HA ))
OR { 618}
(( segid "B " and resid 35 and name HD1 ))
(( segid "B " and resid 35 and name HA ))
ASSI { 621}
(( segid "A " and resid 2 and name HE3 ))
(( segid "A " and resid 3 and name HA ))
4.600 2.700 1.400 peak 621 weight 0.10000E+01 volume 0.40195E-03 ppm1 7.596 ppm2 4.212 CV 1
OR { 621}
(( segid "A " and resid 2 and name HE3 ))
(( segid "A " and resid 1 and name HA ))
ASSI { 623}
(( segid "A " and resid 9 and name HA ))
(( segid "A " and resid 10 and name HB1 ))
4.300 2.300 1.700 peak 623 weight 0.10000E+01 volume 0.58350E-03 ppm1 4.223 ppm2 2.831 CV 1
OR { 623}
(( segid "A " and resid 8 and name HA ))
(( segid "A " and resid 10 and name HB1 ))
ASSI { 624}
(( segid "A " and resid 8 and name HA ))
(( segid "A " and resid 10 and name HB1 ))
4.500 2.500 1.500 peak 624 weight 0.10000E+01 volume 0.40195E-03 ppm1 4.180 ppm2 2.832 CV 1
OR { 624}
(( segid "A " and resid 3 and name HA ))
(( segid "A " and resid 10 and name HB1 ))
ASSI { 635}
(( segid "B " and resid 15 and name HA ))
(( segid "B " and resid 15 and name HG21))
2.700 0.900 0.900 peak 635 weight 0.10000E+01 volume 0.13744E-02 ppm1 4.190 ppm2 0.867 CV 1
OR { 635}
(( segid "A " and resid 8 and name HA ))
(( segid "B " and resid 15 and name HG21))
ASSI { 636}
(( segid "B " and resid 15 and name HA ))
(( segid "B " and resid 15 and name HD11))
3.700 1.700 1.700 peak 636 weight 0.10000E+01 volume 0.57053E-03 ppm1 4.204 ppm2 0.808 CV 1
OR { 636}
(( segid "A " and resid 8 and name HA ))
(( segid "B " and resid 15 and name HD11))
ASSI { 656}
(( segid "A " and resid 4 and name HA ))
(( segid "A " and resid 7 and name HB1 ))
3.100 1.200 1.200 peak 656 weight 0.10000E+01 volume 0.41492E-03 ppm1 4.029 ppm2 3.165 CV 1
OR { 656}
(( segid "B " and resid 17 and name HA ))
(( segid "B " and resid 20 and name HD2 ))
ASSI { 657}
(( segid "B " and resid 17 and name HA ))
(( segid "B " and resid 20 and name HD2 ))
3.700 1.700 1.700 peak 657 weight 0.10000E+01 volume 0.44085E-03 ppm1 4.033 ppm2 3.198 CV 1
OR { 657}
(( segid "B " and resid 17 and name HA ))
(( segid "B " and resid 18 and name HB1 ))
ASSI { 659}
(( segid "B " and resid 26 and name HA ))
(( segid "B " and resid 26 and name HB1 ))
3.000 1.100 1.100 peak 659 weight 0.10000E+01 volume 0.19839E-02 ppm1 4.560 ppm2 3.193 CV 1
OR { 659}
(( segid "B " and resid 23 and name HA ))
(( segid "B " and resid 23 and name HB1 ))
OR { 659}
(( segid "A " and resid 6 and name HA ))
(( segid "A " and resid 9 and name HD1 ))
ASSI { 660}
(( segid "B " and resid 26 and name HA ))
(( segid "B " and resid 26 and name HB2 ))
3.000 1.100 1.100 peak 660 weight 0.10000E+01 volume 0.11540E-02 ppm1 4.563 ppm2 3.072 CV 1
OR { 660}
(( segid "B " and resid 23 and name HA ))
(( segid "B " and resid 23 and name HB2 ))
ASSI { 665}
(( segid "B " and resid 18 and name HB2 ))
(( segid "B " and resid 17 and name HG21))
4.500 2.500 1.500 peak 665 weight 0.10000E+01 volume 0.37602E-03 ppm1 3.330 ppm2 0.835 CV 1
OR { 665}
(( segid "B " and resid 18 and name HB2 ))
(( segid "B " and resid 17 and name HD11))
OR { 665}
(( segid "A " and resid 2 and name HB2 ))
(( segid "B " and resid 15 and name HD11))
ASSI { 666}
(( segid "B " and resid 18 and name HB2 ))
(( segid "B " and resid 14 and name HD11))
4.400 2.500 1.600 peak 666 weight 0.10000E+01 volume 0.51864E-03 ppm1 3.311 ppm2 0.920 CV 1
OR { 666}
(( segid "A " and resid 2 and name HB2 ))
( segid "A " and resid 4 and name HG1%)
ASSI { 667}
(( segid "B " and resid 18 and name HB2 ))
(( segid "B " and resid 17 and name HG21))
4.200 2.200 1.800 peak 667 weight 0.10000E+01 volume 0.44085E-03 ppm1 3.311 ppm2 0.897 CV 1
OR { 667}
(( segid "B " and resid 18 and name HB2 ))
(( segid "B " and resid 14 and name HD11))
ASSI { 668}
(( segid "B " and resid 18 and name HB1 ))
(( segid "B " and resid 17 and name HG21))
4.200 2.200 1.800 peak 668 weight 0.10000E+01 volume 0.44085E-03 ppm1 3.263 ppm2 0.903 CV 1
OR { 668}
(( segid "B " and resid 18 and name HB1 ))
(( segid "B " and resid 14 and name HD11))
OR { 668}
(( segid "B " and resid 18 and name HB2 ))
(( segid "B " and resid 17 and name HG21))
OR { 668}
(( segid "A " and resid 2 and name HB2 ))
( segid "A " and resid 4 and name HG1%)
ASSI { 671}
(( segid "A " and resid 7 and name HB1 ))
(( segid "B " and resid 15 and name HG21))
3.300 1.400 1.400 peak 671 weight 0.10000E+01 volume 0.50568E-03 ppm1 3.091 ppm2 0.909 CV 1
OR { 671}
(( segid "A " and resid 7 and name HB1 ))
( segid "A " and resid 4 and name HG1%)
ASSI { 672}
(( segid "A " and resid 3 and name HE1 ))
(( segid "B " and resid 15 and name HG21))
5.000 3.100 1.000 peak 672 weight 0.10000E+01 volume 0.45381E-03 ppm1 2.891 ppm2 0.857 CV 1
OR { 672}
(( segid "A " and resid 10 and name HB1 ))
(( segid "B " and resid 15 and name HG21))
ASSI { 676}
(( segid "B " and resid 12 and name HE2 ))
(( segid "B " and resid 12 and name HG2 ))
2.300 0.600 0.600 peak 676 weight 0.10000E+01 volume 0.56663E-02 ppm1 2.998 ppm2 1.393 CV 1
OR { 676}
(( segid "A " and resid 8 and name HE2 ))
(( segid "A " and resid 8 and name HG1 ))
ASSI { 680}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 25 and name HG2 ))
3.300 1.400 1.400 peak 680 weight 0.10000E+01 volume 0.16078E-02 ppm1 3.170 ppm2 1.437 CV 1
OR { 680}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 24 and name HB1 ))
OR { 680}
(( segid "A " and resid 7 and name HB1 ))
(( segid "B " and resid 12 and name HG2 ))
ASSI { 682}
(( segid "B " and resid 32 and name HD2 ))
(( segid "B " and resid 34 and name HG2 ))
3.500 1.500 1.500 peak 682 weight 0.10000E+01 volume 0.12966E-02 ppm1 3.173 ppm2 1.312 CV 1
OR { 682}
(( segid "A " and resid 11 and name HE ))
(( segid "A " and resid 8 and name HG1 ))
ASSI { 683}
(( segid "A " and resid 7 and name HB1 ))
(( segid "A " and resid 8 and name HG1 ))
3.800 1.800 1.800 peak 683 weight 0.10000E+01 volume 0.63536E-03 ppm1 3.148 ppm2 1.341 CV 1
OR { 683}
(( segid "B " and resid 32 and name HD2 ))
(( segid "B " and resid 31 and name HB1 ))
OR { 683}
(( segid "B " and resid 32 and name HD2 ))
(( segid "B " and resid 34 and name HG2 ))
OR { 683}
(( segid "B " and resid 30 and name HD2 ))
(( segid "B " and resid 31 and name HB1 ))
ASSI { 684}
(( segid "B " and resid 32 and name HD2 ))
(( segid "B " and resid 31 and name HB1 ))
3.200 1.300 1.300 peak 684 weight 0.10000E+01 volume 0.16986E-02 ppm1 3.202 ppm2 1.392 CV 1
OR { 684}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 25 and name HG2 ))
OR { 684}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 24 and name HB1 ))
OR { 684}
(( segid "B " and resid 18 and name HB1 ))
(( segid "B " and resid 21 and name HG1 ))
ASSI { 686}
(( segid "B " and resid 32 and name HD2 ))
(( segid "B " and resid 31 and name HB1 ))
3.500 1.500 1.500 peak 686 weight 0.10000E+01 volume 0.10114E-02 ppm1 3.206 ppm2 1.352 CV 1
OR { 686}
(( segid "B " and resid 18 and name HB1 ))
(( segid "B " and resid 21 and name HG1 ))
OR { 686}
(( segid "B " and resid 32 and name HD2 ))
(( segid "B " and resid 34 and name HG2 ))
ASSI { 687}
(( segid "B " and resid 26 and name HB2 ))
(( segid "B " and resid 25 and name HG2 ))
4.700 2.700 1.300 peak 687 weight 0.10000E+01 volume 0.47975E-03 ppm1 3.081 ppm2 1.456 CV 1
OR { 687}
(( segid "B " and resid 23 and name HB2 ))
(( segid "B " and resid 24 and name HB1 ))
OR { 687}
(( segid "B " and resid 23 and name HB2 ))
(( segid "B " and resid 25 and name HG2 ))
OR { 687}
(( segid "A " and resid 7 and name HB1 ))
(( segid "B " and resid 12 and name HG2 ))
ASSI { 688}
(( segid "B " and resid 18 and name HB1 ))
(( segid "B " and resid 14 and name HB2 ))
2.000 0.500 0.500 peak 688 weight 0.10000E+01 volume 0.14380E-01 ppm1 3.192 ppm2 1.624 CV 1
OR { 688}
(( segid "A " and resid 9 and name HD1 ))
(( segid "A " and resid 9 and name HG1 ))
OR { 688}
(( segid "A " and resid 11 and name HD1 ))
(( segid "A " and resid 11 and name HG1 ))
OR { 688}
(( segid "B " and resid 20 and name HD2 ))
(( segid "B " and resid 20 and name HG1 ))
OR { 688}
(( segid "B " and resid 32 and name HD2 ))
(( segid "B " and resid 32 and name HG1 ))
OR { 688}
(( segid "A " and resid 9 and name HD2 ))
(( segid "A " and resid 9 and name HG1 ))
ASSI { 689}
(( segid "A " and resid 7 and name HB1 ))
(( segid "A " and resid 8 and name HD1 ))
4.200 2.200 1.800 peak 689 weight 0.10000E+01 volume 0.10892E-02 ppm1 3.107 ppm2 1.654 CV 1
OR { 689}
(( segid "B " and resid 23 and name HB2 ))
(( segid "B " and resid 25 and name HD2 ))
OR { 689}
(( segid "B " and resid 26 and name HB2 ))
(( segid "B " and resid 25 and name HD2 ))
ASSI { 690}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 30 and name HG1 ))
4.200 2.200 1.800 peak 690 weight 0.10000E+01 volume 0.90765E-03 ppm1 3.191 ppm2 1.538 CV 1
OR { 690}
(( segid "B " and resid 32 and name HD2 ))
(( segid "B " and resid 33 and name HB1 ))
OR { 690}
(( segid "A " and resid 11 and name HE ))
(( segid "A " and resid 3 and name HD1 ))
ASSI { 691}
(( segid "B " and resid 12 and name HE2 ))
(( segid "A " and resid 3 and name HD1 ))
3.600 1.700 1.700 peak 691 weight 0.10000E+01 volume 0.71316E-03 ppm1 2.957 ppm2 1.566 CV 1
OR { 691}
(( segid "A " and resid 8 and name HE2 ))
(( segid "A " and resid 9 and name HG1 ))
OR { 691}
(( segid "A " and resid 7 and name HB2 ))
(( segid "A " and resid 3 and name HD1 ))
ASSI { 692}
(( segid "B " and resid 12 and name HE2 ))
(( segid "A " and resid 3 and name HD1 ))
3.000 1.200 1.200 peak 692 weight 0.10000E+01 volume 0.17505E-02 ppm1 2.995 ppm2 1.556 CV 1
OR { 692}
(( segid "A " and resid 7 and name HB2 ))
(( segid "A " and resid 3 and name HD1 ))
ASSI { 693}
(( segid "B " and resid 18 and name HB2 ))
(( segid "B " and resid 21 and name HG1 ))
4.700 2.800 1.300 peak 693 weight 0.10000E+01 volume 0.58350E-03 ppm1 3.303 ppm2 1.404 CV 1
OR { 693}
(( segid "A " and resid 2 and name HB2 ))
(( segid "B " and resid 12 and name HG2 ))
ASSI { 707}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 24 and name HB1 ))
3.700 1.700 1.700 peak 707 weight 0.10000E+01 volume 0.79096E-03 ppm1 2.404 ppm2 1.386 CV 1
OR { 707}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 31 and name HB1 ))
ASSI { 713}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 25 and name HD2 ))
4.000 2.000 2.000 peak 713 weight 0.10000E+01 volume 0.82986E-03 ppm1 2.422 ppm2 1.652 CV 1
OR { 713}
(( segid "A " and resid 1 and name HG2 ))
(( segid "B " and resid 14 and name HG ))
OR { 713}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 32 and name HG1 ))
OR { 713}
(( segid "A " and resid 1 and name HG2 ))
(( segid "A " and resid 8 and name HD1 ))
ASSI { 714}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 25 and name HD2 ))
3.900 1.900 1.900 peak 714 weight 0.10000E+01 volume 0.89469E-03 ppm1 2.360 ppm2 1.659 CV 1
OR { 714}
(( segid "A " and resid 1 and name HG2 ))
(( segid "B " and resid 14 and name HG ))
OR { 714}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 32 and name HG1 ))
OR { 714}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 32 and name HG1 ))
OR { 714}
(( segid "A " and resid 1 and name HG2 ))
(( segid "A " and resid 8 and name HD1 ))
ASSI { 715}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 25 and name HD2 ))
4.000 2.000 2.000 peak 715 weight 0.10000E+01 volume 0.82986E-03 ppm1 2.365 ppm2 1.621 CV 1
OR { 715}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 30 and name HG1 ))
OR { 715}
(( segid "A " and resid 1 and name HG2 ))
(( segid "B " and resid 14 and name HG ))
OR { 715}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 30 and name HG1 ))
OR { 715}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 32 and name HG1 ))
OR { 715}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 32 and name HG1 ))
OR { 715}
(( segid "A " and resid 1 and name HG2 ))
(( segid "A " and resid 8 and name HD1 ))
ASSI { 720}
(( segid "B " and resid 27 and name HG2 ))
(( segid "B " and resid 30 and name HB1 ))
3.900 1.900 1.900 peak 720 weight 0.10000E+01 volume 0.72613E-03 ppm1 2.284 ppm2 1.757 CV 1
OR { 720}
(( segid "B " and resid 27 and name HG2 ))
(( segid "B " and resid 30 and name HB2 ))
OR { 720}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 30 and name HB2 ))
OR { 720}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 30 and name HB1 ))
ASSI { 721}
(( segid "B " and resid 22 and name HG1 ))
(( segid "A " and resid 8 and name HB1 ))
3.000 1.100 1.100 peak 721 weight 0.10000E+01 volume 0.79096E-03 ppm1 2.277 ppm2 1.825 CV 1
OR { 721}
(( segid "B " and resid 27 and name HG2 ))
(( segid "B " and resid 30 and name HB2 ))
ASSI { 722}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 32 and name HB2 ))
3.800 1.800 1.800 peak 722 weight 0.10000E+01 volume 0.71316E-03 ppm1 2.288 ppm2 1.811 CV 1
OR { 722}
(( segid "B " and resid 27 and name HG2 ))
(( segid "B " and resid 30 and name HB2 ))
OR { 722}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 30 and name HB2 ))
ASSI { 725}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 30 and name HB2 ))
4.000 2.000 2.000 peak 725 weight 0.10000E+01 volume 0.75206E-03 ppm1 2.371 ppm2 1.822 CV 1
OR { 725}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 32 and name HB1 ))
OR { 725}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 30 and name HB2 ))
OR { 725}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 30 and name HB2 ))
OR { 725}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 32 and name HB1 ))
ASSI { 726}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 32 and name HB2 ))
4.000 2.000 2.000 peak 726 weight 0.10000E+01 volume 0.70019E-03 ppm1 2.403 ppm2 1.813 CV 1
OR { 726}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 30 and name HB2 ))
OR { 726}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 30 and name HB2 ))
OR { 726}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 32 and name HB1 ))
ASSI { 727}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 30 and name HB1 ))
4.100 2.100 1.900 peak 727 weight 0.10000E+01 volume 0.73909E-03 ppm1 2.412 ppm2 1.768 CV 1
OR { 727}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 32 and name HB2 ))
OR { 727}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 30 and name HB2 ))
OR { 727}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 30 and name HB1 ))
OR { 727}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 30 and name HB2 ))
ASSI { 728}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 32 and name HB2 ))
3.900 1.900 1.900 peak 728 weight 0.10000E+01 volume 0.88172E-03 ppm1 2.357 ppm2 1.770 CV 1
OR { 728}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 30 and name HB2 ))
OR { 728}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 30 and name HB1 ))
OR { 728}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 32 and name HB2 ))
OR { 728}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 30 and name HB1 ))
OR { 728}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 30 and name HB2 ))
ASSI { 737}
(( segid "B " and resid 19 and name HB2 ))
(( segid "A " and resid 11 and name HG1 ))
4.200 2.200 1.800 peak 737 weight 0.10000E+01 volume 0.54460E-03 ppm1 2.762 ppm2 1.673 CV 1
OR { 737}
(( segid "B " and resid 19 and name HB2 ))
(( segid "B " and resid 20 and name HG1 ))
OR { 737}
(( segid "A " and resid 10 and name HB2 ))
(( segid "A " and resid 11 and name HG1 ))
ASSI { 738}
(( segid "A " and resid 10 and name HB2 ))
(( segid "A " and resid 9 and name HG1 ))
3.900 1.900 1.900 peak 738 weight 0.10000E+01 volume 0.53161E-03 ppm1 2.785 ppm2 1.645 CV 1
OR { 738}
(( segid "B " and resid 19 and name HB2 ))
(( segid "A " and resid 11 and name HG1 ))
ASSI { 740}
(( segid "B " and resid 19 and name HB1 ))
(( segid "A " and resid 11 and name HG1 ))
3.900 1.900 1.900 peak 740 weight 0.10000E+01 volume 0.49271E-03 ppm1 2.715 ppm2 1.641 CV 1
OR { 740}
(( segid "B " and resid 19 and name HB1 ))
(( segid "B " and resid 20 and name HG1 ))
ASSI { 748}
(( segid "B " and resid 22 and name HG1 ))
(( segid "B " and resid 22 and name HB2 ))
3.100 1.200 1.200 peak 748 weight 0.10000E+01 volume 0.93358E-03 ppm1 2.208 ppm2 1.934 CV 1
OR { 748}
(( segid "B " and resid 22 and name HG2 ))
(( segid "B " and resid 22 and name HB2 ))
OR { 748}
(( segid "B " and resid 27 and name HG2 ))
(( segid "B " and resid 27 and name HB1 ))
ASSI { 750}
(( segid "B " and resid 28 and name HG2 ))
(( segid "B " and resid 28 and name HB1 ))
3.100 1.200 1.200 peak 750 weight 0.10000E+01 volume 0.22432E-02 ppm1 2.366 ppm2 2.102 CV 1
OR { 750}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 29 and name HB2 ))
OR { 750}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 28 and name HB1 ))
ASSI { 751}
(( segid "A " and resid 1 and name HG2 ))
(( segid "A " and resid 1 and name HE1 ))
3.400 1.500 1.500 peak 751 weight 0.10000E+01 volume 0.19579E-02 ppm1 2.423 ppm2 2.087 CV 1
OR { 751}
(( segid "A " and resid 1 and name HG2 ))
(( segid "A " and resid 4 and name HB ))
ASSI { 755}
(( segid "A " and resid 8 and name HD1 ))
( segid "A " and resid 4 and name HG2%)
3.200 1.300 1.300 peak 755 weight 0.10000E+01 volume 0.26841E-02 ppm1 1.694 ppm2 0.977 CV 1
OR { 755}
(( segid "A " and resid 8 and name HD1 ))
( segid "A " and resid 4 and name HG1%)
OR { 755}
(( segid "A " and resid 3 and name HB2 ))
( segid "A " and resid 4 and name HG2%)
ASSI { 756}
(( segid "A " and resid 8 and name HD1 ))
( segid "A " and resid 4 and name HG2%)
3.100 1.200 1.200 peak 756 weight 0.10000E+01 volume 0.30731E-02 ppm1 1.693 ppm2 0.944 CV 1
OR { 756}
(( segid "B " and resid 12 and name HD2 ))
(( segid "B " and resid 13 and name HD11))
OR { 756}
(( segid "A " and resid 8 and name HD1 ))
( segid "A " and resid 4 and name HG1%)
ASSI { 758}
(( segid "B " and resid 14 and name HB2 ))
(( segid "B " and resid 14 and name HD11))
2.300 0.700 0.700 peak 758 weight 0.10000E+01 volume 0.65998E-02 ppm1 1.619 ppm2 0.955 CV 1
OR { 758}
(( segid "B " and resid 14 and name HG ))
(( segid "B " and resid 14 and name HD21))
OR { 758}
(( segid "B " and resid 14 and name HG ))
(( segid "B " and resid 14 and name HD11))
OR { 758}
(( segid "B " and resid 13 and name HG ))
(( segid "B " and resid 13 and name HD11))
OR { 758}
(( segid "B " and resid 13 and name HB2 ))
(( segid "B " and resid 13 and name HD11))
OR { 758}
(( segid "B " and resid 14 and name HB2 ))
(( segid "B " and resid 14 and name HD21))
ASSI { 759}
(( segid "B " and resid 14 and name HB2 ))
(( segid "B " and resid 14 and name HD11))
2.300 0.700 0.700 peak 759 weight 0.10000E+01 volume 0.59127E-02 ppm1 1.619 ppm2 0.917 CV 1
OR { 759}
(( segid "B " and resid 14 and name HG ))
(( segid "B " and resid 14 and name HD21))
OR { 759}
(( segid "B " and resid 14 and name HG ))
(( segid "B " and resid 14 and name HD11))
OR { 759}
(( segid "B " and resid 13 and name HG ))
(( segid "B " and resid 13 and name HD11))
OR { 759}
(( segid "B " and resid 14 and name HB2 ))
(( segid "B " and resid 14 and name HD21))
ASSI { 761}
(( segid "B " and resid 15 and name HB ))
(( segid "B " and resid 15 and name HG21))
2.800 1.000 1.000 peak 761 weight 0.10000E+01 volume 0.32805E-02 ppm1 1.828 ppm2 0.865 CV 1
OR { 761}
(( segid "B " and resid 17 and name HB ))
(( segid "B " and resid 17 and name HG21))
ASSI { 762}
(( segid "A " and resid 1 and name HB2 ))
( segid "A " and resid 4 and name HG1%)
2.500 0.800 0.800 peak 762 weight 0.10000E+01 volume 0.24506E-02 ppm1 1.880 ppm2 0.908 CV 1
OR { 762}
(( segid "B " and resid 17 and name HB ))
(( segid "B " and resid 17 and name HG21))
ASSI { 764}
(( segid "A " and resid 8 and name HB1 ))
( segid "A " and resid 4 and name HG2%)
4.100 2.100 1.900 peak 764 weight 0.10000E+01 volume 0.97248E-03 ppm1 1.804 ppm2 0.944 CV 1
OR { 764}
(( segid "A " and resid 8 and name HB1 ))
( segid "A " and resid 4 and name HG1%)
OR { 764}
(( segid "B " and resid 15 and name HB ))
( segid "A " and resid 4 and name HG2%)
ASSI { 765}
(( segid "B " and resid 21 and name HD2 ))
(( segid "B " and resid 17 and name HG21))
3.200 1.300 1.300 peak 765 weight 0.10000E+01 volume 0.13355E-02 ppm1 1.698 ppm2 0.912 CV 1
OR { 765}
(( segid "B " and resid 12 and name HD2 ))
(( segid "B " and resid 13 and name HD11))
OR { 765}
(( segid "A " and resid 8 and name HD1 ))
( segid "A " and resid 4 and name HG1%)
OR { 765}
(( segid "A " and resid 3 and name HB2 ))
( segid "A " and resid 4 and name HG1%)
ASSI { 766}
(( segid "B " and resid 21 and name HD2 ))
(( segid "B " and resid 17 and name HG21))
3.300 1.400 1.400 peak 766 weight 0.10000E+01 volume 0.11151E-02 ppm1 1.726 ppm2 0.899 CV 1
OR { 766}
(( segid "B " and resid 12 and name HD2 ))
(( segid "B " and resid 13 and name HD11))
ASSI { 767}
(( segid "B " and resid 21 and name HD2 ))
(( segid "B " and resid 17 and name HG21))
3.200 1.300 1.300 peak 767 weight 0.10000E+01 volume 0.15171E-02 ppm1 1.694 ppm2 0.869 CV 1
OR { 767}
(( segid "B " and resid 12 and name HD2 ))
(( segid "B " and resid 13 and name HD11))
OR { 767}
(( segid "A " and resid 11 and name HG1 ))
(( segid "B " and resid 15 and name HG21))
ASSI { 768}
(( segid "B " and resid 21 and name HD2 ))
(( segid "B " and resid 17 and name HG21))
3.200 1.300 1.300 peak 768 weight 0.10000E+01 volume 0.10762E-02 ppm1 1.712 ppm2 0.831 CV 1
OR { 768}
(( segid "B " and resid 21 and name HD2 ))
(( segid "B " and resid 17 and name HD11))
OR { 768}
(( segid "B " and resid 20 and name HG1 ))
(( segid "B " and resid 17 and name HD11))
OR { 768}
(( segid "A " and resid 3 and name HB2 ))
(( segid "B " and resid 15 and name HD11))
OR { 768}
(( segid "A " and resid 3 and name HB2 ))
(( segid "B " and resid 15 and name HG21))
ASSI { 769}
(( segid "B " and resid 14 and name HG ))
(( segid "B " and resid 15 and name HD11))
3.600 1.600 1.600 peak 769 weight 0.10000E+01 volume 0.18023E-02 ppm1 1.625 ppm2 0.845 CV 1
OR { 769}
(( segid "B " and resid 14 and name HG ))
(( segid "B " and resid 15 and name HG21))
OR { 769}
(( segid "B " and resid 14 and name HB2 ))
(( segid "B " and resid 15 and name HD11))
OR { 769}
(( segid "A " and resid 11 and name HG1 ))
(( segid "B " and resid 15 and name HG21))
ASSI { 771}
(( segid "B " and resid 12 and name HG2 ))
(( segid "B " and resid 13 and name HD11))
2.600 0.800 0.800 peak 771 weight 0.10000E+01 volume 0.21654E-02 ppm1 1.392 ppm2 0.862 CV 1
OR { 771}
(( segid "B " and resid 21 and name HG1 ))
(( segid "B " and resid 17 and name HG21))
OR { 771}
(( segid "A " and resid 8 and name HG1 ))
(( segid "B " and resid 15 and name HG21))
ASSI { 772}
(( segid "B " and resid 21 and name HG1 ))
(( segid "B " and resid 17 and name HG21))
2.900 1.100 1.100 peak 772 weight 0.10000E+01 volume 0.19968E-02 ppm1 1.399 ppm2 0.839 CV 1
OR { 772}
(( segid "B " and resid 21 and name HG1 ))
(( segid "B " and resid 17 and name HD11))
OR { 772}
(( segid "A " and resid 8 and name HG1 ))
(( segid "B " and resid 15 and name HD11))
OR { 772}
(( segid "B " and resid 12 and name HG2 ))
(( segid "B " and resid 15 and name HD11))
ASSI { 777}
(( segid "B " and resid 12 and name HG2 ))
(( segid "B " and resid 13 and name HD11))
2.900 1.000 1.000 peak 777 weight 0.10000E+01 volume 0.12059E-02 ppm1 1.442 ppm2 0.955 CV 1
OR { 777}
(( segid "B " and resid 12 and name HG2 ))
(( segid "B " and resid 14 and name HD21))
ASSI { 779}
(( segid "B " and resid 21 and name HG1 ))
(( segid "B " and resid 17 and name HD11))
3.200 1.300 1.300 peak 779 weight 0.10000E+01 volume 0.68723E-03 ppm1 1.414 ppm2 0.796 CV 1
OR { 779}
(( segid "B " and resid 12 and name HG2 ))
(( segid "B " and resid 15 and name HD11))
ASSI { 784}
( segid "B " and resid 15 and name HG1%)
(( segid "B " and resid 15 and name HD11))
2.700 0.900 0.900 peak 784 weight 0.10000E+01 volume 0.18801E-02 ppm1 1.143 ppm2 0.842 CV 1
OR { 784}
( segid "B " and resid 15 and name HG1%)
(( segid "B " and resid 15 and name HG21))
OR { 784}
( segid "B " and resid 17 and name HG1%)
(( segid "B " and resid 17 and name HG21))
ASSI { 785}
( segid "B " and resid 15 and name HG1%)
(( segid "B " and resid 15 and name HG21))
2.800 1.000 1.000 peak 785 weight 0.10000E+01 volume 0.23599E-02 ppm1 1.148 ppm2 0.864 CV 1
OR { 785}
( segid "B " and resid 17 and name HG1%)
(( segid "B " and resid 17 and name HG21))
ASSI { 789}
(( segid "B " and resid 17 and name HB ))
( segid "B " and resid 17 and name HG1%)
2.900 1.100 1.100 peak 789 weight 0.10000E+01 volume 0.10632E-02 ppm1 1.823 ppm2 1.142 CV 1
OR { 789}
(( segid "B " and resid 15 and name HB ))
( segid "B " and resid 15 and name HG1%)
ASSI { 793}
(( segid "B " and resid 21 and name HD2 ))
(( segid "B " and resid 21 and name HG1 ))
2.100 0.500 0.500 peak 793 weight 0.10000E+01 volume 0.11190E-01 ppm1 1.686 ppm2 1.356 CV 1
OR { 793}
(( segid "A " and resid 8 and name HD1 ))
(( segid "A " and resid 8 and name HG1 ))
OR { 793}
(( segid "B " and resid 34 and name HB2 ))
(( segid "B " and resid 34 and name HG2 ))
ASSI { 794}
(( segid "B " and resid 21 and name HD2 ))
(( segid "B " and resid 21 and name HG1 ))
2.000 0.500 0.500 peak 794 weight 0.10000E+01 volume 0.14535E-01 ppm1 1.686 ppm2 1.394 CV 1
OR { 794}
(( segid "A " and resid 8 and name HD1 ))
(( segid "A " and resid 8 and name HG1 ))
OR { 794}
(( segid "B " and resid 12 and name HD2 ))
(( segid "B " and resid 12 and name HG2 ))
ASSI { 795}
(( segid "A " and resid 8 and name HB1 ))
(( segid "A " and resid 8 and name HG1 ))
2.300 0.600 0.600 peak 795 weight 0.10000E+01 volume 0.68204E-02 ppm1 1.801 ppm2 1.395 CV 1
OR { 795}
(( segid "B " and resid 25 and name HB1 ))
(( segid "B " and resid 25 and name HG2 ))
OR { 795}
(( segid "B " and resid 21 and name HB2 ))
(( segid "B " and resid 21 and name HG1 ))
ASSI { 796}
(( segid "A " and resid 8 and name HB1 ))
(( segid "A " and resid 8 and name HG1 ))
2.300 0.600 0.600 peak 796 weight 0.10000E+01 volume 0.61591E-02 ppm1 1.797 ppm2 1.348 CV 1
OR { 796}
(( segid "B " and resid 21 and name HB2 ))
(( segid "B " and resid 21 and name HG1 ))
ASSI { 803}
(( segid "A " and resid 4 and name HB ))
(( segid "A " and resid 8 and name HG1 ))
4.100 2.100 1.900 peak 803 weight 0.10000E+01 volume 0.98545E-03 ppm1 2.093 ppm2 1.400 CV 1
OR { 803}
(( segid "A " and resid 4 and name HB ))
(( segid "B " and resid 12 and name HG2 ))
ASSI { 804}
(( segid "B " and resid 27 and name HB2 ))
(( segid "B " and resid 24 and name HB1 ))
3.500 1.600 1.600 peak 804 weight 0.10000E+01 volume 0.72613E-03 ppm1 1.996 ppm2 1.396 CV 1
OR { 804}
(( segid "B " and resid 22 and name HB2 ))
(( segid "A " and resid 8 and name HG1 ))
ASSI { 805}
(( segid "A " and resid 4 and name HB ))
(( segid "B " and resid 14 and name HG ))
3.500 1.500 1.500 peak 805 weight 0.10000E+01 volume 0.15041E-02 ppm1 2.084 ppm2 1.666 CV 1
OR { 805}
(( segid "A " and resid 4 and name HB ))
(( segid "A " and resid 3 and name HB2 ))
OR { 805}
(( segid "A " and resid 4 and name HB ))
(( segid "A " and resid 8 and name HD1 ))
OR { 805}
(( segid "A " and resid 1 and name HE1 ))
(( segid "B " and resid 14 and name HG ))
OR { 805}
(( segid "B " and resid 28 and name HB1 ))
(( segid "B " and resid 32 and name HG1 ))
ASSI { 806}
(( segid "B " and resid 29 and name HB2 ))
(( segid "B " and resid 30 and name HB1 ))
3.800 1.800 1.800 peak 806 weight 0.10000E+01 volume 0.10114E-02 ppm1 2.092 ppm2 1.712 CV 1
OR { 806}
(( segid "A " and resid 4 and name HB ))
(( segid "A " and resid 3 and name HB2 ))
OR { 806}
(( segid "A " and resid 4 and name HB ))
(( segid "A " and resid 8 and name HD1 ))
ASSI { 807}
(( segid "B " and resid 29 and name HB2 ))
(( segid "B " and resid 30 and name HB2 ))
3.800 1.800 1.800 peak 807 weight 0.10000E+01 volume 0.73909E-03 ppm1 2.106 ppm2 1.763 CV 1
OR { 807}
(( segid "A " and resid 4 and name HB ))
(( segid "A " and resid 8 and name HB1 ))
OR { 807}
(( segid "B " and resid 29 and name HB2 ))
(( segid "B " and resid 30 and name HB1 ))
OR { 807}
(( segid "B " and resid 28 and name HB1 ))
(( segid "B " and resid 32 and name HB2 ))
OR { 807}
(( segid "B " and resid 29 and name HB2 ))
(( segid "B " and resid 32 and name HB2 ))
ASSI { 809}
(( segid "A " and resid 4 and name HB ))
(( segid "A " and resid 1 and name HB2 ))
2.800 1.000 1.000 peak 809 weight 0.10000E+01 volume 0.10892E-02 ppm1 2.086 ppm2 1.886 CV 1
OR { 809}
(( segid "A " and resid 1 and name HE1 ))
(( segid "A " and resid 1 and name HB2 ))
ASSI { 812}
(( segid "B " and resid 27 and name HG1 ))
(( segid "B " and resid 27 and name HB2 ))
3.300 1.400 1.400 peak 812 weight 0.10000E+01 volume 0.71316E-03 ppm1 2.427 ppm2 2.008 CV 1
OR { 812}
(( segid "A " and resid 1 and name HG2 ))
(( segid "A " and resid 1 and name HE1 ))
ASSI { 813}
(( segid "B " and resid 18 and name HB1 ))
(( segid "B " and resid 22 and name HG1 ))
3.700 1.700 1.700 peak 813 weight 0.10000E+01 volume 0.92062E-03 ppm1 3.199 ppm2 2.278 CV 1
OR { 813}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 27 and name HG2 ))
OR { 813}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 27 and name HG2 ))
ASSI { 814}
(( segid "B " and resid 18 and name HB1 ))
(( segid "B " and resid 22 and name HG1 ))
3.800 1.800 1.800 peak 814 weight 0.10000E+01 volume 0.71316E-03 ppm1 3.190 ppm2 2.206 CV 1
OR { 814}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 27 and name HG2 ))
OR { 814}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 27 and name HG2 ))
OR { 814}
(( segid "B " and resid 18 and name HB1 ))
(( segid "B " and resid 22 and name HG2 ))
ASSI { 815}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 27 and name HG1 ))
4.000 2.000 2.000 peak 815 weight 0.10000E+01 volume 0.79096E-03 ppm1 3.171 ppm2 2.355 CV 1
OR { 815}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 29 and name HG2 ))
OR { 815}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 28 and name HG2 ))
ASSI { 819}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 27 and name HG1 ))
3.900 1.900 1.900 peak 819 weight 0.10000E+01 volume 0.76503E-03 ppm1 3.209 ppm2 2.422 CV 1
OR { 819}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 28 and name HG2 ))
OR { 819}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 27 and name HG1 ))
ASSI { 821}
(( segid "B " and resid 26 and name HB2 ))
(( segid "B " and resid 28 and name HG2 ))
4.400 2.400 1.600 peak 821 weight 0.10000E+01 volume 0.57053E-03 ppm1 3.114 ppm2 2.411 CV 1
OR { 821}
(( segid "B " and resid 23 and name HB2 ))
(( segid "B " and resid 27 and name HG1 ))
OR { 821}
(( segid "B " and resid 26 and name HB2 ))
(( segid "B " and resid 27 and name HG1 ))
ASSI { 825}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 29 and name HB2 ))
3.700 1.700 1.700 peak 825 weight 0.10000E+01 volume 0.99842E-03 ppm1 3.178 ppm2 2.082 CV 1
OR { 825}
(( segid "A " and resid 11 and name HE ))
(( segid "A " and resid 4 and name HB ))
ASSI { 826}
(( segid "B " and resid 26 and name HB2 ))
(( segid "B " and resid 29 and name HB2 ))
3.700 1.700 1.700 peak 826 weight 0.10000E+01 volume 0.77799E-03 ppm1 3.111 ppm2 2.083 CV 1
OR { 826}
(( segid "A " and resid 7 and name HB1 ))
(( segid "A " and resid 4 and name HB ))
ASSI { 827}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 29 and name HB2 ))
3.800 1.800 1.800 peak 827 weight 0.10000E+01 volume 0.11151E-02 ppm1 3.179 ppm2 2.050 CV 1
OR { 827}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 27 and name HB2 ))
OR { 827}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 27 and name HB2 ))
ASSI { 828}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 22 and name HB2 ))
4.100 2.100 1.900 peak 828 weight 0.10000E+01 volume 0.59647E-03 ppm1 3.210 ppm2 2.001 CV 1
OR { 828}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 27 and name HB2 ))
OR { 828}
(( segid "B " and resid 18 and name HB1 ))
(( segid "B " and resid 22 and name HB2 ))
OR { 828}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 27 and name HB2 ))
ASSI { 829}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 22 and name HB2 ))
4.200 2.200 1.800 peak 829 weight 0.10000E+01 volume 0.57053E-03 ppm1 3.180 ppm2 1.995 CV 1
OR { 829}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 27 and name HB2 ))
OR { 829}
(( segid "B " and resid 18 and name HB1 ))
(( segid "B " and resid 22 and name HB2 ))
OR { 829}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 27 and name HB2 ))
OR { 829}
(( segid "B " and resid 23 and name HB1 ))
(( segid "B " and resid 27 and name HB1 ))
OR { 829}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 27 and name HB1 ))
ASSI { 830}
(( segid "B " and resid 26 and name HB2 ))
(( segid "B " and resid 29 and name HB2 ))
3.800 1.800 1.800 peak 830 weight 0.10000E+01 volume 0.80392E-03 ppm1 3.136 ppm2 2.051 CV 1
OR { 830}
(( segid "A " and resid 7 and name HB1 ))
(( segid "A " and resid 4 and name HB ))
OR { 830}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 29 and name HB2 ))
OR { 830}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 27 and name HB2 ))
ASSI { 839}
(( segid "B " and resid 12 and name HE2 ))
(( segid "B " and resid 12 and name HB2 ))
4.300 2.300 1.700 peak 839 weight 0.10000E+01 volume 0.60943E-03 ppm1 2.960 ppm2 1.947 CV 1
OR { 839}
(( segid "A " and resid 8 and name HE2 ))
(( segid "B " and resid 22 and name HB2 ))
ASSI { 842}
(( segid "A " and resid 8 and name HE2 ))
(( segid "A " and resid 9 and name HB1 ))
4.300 2.400 1.700 peak 842 weight 0.10000E+01 volume 0.59647E-03 ppm1 2.961 ppm2 1.868 CV 1
OR { 842}
(( segid "B " and resid 12 and name HE2 ))
(( segid "B " and resid 12 and name HB2 ))
ASSI { 843}
(( segid "A " and resid 8 and name HE2 ))
(( segid "A " and resid 9 and name HB1 ))
3.200 1.300 1.300 peak 843 weight 0.10000E+01 volume 0.32415E-02 ppm1 2.998 ppm2 1.800 CV 1
OR { 843}
(( segid "A " and resid 8 and name HE2 ))
(( segid "A " and resid 8 and name HB1 ))
ASSI { 844}
(( segid "A " and resid 11 and name HE ))
(( segid "A " and resid 11 and name HB2 ))
2.400 0.700 0.700 peak 844 weight 0.10000E+01 volume 0.49271E-02 ppm1 3.191 ppm2 1.839 CV 1
OR { 844}
(( segid "A " and resid 9 and name HD2 ))
(( segid "A " and resid 9 and name HB1 ))
OR { 844}
(( segid "A " and resid 11 and name HD1 ))
(( segid "A " and resid 11 and name HB2 ))
OR { 844}
(( segid "A " and resid 9 and name HD1 ))
(( segid "A " and resid 9 and name HB1 ))
OR { 844}
(( segid "B " and resid 32 and name HD2 ))
(( segid "B " and resid 32 and name HB1 ))
ASSI { 845}
(( segid "B " and resid 32 and name HD2 ))
(( segid "B " and resid 32 and name HB2 ))
2.300 0.700 0.700 peak 845 weight 0.10000E+01 volume 0.57183E-02 ppm1 3.194 ppm2 1.761 CV 1
OR { 845}
(( segid "A " and resid 9 and name HD1 ))
(( segid "A " and resid 9 and name HB2 ))
OR { 845}
(( segid "A " and resid 9 and name HD2 ))
(( segid "A " and resid 9 and name HB2 ))
ASSI { 846}
(( segid "A " and resid 8 and name HE2 ))
(( segid "A " and resid 8 and name HD1 ))
1.700 0.400 0.500 peak 846 weight 0.10000E+01 volume 0.21135E-01 ppm1 2.995 ppm2 1.689 CV 1
OR { 846}
(( segid "B " and resid 12 and name HE2 ))
(( segid "B " and resid 12 and name HD2 ))
OR { 846}
(( segid "A " and resid 8 and name HE2 ))
(( segid "A " and resid 9 and name HB2 ))
ASSI { 847}
(( segid "A " and resid 8 and name HE2 ))
(( segid "A " and resid 8 and name HD1 ))
2.200 0.600 0.600 peak 847 weight 0.10000E+01 volume 0.73648E-02 ppm1 2.958 ppm2 1.656 CV 1
OR { 847}
(( segid "A " and resid 8 and name HE2 ))
(( segid "A " and resid 9 and name HG1 ))
ASSI { 849}
(( segid "A " and resid 2 and name HB2 ))
(( segid "A " and resid 3 and name HB2 ))
4.700 2.700 1.300 peak 849 weight 0.10000E+01 volume 0.58350E-03 ppm1 3.301 ppm2 1.746 CV 1
OR { 849}
(( segid "B " and resid 35 and name HB2 ))
(( segid "B " and resid 34 and name HB2 ))
ASSI { 852}
(( segid "B " and resid 18 and name HB1 ))
( segid "B " and resid 15 and name HG1%)
4.800 2.900 1.200 peak 852 weight 0.10000E+01 volume 0.50568E-03 ppm1 3.259 ppm2 1.146 CV 1
OR { 852}
(( segid "B " and resid 18 and name HB1 ))
( segid "B " and resid 17 and name HG1%)
OR { 852}
(( segid "A " and resid 2 and name HB2 ))
( segid "B " and resid 15 and name HG1%)
OR { 852}
(( segid "B " and resid 18 and name HB2 ))
( segid "B " and resid 17 and name HG1%)
ASSI { 857}
(( segid "B " and resid 15 and name HB ))
(( segid "A " and resid 3 and name HG2 ))
4.800 2.800 1.200 peak 857 weight 0.10000E+01 volume 0.51864E-03 ppm1 1.802 ppm2 1.091 CV 1
OR { 857}
(( segid "A " and resid 8 and name HB1 ))
(( segid "A " and resid 3 and name HG2 ))
ASSI { 858}
(( segid "B " and resid 12 and name HD2 ))
( segid "B " and resid 15 and name HG1%)
4.000 2.000 2.000 peak 858 weight 0.10000E+01 volume 0.10243E-02 ppm1 1.693 ppm2 1.205 CV 1
OR { 858}
(( segid "B " and resid 20 and name HG1 ))
( segid "B " and resid 17 and name HG1%)
OR { 858}
(( segid "A " and resid 3 and name HB2 ))
( segid "B " and resid 15 and name HG1%)
ASSI { 860}
(( segid "A " and resid 8 and name HG1 ))
(( segid "A " and resid 3 and name HG2 ))
4.600 2.700 1.400 peak 860 weight 0.10000E+01 volume 0.77799E-03 ppm1 1.388 ppm2 1.092 CV 1
OR { 860}
(( segid "B " and resid 12 and name HG2 ))
(( segid "A " and resid 3 and name HG2 ))
ASSI { 872}
(( segid "B " and resid 17 and name HA ))
(( segid "B " and resid 17 and name HD11))
3.400 1.500 1.500 peak 872 weight 0.10000E+01 volume 0.53161E-03 ppm1 4.042 ppm2 0.788 CV 1
OR { 872}
(( segid "A " and resid 4 and name HA ))
(( segid "B " and resid 15 and name HD11))
ASSI { 873}
(( segid "B " and resid 22 and name HG1 ))
(( segid "B " and resid 15 and name HG21))
2.700 2.700 3.300 peak 873 weight 0.10000E+01 volume 0.55757E-03 ppm1 2.269 ppm2 0.878 CV 1
OR { 873}
(( segid "B " and resid 22 and name HG1 ))
(( segid "B " and resid 17 and name HG21))
ASSI { 883}
(( segid "B " and resid 17 and name HB ))
(( segid "B " and resid 17 and name HG21))
3.400 1.400 1.400 peak 883 weight 0.10000E+01 volume 0.11410E-02 ppm1 1.871 ppm2 0.835 CV 1
OR { 883}
(( segid "B " and resid 20 and name HB2 ))
(( segid "B " and resid 17 and name HD11))
OR { 883}
(( segid "B " and resid 17 and name HB ))
(( segid "B " and resid 17 and name HD11))
ASSI { 884}
(( segid "B " and resid 17 and name HB ))
(( segid "B " and resid 17 and name HD11))
3.900 1.900 1.900 peak 884 weight 0.10000E+01 volume 0.75206E-03 ppm1 1.827 ppm2 0.804 CV 1
OR { 884}
(( segid "B " and resid 15 and name HB ))
(( segid "B " and resid 15 and name HD11))
ASSI { 885}
(( segid "A " and resid 8 and name HB1 ))
(( segid "B " and resid 15 and name HD11))
4.300 2.300 1.700 peak 885 weight 0.10000E+01 volume 0.38898E-03 ppm1 1.772 ppm2 0.818 CV 1
OR { 885}
(( segid "B " and resid 15 and name HB ))
(( segid "B " and resid 15 and name HD11))
ASSI { 887}
(( segid "B " and resid 14 and name HG ))
(( segid "B " and resid 15 and name HD11))
4.100 2.100 1.900 peak 887 weight 0.10000E+01 volume 0.71316E-03 ppm1 1.621 ppm2 0.806 CV 1
OR { 887}
(( segid "B " and resid 20 and name HG1 ))
(( segid "B " and resid 17 and name HD11))
ASSI { 888}
(( segid "B " and resid 21 and name HD2 ))
(( segid "B " and resid 17 and name HD11))
3.700 1.700 1.700 peak 888 weight 0.10000E+01 volume 0.60943E-03 ppm1 1.727 ppm2 0.806 CV 1
OR { 888}
(( segid "A " and resid 3 and name HB2 ))
(( segid "B " and resid 15 and name HD11))
OR { 888}
(( segid "B " and resid 12 and name HD2 ))
(( segid "B " and resid 15 and name HD11))
ASSI { 894}
(( segid "A " and resid 8 and name HD1 ))
(( segid "A " and resid 8 and name HG1 ))
2.400 0.700 0.700 peak 894 weight 0.10000E+01 volume 0.31248E-02 ppm1 1.641 ppm2 1.307 CV 1
OR { 894}
(( segid "B " and resid 34 and name HD1 ))
(( segid "B " and resid 34 and name HG2 ))
ASSI { 900}
(( segid "A " and resid 3 and name HD1 ))
(( segid "B " and resid 12 and name HG2 ))
3.600 1.600 1.600 peak 900 weight 0.10000E+01 volume 0.18542E-02 ppm1 1.558 ppm2 1.413 CV 1
OR { 900}
(( segid "B " and resid 30 and name HG1 ))
(( segid "B " and resid 31 and name HB1 ))
OR { 900}
(( segid "B " and resid 13 and name HG ))
(( segid "B " and resid 12 and name HG2 ))
ASSI { 901}
(( segid "B " and resid 14 and name HG ))
(( segid "B " and resid 12 and name HG2 ))
3.700 1.700 1.700 peak 901 weight 0.10000E+01 volume 0.10243E-02 ppm1 1.627 ppm2 1.463 CV 1
OR { 901}
(( segid "B " and resid 13 and name HG ))
(( segid "B " and resid 12 and name HG2 ))
OR { 901}
(( segid "B " and resid 13 and name HB2 ))
(( segid "B " and resid 12 and name HG2 ))
OR { 901}
(( segid "B " and resid 32 and name HG1 ))
(( segid "B " and resid 33 and name HB1 ))
OR { 901}
(( segid "B " and resid 25 and name HD2 ))
(( segid "B " and resid 24 and name HB1 ))
ASSI { 904}
(( segid "B " and resid 32 and name HB1 ))
(( segid "B " and resid 32 and name HG1 ))
2.200 0.600 0.600 peak 904 weight 0.10000E+01 volume 0.11034E-01 ppm1 1.839 ppm2 1.647 CV 1
OR { 904}
(( segid "A " and resid 11 and name HB2 ))
(( segid "A " and resid 11 and name HG1 ))
OR { 904}
(( segid "A " and resid 9 and name HB1 ))
(( segid "A " and resid 9 and name HG1 ))
OR { 904}
(( segid "B " and resid 21 and name HB2 ))
(( segid "B " and resid 21 and name HD2 ))
ASSI { 905}
(( segid "B " and resid 34 and name HB2 ))
(( segid "B " and resid 34 and name HD1 ))
2.000 0.500 0.500 peak 905 weight 0.10000E+01 volume 0.14068E-01 ppm1 1.756 ppm2 1.631 CV 1
OR { 905}
(( segid "A " and resid 9 and name HB2 ))
(( segid "A " and resid 9 and name HG1 ))
OR { 905}
(( segid "B " and resid 32 and name HB2 ))
(( segid "B " and resid 32 and name HG1 ))
OR { 905}
(( segid "B " and resid 25 and name HB1 ))
(( segid "B " and resid 25 and name HD2 ))
ASSI { 908}
(( segid "B " and resid 27 and name HB2 ))
(( segid "B " and resid 25 and name HD2 ))
4.000 2.000 2.000 peak 908 weight 0.10000E+01 volume 0.49271E-03 ppm1 1.999 ppm2 1.661 CV 1
OR { 908}
(( segid "B " and resid 22 and name HB2 ))
(( segid "B " and resid 25 and name HD2 ))
ASSI { 909}
(( segid "B " and resid 27 and name HB1 ))
(( segid "B " and resid 30 and name HG1 ))
4.100 2.100 1.900 peak 909 weight 0.10000E+01 volume 0.55757E-03 ppm1 1.965 ppm2 1.599 CV 1
OR { 909}
(( segid "B " and resid 22 and name HB2 ))
(( segid "B " and resid 25 and name HD2 ))
OR { 909}
(( segid "B " and resid 27 and name HB1 ))
(( segid "B " and resid 25 and name HD2 ))
ASSI { 912}
(( segid "A " and resid 4 and name HB ))
(( segid "A " and resid 3 and name HD1 ))
4.300 2.300 1.700 peak 912 weight 0.10000E+01 volume 0.73909E-03 ppm1 2.079 ppm2 1.540 CV 1
OR { 912}
(( segid "B " and resid 29 and name HB2 ))
(( segid "B " and resid 33 and name HB1 ))
ASSI { 913}
(( segid "A " and resid 4 and name HB ))
(( segid "A " and resid 3 and name HD1 ))
4.400 2.500 1.600 peak 913 weight 0.10000E+01 volume 0.75206E-03 ppm1 2.084 ppm2 1.585 CV 1
OR { 913}
(( segid "A " and resid 4 and name HB ))
(( segid "B " and resid 14 and name HG ))
OR { 913}
(( segid "B " and resid 29 and name HB2 ))
(( segid "B " and resid 30 and name HG1 ))
ASSI { 916}
(( segid "B " and resid 27 and name HB1 ))
(( segid "B " and resid 31 and name HB1 ))
3.600 1.600 1.600 peak 916 weight 0.10000E+01 volume 0.46678E-03 ppm1 1.958 ppm2 1.340 CV 1
OR { 916}
(( segid "B " and resid 20 and name HB2 ))
(( segid "B " and resid 21 and name HG1 ))
OR { 916}
(( segid "B " and resid 22 and name HB2 ))
(( segid "A " and resid 8 and name HG1 ))
ASSI { 920}
(( segid "B " and resid 21 and name HD2 ))
(( segid "B " and resid 17 and name HD11))
4.100 2.100 1.900 peak 920 weight 0.10000E+01 volume 0.45381E-03 ppm1 1.680 ppm2 0.767 CV 1
OR { 920}
(( segid "B " and resid 14 and name HB2 ))
(( segid "B " and resid 15 and name HD11))
OR { 920}
(( segid "B " and resid 20 and name HG1 ))
(( segid "B " and resid 17 and name HD11))
OR { 920}
(( segid "A " and resid 3 and name HB2 ))
(( segid "B " and resid 15 and name HD11))
ASSI { 922}
(( segid "A " and resid 7 and name HB2 ))
(( segid "B " and resid 15 and name HD11))
4.300 2.300 1.700 peak 922 weight 0.10000E+01 volume 0.53161E-03 ppm1 2.999 ppm2 0.814 CV 1
OR { 922}
(( segid "B " and resid 12 and name HE2 ))
(( segid "B " and resid 15 and name HD11))
ASSI { 927}
(( segid "B " and resid 19 and name HB2 ))
(( segid "B " and resid 21 and name HG1 ))
4.800 2.900 1.200 peak 927 weight 0.10000E+01 volume 0.38898E-03 ppm1 2.813 ppm2 1.403 CV 1
OR { 927}
(( segid "A " and resid 10 and name HB1 ))
(( segid "B " and resid 12 and name HG2 ))
ASSI { 928}
(( segid "B " and resid 19 and name HB1 ))
(( segid "B " and resid 21 and name HG1 ))
4.300 2.300 1.700 peak 928 weight 0.10000E+01 volume 0.63536E-03 ppm1 2.737 ppm2 1.398 CV 1
OR { 928}
(( segid "B " and resid 19 and name HB2 ))
(( segid "B " and resid 21 and name HG1 ))
OR { 928}
(( segid "B " and resid 19 and name HB2 ))
(( segid "A " and resid 8 and name HG1 ))
ASSI { 934}
(( segid "A " and resid 3 and name HE1 ))
(( segid "B " and resid 15 and name HB ))
4.500 2.600 1.500 peak 934 weight 0.10000E+01 volume 0.44085E-03 ppm1 2.840 ppm2 1.831 CV 1
OR { 934}
(( segid "A " and resid 10 and name HB1 ))
(( segid "A " and resid 11 and name HB2 ))
ASSI { 935}
(( segid "B " and resid 23 and name HB2 ))
(( segid "B " and resid 22 and name HB2 ))
3.900 1.900 1.900 peak 935 weight 0.10000E+01 volume 0.44085E-03 ppm1 3.090 ppm2 1.946 CV 1
OR { 935}
(( segid "A " and resid 7 and name HB1 ))
(( segid "A " and resid 11 and name HB1 ))
OR { 935}
(( segid "B " and resid 26 and name HB2 ))
(( segid "B " and resid 27 and name HB1 ))
OR { 935}
(( segid "B " and resid 23 and name HB2 ))
(( segid "B " and resid 27 and name HB1 ))
ASSI { 936}
(( segid "A " and resid 7 and name HB1 ))
(( segid "A " and resid 11 and name HB1 ))
4.300 2.300 1.700 peak 936 weight 0.10000E+01 volume 0.53161E-03 ppm1 3.122 ppm2 1.911 CV 1
OR { 936}
(( segid "B " and resid 26 and name HB2 ))
(( segid "B " and resid 27 and name HB1 ))
OR { 936}
(( segid "B " and resid 26 and name HB1 ))
(( segid "B " and resid 27 and name HB1 ))
ASSI { 938}
(( segid "B " and resid 18 and name HB2 ))
(( segid "B " and resid 21 and name HB2 ))
4.300 2.300 1.700 peak 938 weight 0.10000E+01 volume 0.59647E-03 ppm1 3.302 ppm2 1.829 CV 1
OR { 938}
(( segid "B " and resid 18 and name HB2 ))
(( segid "A " and resid 8 and name HB1 ))
OR { 938}
(( segid "B " and resid 18 and name HB2 ))
(( segid "B " and resid 15 and name HB ))
OR { 938}
(( segid "A " and resid 2 and name HB2 ))
(( segid "B " and resid 15 and name HB ))
ASSI { 941}
(( segid "B " and resid 18 and name HB2 ))
(( segid "B " and resid 22 and name HB2 ))
4.500 2.500 1.500 peak 941 weight 0.10000E+01 volume 0.41492E-03 ppm1 3.295 ppm2 1.958 CV 1
OR { 941}
(( segid "B " and resid 18 and name HB2 ))
(( segid "B " and resid 20 and name HB2 ))
ASSI { 945}
(( segid "B " and resid 13 and name HA ))
(( segid "B " and resid 15 and name HB ))
3.700 1.700 1.700 peak 945 weight 0.10000E+01 volume 0.60943E-03 ppm1 4.365 ppm2 1.816 CV 1
OR { 945}
(( segid "B " and resid 16 and name HA ))
(( segid "B " and resid 15 and name HB ))
OR { 945}
(( segid "B " and resid 16 and name HA ))
(( segid "B " and resid 17 and name HB ))
ASSI { 956}
(( segid "B " and resid 19 and name HA ))
(( segid "A " and resid 8 and name HA ))
4.000 2.000 2.000 peak 956 weight 0.10000E+01 volume 0.47975E-03 ppm1 4.616 ppm2 4.237 CV 1
OR { 956}
(( segid "A " and resid 2 and name HA ))
(( segid "A " and resid 1 and name HA ))
OR { 956}
(( segid "B " and resid 19 and name HA ))
(( segid "B " and resid 20 and name HA ))
OR { 956}
(( segid "B " and resid 19 and name HA ))
(( segid "B " and resid 22 and name HA ))
OR { 956}
(( segid "B " and resid 18 and name HA ))
(( segid "B " and resid 21 and name HA ))
ASSI { 958}
(( segid "B " and resid 18 and name HA ))
(( segid "B " and resid 14 and name HB2 ))
4.600 2.700 1.400 peak 958 weight 0.10000E+01 volume 0.37602E-03 ppm1 4.620 ppm2 1.640 CV 1
OR { 958}
(( segid "B " and resid 19 and name HA ))
(( segid "B " and resid 20 and name HG1 ))
OR { 958}
(( segid "B " and resid 19 and name HA ))
(( segid "A " and resid 11 and name HG1 ))
ASSI { 959}
(( segid "A " and resid 2 and name HA ))
(( segid "A " and resid 4 and name HB ))
4.300 2.300 1.700 peak 959 weight 0.10000E+01 volume 0.72613E-03 ppm1 4.623 ppm2 2.048 CV 1
OR { 959}
(( segid "A " and resid 2 and name HA ))
(( segid "A " and resid 1 and name HE1 ))
ASSI { 3}
( segid "A " and resid 7 and name HE% )
(( segid "A " and resid 7 and name HA ))
3.300 1.400 1.400 peak 3 weight 0.10000E+01 volume 0.26710E-02 ppm1 7.362 ppm2 4.550 CV 1
OR { 3}
( segid "B " and resid 23 and name HE% )
(( segid "B " and resid 23 and name HA ))
ASSI { 30}
(( segid "A " and resid 3 and name HN ))
(( segid "A " and resid 2 and name HB2 ))
2.300 0.600 0.600 peak 30 weight 0.10000E+01 volume 0.75206E-03 ppm1 7.668 ppm2 3.300 CV 1
OR { 30}
(( segid "B " and resid 35 and name HE3 ))
(( segid "B " and resid 35 and name HB2 ))
ASSI { 49}
( segid "A " and resid 7 and name HE% )
(( segid "A " and resid 7 and name HB1 ))
3.500 1.500 1.500 peak 49 weight 0.10000E+01 volume 0.26061E-02 ppm1 7.361 ppm2 3.112 CV 1
OR { 49}
( segid "B " and resid 26 and name HE% )
(( segid "B " and resid 26 and name HB2 ))
ASSI { 73}
( segid "B " and resid 23 and name HE% )
(( segid "B " and resid 23 and name HB1 ))
3.800 1.800 1.800 peak 73 weight 0.10000E+01 volume 0.19320E-02 ppm1 7.356 ppm2 3.201 CV 1
OR { 73}
( segid "B " and resid 26 and name HE% )
(( segid "B " and resid 26 and name HB1 ))
ASSI { 80}
(( segid "A " and resid 7 and name HZ ))
(( segid "A " and resid 10 and name HB1 ))
4.300 2.300 1.700 peak 80 weight 0.10000E+01 volume 0.66130E-03 ppm1 7.330 ppm2 2.893 CV 1
OR { 80}
(( segid "A " and resid 7 and name HZ ))
(( segid "A " and resid 3 and name HE1 ))
ASSI { 82}
( segid "B " and resid 26 and name HE% )
(( segid "B " and resid 27 and name HG2 ))
3.300 1.400 1.400 peak 82 weight 0.10000E+01 volume 0.67426E-03 ppm1 7.332 ppm2 2.276 CV 1
OR { 82}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 22 and name HG1 ))
ASSI { 104}
( segid "A " and resid 6 and name HE% )
( segid "A " and resid 4 and name HG1%)
2.000 2.000 4.000 peak 104 weight 0.10000E+01 volume 0.31248E-02 ppm1 7.323 ppm2 0.946 CV 1
OR { 104}
(( segid "B " and resid 18 and name HD1 ))
( segid "A " and resid 4 and name HG1%)
ASSI { 114}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 15 and name HD13))
3.000 1.100 1.100 peak 114 weight 0.10000E+01 volume 0.15171E-02 ppm1 7.315 ppm2 0.868 CV 1
OR { 114}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 15 and name HD13))
OR { 114}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 14 and name HD12))
OR { 114}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 15 and name HD11))
OR { 114}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 15 and name HD11))
OR { 114}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 14 and name HD11))
OR { 114}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 15 and name HD12))
OR { 114}
(( segid "B " and resid 18 and name HD1 ))
(( segid "B " and resid 15 and name HD12))
ASSI { 123}
( segid "B " and resid 26 and name HD% )
(( segid "B " and resid 26 and name HB2 ))
3.000 1.100 1.100 peak 123 weight 0.10000E+01 volume 0.15560E-02 ppm1 7.262 ppm2 3.081 CV 1
OR { 123}
( segid "B " and resid 23 and name HD% )
(( segid "B " and resid 23 and name HB2 ))
ASSI { 127}
( segid "A " and resid 7 and name HD% )
(( segid "A " and resid 4 and name HB ))
3.500 3.500 2.500 peak 127 weight 0.10000E+01 volume 0.31896E-02 ppm1 7.263 ppm2 2.049 CV 1
OR { 127}
(( segid "A " and resid 2 and name HD1 ))
(( segid "A " and resid 4 and name HB ))
ASSI { 155}
( segid "A " and resid 7 and name HD% )
(( segid "A " and resid 8 and name HG1 ))
3.900 1.900 1.900 peak 155 weight 0.10000E+01 volume 0.11670E-02 ppm1 7.251 ppm2 1.357 CV 1
OR { 155}
(( segid "B " and resid 35 and name HD1 ))
(( segid "B " and resid 33 and name HB2 ))
ASSI { 156}
( segid "A " and resid 7 and name HD% )
(( segid "A " and resid 7 and name HB1 ))
2.100 0.600 0.600 peak 156 weight 0.10000E+01 volume 0.62240E-02 ppm1 7.242 ppm2 3.118 CV 1
OR { 156}
( segid "B " and resid 26 and name HD% )
(( segid "B " and resid 26 and name HB2 ))
ASSI { 189}
(( segid "B " and resid 23 and name HA ))
(( segid "B " and resid 22 and name HB2 ))
3.900 1.900 1.900 peak 189 weight 0.10000E+01 volume 0.76503E-03 ppm1 4.560 ppm2 1.886 CV 1
OR { 189}
(( segid "A " and resid 7 and name HA ))
(( segid "A " and resid 11 and name HB1 ))
ASSI { 191}
(( segid "B " and resid 26 and name HA ))
(( segid "B " and resid 25 and name HB1 ))
3.400 1.500 1.500 peak 191 weight 0.10000E+01 volume 0.82986E-03 ppm1 4.562 ppm2 1.767 CV 1
OR { 191}
(( segid "B " and resid 26 and name HA ))
(( segid "B " and resid 30 and name HB1 ))
ASSI { 205}
(( segid "B " and resid 23 and name HA ))
(( segid "B " and resid 25 and name HB1 ))
3.400 1.400 1.400 peak 205 weight 0.10000E+01 volume 0.10762E-02 ppm1 4.550 ppm2 1.792 CV 1
OR { 205}
(( segid "B " and resid 26 and name HA ))
(( segid "B " and resid 25 and name HB1 ))
ASSI { 208}
(( segid "B " and resid 23 and name HA ))
(( segid "B " and resid 25 and name HD2 ))
3.000 1.100 1.100 peak 208 weight 0.10000E+01 volume 0.11670E-02 ppm1 4.552 ppm2 1.636 CV 1
OR { 208}
(( segid "B " and resid 26 and name HA ))
(( segid "B " and resid 25 and name HD2 ))
ASSI { 209}
(( segid "B " and resid 23 and name HA ))
(( segid "B " and resid 25 and name HG2 ))
3.800 1.800 1.800 peak 209 weight 0.10000E+01 volume 0.98545E-03 ppm1 4.550 ppm2 1.399 CV 1
OR { 209}
(( segid "B " and resid 26 and name HA ))
(( segid "B " and resid 25 and name HG2 ))
ASSI { 238}
(( segid "A " and resid 11 and name HA ))
(( segid "A " and resid 11 and name HG1 ))
2.600 0.800 0.800 peak 238 weight 0.10000E+01 volume 0.96339E-02 ppm1 4.285 ppm2 1.634 CV 1
OR { 238}
(( segid "A " and resid 9 and name HA ))
(( segid "A " and resid 9 and name HG1 ))
ASSI { 244}
(( segid "B " and resid 21 and name HA ))
(( segid "B " and resid 22 and name HB2 ))
3.500 1.500 1.500 peak 244 weight 0.10000E+01 volume 0.18412E-02 ppm1 4.257 ppm2 1.996 CV 1
OR { 244}
(( segid "B " and resid 20 and name HA ))
(( segid "B " and resid 22 and name HB2 ))
ASSI { 262}
(( segid "A " and resid 8 and name HA ))
(( segid "A " and resid 8 and name HB1 ))
2.200 0.600 0.600 peak 262 weight 0.10000E+01 volume 0.10697E-01 ppm1 4.233 ppm2 1.796 CV 1
OR { 262}
(( segid "B " and resid 21 and name HA ))
(( segid "B " and resid 21 and name HB2 ))
ASSI { 265}
(( segid "B " and resid 21 and name HA ))
(( segid "B " and resid 24 and name HB3 ))
2.400 0.700 0.700 peak 265 weight 0.10000E+01 volume 0.79354E-02 ppm1 4.234 ppm2 1.394 CV 1
OR { 265}
(( segid "B " and resid 21 and name HA ))
(( segid "B " and resid 21 and name HG1 ))
OR { 265}
(( segid "B " and resid 21 and name HA ))
(( segid "B " and resid 24 and name HB2 ))
ASSI { 291}
(( segid "B " and resid 30 and name HA ))
(( segid "B " and resid 30 and name HG1 ))
2.300 0.700 0.700 peak 291 weight 0.10000E+01 volume 0.10827E-01 ppm1 4.182 ppm2 1.545 CV 1
OR { 291}
(( segid "A " and resid 3 and name HA ))
(( segid "A " and resid 3 and name HD1 ))
ASSI { 343}
(( segid "B " and resid 20 and name HD2 ))
(( segid "B " and resid 20 and name HB2 ))
2.200 0.600 0.600 peak 343 weight 0.10000E+01 volume 0.49271E-02 ppm1 3.204 ppm2 1.911 CV 1
OR { 343}
(( segid "A " and resid 11 and name HE ))
(( segid "A " and resid 11 and name HB1 ))
ASSI { 369}
(( segid "B " and resid 12 and name HA ))
(( segid "B " and resid 15 and name HD12))
4.100 2.100 1.900 peak 369 weight 0.10000E+01 volume 0.80392E-03 ppm1 4.031 ppm2 0.847 CV 1
OR { 369}
(( segid "B " and resid 12 and name HA ))
(( segid "B " and resid 14 and name HD13))
OR { 369}
(( segid "B " and resid 12 and name HA ))
(( segid "B " and resid 14 and name HD12))
OR { 369}
(( segid "B " and resid 12 and name HA ))
(( segid "B " and resid 15 and name HD13))
OR { 369}
(( segid "B " and resid 12 and name HA ))
(( segid "B " and resid 15 and name HD11))
ASSI { 429}
(( segid "A " and resid 6 and name HA ))
(( segid "A " and resid 3 and name HA ))
3.900 3.900 2.100 peak 429 weight 0.10000E+01 volume 0.95952E-03 ppm1 4.509 ppm2 4.178 CV 1
OR { 429}
(( segid "A " and resid 6 and name HA ))
(( segid "A " and resid 8 and name HA ))
ASSI { 446}
( segid "B " and resid 26 and name HD% )
(( segid "B " and resid 27 and name HA ))
4.100 2.100 1.900 peak 446 weight 0.10000E+01 volume 0.54460E-03 ppm1 7.264 ppm2 4.132 CV 1
OR { 446}
( segid "B " and resid 26 and name HD% )
(( segid "B " and resid 25 and name HA ))
ASSI { 626}
(( segid "B " and resid 20 and name HA ))
(( segid "B " and resid 19 and name HB2 ))
4.300 2.300 1.700 peak 626 weight 0.10000E+01 volume 0.55757E-03 ppm1 4.238 ppm2 2.777 CV 1
OR { 626}
(( segid "A " and resid 9 and name HA ))
(( segid "A " and resid 10 and name HB2 ))
ASSI { 640}
(( segid "A " and resid 11 and name HA ))
( segid "B " and resid 15 and name HG1%)
4.600 2.600 1.400 peak 640 weight 0.10000E+01 volume 0.66130E-03 ppm1 4.297 ppm2 1.146 CV 1
OR { 640}
(( segid "B " and resid 20 and name HA ))
( segid "B " and resid 17 and name HG1%)
ASSI { 716}
(( segid "B " and resid 27 and name HG2 ))
(( segid "B " and resid 25 and name HD2 ))
3.700 1.700 1.700 peak 716 weight 0.10000E+01 volume 0.76503E-03 ppm1 2.280 ppm2 1.624 CV 1
OR { 716}
(( segid "B " and resid 27 and name HG2 ))
(( segid "B " and resid 30 and name HG1 ))
ASSI { 729}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 32 and name HB2 ))
3.900 1.900 1.900 peak 729 weight 0.10000E+01 volume 0.72613E-03 ppm1 2.359 ppm2 1.725 CV 1
OR { 729}
(( segid "B " and resid 29 and name HG2 ))
(( segid "B " and resid 30 and name HB1 ))
ASSI { 743}
(( segid "B " and resid 19 and name HB1 ))
(( segid "B " and resid 20 and name HB2 ))
4.500 2.500 1.500 peak 743 weight 0.10000E+01 volume 0.41492E-03 ppm1 2.728 ppm2 1.934 CV 1
OR { 743}
(( segid "B " and resid 19 and name HB1 ))
(( segid "B " and resid 22 and name HB2 ))
ASSI { 808}
(( segid "B " and resid 22 and name HG2 ))
(( segid "B " and resid 21 and name HB2 ))
3.300 1.400 1.400 peak 808 weight 0.10000E+01 volume 0.71316E-03 ppm1 2.123 ppm2 1.832 CV 1
OR { 808}
(( segid "B " and resid 28 and name HB1 ))
(( segid "B " and resid 32 and name HB1 ))
ASSI { 868}
(( segid "A " and resid 9 and name HA ))
(( segid "B " and resid 22 and name HG1 ))
4.100 2.100 1.900 peak 868 weight 0.10000E+01 volume 0.71316E-03 ppm1 4.298 ppm2 2.256 CV 1
OR { 868}
(( segid "B " and resid 20 and name HA ))
(( segid "B " and resid 22 and name HG1 ))
Contact the webmaster for help, if required. Thursday, May 2, 2024 1:33:43 PM GMT (wattos1)